data_1pv3_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 1pv3 _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.775 ' HB2' HG23 ' A' ' 968' ' ' THR . 33.4 mmtp . . . . . 0 C--O 1.226 -0.153 0 N-CA-C 111.711 0.263 . . . . 0.0 111.711 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.587 ' O ' HG21 ' A' ' 929' ' ' VAL . 16.6 m -55.38 -31.84 28.15 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.396 0 CA-C-O 121.02 0.438 . . . . 0.0 110.528 175.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . 0.445 ' CB ' HD11 ' A' 1036 ' ' LEU . 0.0 OUTLIER -77.79 -32.76 52.6 Favored 'General case' 0 CA--C 1.501 -0.938 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.585 177.175 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -77.53 -23.94 50.04 Favored 'General case' 0 C--N 1.3 -1.558 0 C-N-CA 118.261 -1.376 . . . . 0.0 112.397 178.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.508 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 2.7 m120 -72.44 -30.19 64.37 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 121.863 0.839 . . . . 0.0 108.848 171.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.587 HG21 ' O ' ' A' ' 925' ' ' VAL . 90.2 t -79.51 -28.45 13.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 114.666 -1.152 . . . . 0.0 110.362 176.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.589 ' O ' ' HD2' ' A' ' 934' ' ' LYS . 53.2 m -57.47 -49.26 76.84 Favored 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 119.561 -0.856 . . . . 0.0 108.786 170.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -64.11 -51.4 53.33 Favored Glycine 0 CA--C 1.525 0.707 0 CA-C-N 115.355 -0.838 . . . . 0.0 113.459 177.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.476 HD22 ' HA ' ' A' ' 929' ' ' VAL . 0.3 OUTLIER -61.91 -49.02 77.85 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 112.751 0.648 . . . . 0.0 112.751 -175.882 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.454 HG21 ' HA ' ' A' 1029 ' ' ALA . 53.0 t -70.17 -38.27 74.26 Favored 'Isoleucine or valine' 0 C--O 1.24 0.576 0 CA-C-O 120.947 0.403 . . . . 0.0 111.446 -174.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.589 ' HD2' ' O ' ' A' ' 930' ' ' THR . 0.2 OUTLIER -58.92 -37.15 76.01 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.492 179.208 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.48 ' HA ' ' SD ' ' A' ' 939' ' ' MET . . . -64.03 -42.01 97.22 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.607 -0.269 . . . . 0.0 111.066 177.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.75 HG21 ' HB3' ' A' 1025 ' ' ALA . 99.3 t -47.55 -69.79 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.065 -178.148 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 26.7 pt -71.95 -39.76 67.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 N-CA-C 112.489 0.551 . . . . 0.0 112.489 -176.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -72.52 -52.19 16.76 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 119.722 -0.791 . . . . 0.0 111.37 -173.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.48 ' SD ' ' HA ' ' A' ' 935' ' ' ALA . 1.0 OUTLIER -68.59 -24.78 64.63 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.252 -0.579 . . . . 0.0 109.57 -179.065 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.733 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 8.7 p . . . . . 0 C--O 1.224 -0.289 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.206 -179.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.934 ' HB3' ' HG2' ' A' 1002 ' ' MET . 22.4 m-85 . . . . . 0 CA--C 1.538 0.517 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 0.587 ' O ' ' HB ' ' A' ' 955' ' ' VAL . 45.8 t -50.57 -43.13 79.9 Favored Pre-proline 0 C--N 1.322 -0.63 0 C-N-CA 122.861 0.464 . . . . 0.0 111.703 173.43 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 0.628 ' O ' ' HB3' ' A' ' 956' ' ' LYS . 24.3 Cg_exo -49.31 -43.05 39.14 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 122.022 1.815 . . . . 0.0 112.831 172.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.407 ' O ' HG12 ' A' ' 958' ' ' VAL . 21.2 ttt -76.26 -31.09 58.11 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.566 176.287 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.587 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 78.9 t -52.96 -35.77 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 167.741 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.628 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 11.1 tmtt? -66.58 -36.43 82.61 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.119 172.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -76.93 -47.0 22.24 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.908 0.385 . . . . 0.0 111.554 -174.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.598 HG22 HD23 ' A' ' 962' ' ' LEU . 14.1 p -85.4 -33.51 7.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.063 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -60.44 -43.11 99.09 Favored Glycine 0 N--CA 1.447 -0.59 0 N-CA-C 110.8 -0.92 . . . . 0.0 110.8 176.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . 0.427 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 14.7 tp -63.57 -36.76 84.87 Favored 'General case' 0 C--O 1.22 -0.468 0 C-N-CA 122.235 0.214 . . . . 0.0 110.716 176.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -75.72 -38.12 58.83 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.266 0.555 . . . . 0.0 111.046 -174.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.855 HD21 HD13 ' A' ' 995' ' ' LEU . 4.3 pp -87.37 -20.26 26.96 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.613 -178.203 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.427 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 15.3 ptm180 -77.01 -35.93 56.67 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 119.574 -0.85 . . . . 0.0 110.668 165.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 85.8 m -61.5 -36.02 79.34 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 173.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.508 ' HA ' ' OD1' ' A' ' 928' ' ' ASN . 18.5 tp -61.77 -47.85 83.34 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.293 -1.321 . . . . 0.0 110.207 173.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.758 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.4 tt -66.04 -37.85 86.89 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.191 -173.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -71.91 -31.15 66.1 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.901 178.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.775 HG23 ' HB2' ' A' ' 924' ' ' LYS . 23.5 m -71.22 -36.91 72.03 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 119.668 -0.813 . . . . 0.0 109.553 173.371 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.823 HG12 HG23 ' A' ' 984' ' ' ILE . 61.7 t -68.47 -39.78 81.19 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.338 172.458 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.715 ' HB2' HE22 ' A' ' 988' ' ' GLN . 10.3 t70 -67.23 -40.23 86.34 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.85 0.833 . . . . 0.0 108.758 -178.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.657 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 8.1 tp10 -68.28 -29.47 68.26 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 114.561 -1.2 . . . . 0.0 109.726 177.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.685 ' HA ' HG22 ' A' ' 975' ' ' VAL . 70.8 m -69.52 -17.91 63.62 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.879 175.65 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.881 ' HB2' HG21 ' A' ' 984' ' ' ILE . 10.5 tt -68.81 -52.78 16.81 Favored Pre-proline 0 N--CA 1.449 -0.493 0 C-N-CA 120.973 -0.291 . . . . 0.0 110.324 -177.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.657 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 90.4 Cg_endo -90.91 0.75 4.94 Favored 'Trans proline' 0 C--N 1.357 0.991 0 C-N-CA 121.357 1.371 . . . . 0.0 114.72 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.685 HG22 ' HA ' ' A' ' 972' ' ' SER . 27.4 m . . . . . 0 N--CA 1.454 -0.269 0 O-C-N 121.427 -0.795 . . . . 0.0 111.298 172.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.763 HG22 ' HB1' ' A' 1042 ' ' ALA . 25.8 m . . . . . 0 CA--C 1.536 0.42 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.502 ' O ' ' HG2' ' A' ' 985' ' ' GLU . 12.2 m170 -50.56 -40.54 52.39 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -177.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . 0.466 ' HA ' ' CG ' ' A' ' 985' ' ' GLU . 11.1 ptt180 -83.52 -18.75 37.37 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 -171.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.417 ' HG3' ' CG1' ' A' 1038 ' ' VAL . 0.4 OUTLIER -74.3 -34.6 63.57 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 171.7 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.881 HG21 ' HB2' ' A' ' 973' ' ' LEU . 1.8 mp -70.99 -32.75 49.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 176.058 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . 0.502 ' HG2' ' O ' ' A' ' 981' ' ' HIS . 64.5 mm-40 -57.6 -54.19 49.63 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.325 174.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 48.0 ttm -68.47 -45.59 72.03 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.246 -172.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.669 ' HB2' ' HB3' ' A' 1035 ' ' LEU . . . -68.69 -52.2 33.54 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.299 -0.864 . . . . 0.0 112.737 -171.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.758 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 3.3 pt20 -65.13 -26.98 68.42 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 119.759 -0.776 . . . . 0.0 111.446 -177.156 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . 0.827 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 54.9 mtpt -75.15 -42.31 56.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.282 0.563 . . . . 0.0 111.697 175.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.604 HD22 HD13 ' A' 1035 ' ' LEU . 39.3 tp -54.0 -58.19 8.25 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -178.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.899 HD12 ' HA ' ' A' 1028 ' ' LEU . 11.4 tp -68.3 -23.12 64.7 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 120.336 -0.545 . . . . 0.0 110.169 179.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . 0.827 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 25.2 t-20 -51.77 -54.13 32.05 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.82 174.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 6.8 p -76.49 -26.1 54.95 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.355 177.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -64.19 -52.46 58.79 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.323 0.582 . . . . 0.0 110.198 177.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.855 HD13 HD21 ' A' ' 962' ' ' LEU . 0.3 OUTLIER -51.95 -28.36 16.34 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.704 168.598 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -70.29 -35.77 73.93 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 118.789 -1.164 . . . . 0.0 111.291 176.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.525 ' O ' ' HD3' ' A' 1001 ' ' LYS . 3.9 pt-20 -78.06 -29.51 49.25 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 121.134 -0.979 . . . . 0.0 110.912 175.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.833 HD23 HD13 ' A' 1028 ' ' LEU . 0.1 OUTLIER -56.15 -47.08 78.91 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 121.296 0.569 . . . . 0.0 110.062 178.513 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.502 ' O ' ' HB2' ' A' 1003 ' ' LYS . 75.2 mt -70.66 -32.99 51.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 114.927 -1.033 . . . . 0.0 111.522 -174.552 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -65.46 -41.29 93.55 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.995 0.426 . . . . 0.0 111.879 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.53 ' O ' ' HB3' ' A' 1017 ' ' TYR . 0.6 OUTLIER -78.39 -34.56 48.09 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 122.332 1.063 . . . . 0.0 108.742 -178.964 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.934 ' HG2' ' HB3' ' A' ' 951' ' ' TYR . 12.5 ttt -62.57 -27.74 69.39 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 113.977 -1.465 . . . . 0.0 109.046 176.256 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.502 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 2.6 tptp -74.84 -53.05 9.81 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 113.753 -1.567 . . . . 0.0 110.623 -167.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.625 ' HA ' ' HG2' ' A' 1007 ' ' GLN . 7.4 mp -75.15 -12.32 60.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.87 -179.024 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1005 ' ' ALA . . . . . 0.729 ' HB1' ' HB3' ' A' 1017 ' ' TYR . . . -70.28 -50.03 43.67 Favored 'General case' 0 C--O 1.216 -0.698 0 C-N-CA 119.364 -0.934 . . . . 0.0 109.747 177.316 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.938 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.3 pp0? -71.71 -30.64 65.87 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 174.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.625 ' HG2' ' HA ' ' A' 1004 ' ' LEU . 4.7 pt20 -57.87 -48.15 80.65 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 119.989 -0.684 . . . . 0.0 109.703 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.652 ' HB2' HD11 ' A' 1013 ' ' LEU . 14.0 m-30 -115.22 42.01 2.32 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 173.564 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 1.003 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 12.4 p -54.0 -24.56 11.14 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.301 0 CA-C-O 122.319 1.057 . . . . 0.0 109.743 173.259 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 49.3 mtt -55.96 -20.72 17.39 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 113.687 -1.597 . . . . 0.0 111.529 174.294 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1011 ' ' THR . . . . . 0.447 ' HB ' ' H ' ' A' 1012 ' ' SER . 16.9 p -142.87 -153.08 0.44 Allowed 'General case' 0 C--O 1.262 1.713 0 CA-C-O 123.596 1.665 . . . . 0.0 115.276 -172.068 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1012 ' ' SER . . . . . 0.447 ' H ' ' HB ' ' A' 1011 ' ' THR . 26.2 p -55.04 -37.99 67.4 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 113.048 -1.887 . . . . 0.0 112.743 -173.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1013 ' ' LEU . . . . . 0.746 ' O ' ' HB2' ' A' 1017 ' ' TYR . 6.6 mt -52.9 -40.32 63.44 Favored 'General case' 0 CA--C 1.494 -1.185 0 C-N-CA 120.196 -0.602 . . . . 0.0 110.507 178.14 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 1.003 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.09 -53.7 49.56 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-O 121.699 0.761 . . . . 0.0 109.398 -173.952 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A 1015 ' ' GLN . . . . . 0.503 ' O ' ' HD3' ' A' 1019 ' ' LYS . 0.9 OUTLIER -72.61 -41.14 65.89 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 114.587 -1.188 . . . . 0.0 112.231 -177.273 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -70.64 -55.47 8.69 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 122.818 0.447 . . . . 0.0 112.041 -178.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.746 ' HB2' ' O ' ' A' 1013 ' ' LEU . 7.3 m-85 -62.11 -33.33 74.25 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -177.205 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.634 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 54.3 tptt -78.93 -27.8 43.74 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.492 -177.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1019 ' ' LYS . . . . . 0.503 ' HD3' ' O ' ' A' 1015 ' ' GLN . 4.3 mptp? -71.68 -50.23 32.33 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 172.183 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -52.23 -31.41 32.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.83 165.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.559 ' HG3' ' CB ' ' A' 1002 ' ' MET . 2.3 ttp -67.81 -49.23 63.45 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 178.252 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1022 ' ' LEU . . . . . 0.718 ' HA ' ' HB2' ' A' 1025 ' ' ALA . 0.0 OUTLIER -81.92 -8.58 59.69 Favored 'General case' 0 C--O 1.218 -0.586 0 C-N-CA 118.987 -1.085 . . . . 0.0 109.41 -177.16 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 52.4 m -76.8 -45.74 27.64 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.718 171.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.549 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -74.85 -21.46 59.25 Favored 'General case' 0 C--O 1.213 -0.845 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 173.459 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.75 ' HB3' HG21 ' A' ' 936' ' ' VAL . . . -84.56 -25.94 28.34 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.223 172.428 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.461 ' O ' HG23 ' A' 1030 ' ' VAL . 42.4 t-80 -78.32 -22.71 47.69 Favored 'General case' 0 C--O 1.214 -0.793 0 O-C-N 121.845 -0.534 . . . . 0.0 109.641 167.257 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -69.84 -42.55 73.45 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 123.421 0.688 . . . . 0.0 109.82 162.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.899 ' HA ' HD12 ' A' ' 991' ' ' LEU . 49.7 mt -56.12 -50.05 72.17 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 168.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1029 ' ' ALA . . . . . 0.454 ' HA ' HG21 ' A' ' 933' ' ' VAL . . . -59.6 -43.48 93.7 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 175.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' 1026 ' ' HIS . 3.7 t -66.98 -50.82 60.92 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.305 0 CA-C-O 121.019 0.438 . . . . 0.0 110.564 -176.407 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.569 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 4.0 m-20 -76.36 -29.1 57.06 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.83 -178.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.536 ' HB3' HG23 ' A' ' 929' ' ' VAL . . . -67.22 -27.43 67.23 Favored 'General case' 0 C--N 1.321 -0.645 0 O-C-N 121.426 -0.796 . . . . 0.0 109.749 172.344 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.449 ' C ' ' HD3' ' A' 1033 ' ' LYS . 12.7 tmtt? -70.36 -51.86 26.76 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 167.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.569 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 36.1 t30 -63.37 -56.66 14.55 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 114.838 -1.074 . . . . 0.0 112.569 -174.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.669 ' HB3' ' HB2' ' A' ' 987' ' ' ALA . 0.2 OUTLIER -60.24 -35.85 76.41 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.775 -0.193 . . . . 0.0 110.578 -179.865 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.525 HD22 ' C ' ' A' 1036 ' ' LEU . 0.8 OUTLIER -67.57 -47.27 70.27 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 118.987 -1.085 . . . . 0.0 108.712 179.122 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.504 ' O ' ' HB2' ' A' 1041 ' ' GLN . 13.4 t70 -51.32 -28.35 11.99 Favored 'General case' 0 C--O 1.215 -0.729 0 CA-C-N 113.873 -1.512 . . . . 0.0 109.977 172.258 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.54 ' HB ' ' O ' ' A' 1035 ' ' LEU . 30.1 t -75.19 -29.95 22.36 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.536 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.778 178.404 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.522 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 1.8 mp -85.78 -34.75 8.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 CA-C-N 118.221 0.464 . . . . 0.0 111.577 172.094 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.65 -42.86 93.75 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 167.221 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1041 ' ' GLN . . . . . 0.504 ' HB2' ' O ' ' A' 1037 ' ' ASP . 1.7 mt-30 -58.53 -54.09 51.02 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.894 168.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.763 ' HB1' HG22 ' A' ' 980' ' ' THR . . . -53.19 -47.12 69.14 Favored 'General case' 0 CA--C 1.499 -1.017 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.735 -170.501 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.466 ' HG2' ' O ' ' A' 1039 ' ' ILE . 13.8 ptp180 -67.56 -46.69 71.96 Favored 'General case' 0 N--CA 1.432 -1.364 0 C-N-CA 119.91 -0.716 . . . . 0.0 110.668 -172.478 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 36.5 mt . . . . . 0 CA--C 1.531 0.231 0 C-N-CA 120.233 -0.587 . . . . 0.0 112.069 -178.646 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.692 ' HG3' HG21 ' A' ' 968' ' ' THR . 17.9 tppt? . . . . . 0 CA--C 1.535 0.385 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.614 ' O ' HG21 ' A' ' 929' ' ' VAL . 12.3 t -65.7 -28.22 43.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.191 0.52 . . . . 0.0 110.691 177.374 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -75.94 -26.42 56.87 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.398 0.679 . . . . 0.0 111.66 -177.514 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . 0.517 ' O ' HG22 ' A' ' 930' ' ' THR . 7.8 pt-20 -76.74 -24.13 53.01 Favored 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 118.743 -1.183 . . . . 0.0 109.853 172.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.475 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 1.7 m120 -71.33 -30.72 66.54 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 170.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.63 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 68.6 t -80.88 -30.53 11.88 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-N 114.811 -1.086 . . . . 0.0 111.68 177.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.517 HG22 ' O ' ' A' ' 927' ' ' GLU . 3.6 t -66.29 -30.8 71.3 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 120.222 1.374 . . . . 0.0 107.759 170.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -72.53 -52.73 9.6 Favored Glycine 0 CA--C 1.526 0.727 0 CA-C-N 115.35 -0.841 . . . . 0.0 113.239 175.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.63 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.1 pp -66.99 -49.35 65.64 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -177.372 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.586 HG21 ' HA ' ' A' 1029 ' ' ALA . 79.0 t -68.42 -37.18 77.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-O 121.038 0.446 . . . . 0.0 111.151 -174.267 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.439 ' O ' ' HB2' ' A' ' 938' ' ' GLU . 30.2 ttpt -58.26 -46.31 86.24 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.159 179.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -56.17 -36.68 68.61 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.671 176.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.775 HG21 ' HB2' ' A' 1025 ' ' ALA . 85.0 t -52.85 -75.45 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-O 121.12 0.486 . . . . 0.0 112.086 -178.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 30.7 pt -68.01 -41.68 84.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.328 -176.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.439 ' HB2' ' O ' ' A' ' 934' ' ' LYS . 9.2 mm-40 -64.49 -49.63 70.6 Favored 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.908 -174.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 25.0 mmt -74.53 -24.94 59.03 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.336 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.59 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 24.8 p . . . . . 0 N--CA 1.465 0.291 0 CA-C-O 121.384 0.611 . . . . 0.0 111.078 -174.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.774 ' HB3' ' HB2' ' A' 1002 ' ' MET . 35.3 m-85 . . . . . 0 C--O 1.21 -0.974 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 0.645 ' HA ' HG21 ' A' ' 955' ' ' VAL . 0.1 OUTLIER -63.07 -52.88 59.55 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.859 174.097 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 0.627 ' CD ' HG11 ' A' ' 952' ' ' VAL . 0.5 OUTLIER -46.26 -43.68 20.93 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 121.936 1.757 . . . . 0.0 113.309 161.322 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.702 ' HB3' ' HA ' ' A' ' 951' ' ' TYR . 27.3 tpp -60.83 -33.49 73.12 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.794 0.33 . . . . 0.0 110.859 176.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.645 HG21 ' HA ' ' A' ' 952' ' ' VAL . 60.0 t -51.84 -40.1 26.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.249 -0.432 . . . . 0.0 109.946 172.6 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.515 ' HD3' ' HA ' ' A' ' 953' ' ' PRO . 3.2 mptp? -66.59 -36.73 83.33 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.735 0.302 . . . . 0.0 110.862 175.688 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -79.85 -45.45 18.66 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.186 -0.461 . . . . 0.0 112.125 -172.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.419 HG12 ' O ' ' A' ' 954' ' ' MET . 11.8 p -84.26 -26.34 7.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -65.02 -30.77 78.86 Favored Glycine 0 N--CA 1.442 -0.944 0 N-CA-C 110.03 -1.228 . . . . 0.0 110.03 169.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . 0.596 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 19.5 tp -71.08 -38.59 72.43 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.305 -0.448 . . . . 0.0 110.097 176.029 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.501 ' HB1' ' HB3' ' A' ' 932' ' ' LEU . . . -72.46 -39.7 67.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.905 0.383 . . . . 0.0 111.109 -174.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.404 HD23 HD21 ' A' ' 995' ' ' LEU . 0.0 OUTLIER -70.18 -40.53 74.61 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-O 119.095 -0.478 . . . . 0.0 110.873 173.346 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.596 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 4.6 ptp180 -67.03 -31.38 71.86 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 118.735 -1.186 . . . . 0.0 110.306 178.391 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 964' ' ' THR . . . . . 0.494 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 40.5 m -68.62 -40.96 80.13 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.127 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.624 HD21 HD13 ' A' ' 991' ' ' LEU . 0.1 OUTLIER -63.76 -39.58 94.63 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 114.062 -1.426 . . . . 0.0 110.92 175.535 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.609 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.2 tt -76.17 -35.08 59.32 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 -172.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . 0.41 ' O ' ' HB2' ' A' ' 971' ' ' GLU . . . -72.08 -31.07 65.74 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.393 178.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.692 HG21 ' HG3' ' A' ' 924' ' ' LYS . 13.6 p -70.6 -41.58 72.12 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 118.347 0.521 . . . . 0.0 110.301 174.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 1.0 HG13 HG21 ' A' ' 984' ' ' ILE . 61.2 t -68.52 -38.19 78.82 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.991 172.494 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.547 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 16.5 t70 -68.06 -39.54 82.97 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.965 0.888 . . . . 0.0 108.88 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.644 ' O ' HG23 ' A' ' 975' ' ' VAL . 37.5 tt0 -65.74 -32.92 74.73 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.272 -1.331 . . . . 0.0 109.672 177.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.45 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 71.9 m -66.97 -17.81 65.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.979 175.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.746 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 8.5 tt -68.57 -52.39 19.64 Favored Pre-proline 0 CA--C 1.534 0.33 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 -178.314 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.746 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 5.7 Cg_exo -81.89 0.62 9.74 Favored 'Trans proline' 0 C--N 1.354 0.857 0 C-N-CA 121.478 1.452 . . . . 0.0 112.908 173.033 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.644 HG23 ' O ' ' A' ' 971' ' ' GLU . 17.5 t . . . . . 0 C--N 1.329 -0.291 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 170.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.484 ' HG1' ' HA ' ' A' 1043 ' ' ARG . 1.9 m . . . . . 0 N--CA 1.473 0.703 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.711 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 19.2 p80 -50.2 -32.04 15.38 Favored 'General case' 0 C--O 1.214 -0.782 0 C-N-CA 121.135 -0.226 . . . . 0.0 111.54 174.39 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -82.81 -20.51 35.58 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 121.147 -0.221 . . . . 0.0 111.069 -173.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.01 -34.47 57.41 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 169.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 1.0 HG21 HG13 ' A' ' 969' ' ' VAL . 69.0 mt -70.05 -32.82 52.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 114.913 -1.039 . . . . 0.0 109.441 177.339 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . 0.711 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 42.0 mt-10 -66.01 -51.62 56.68 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.312 177.477 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 18.2 mmt -71.58 -41.73 68.64 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.909 -172.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.984 ' HB3' ' HB2' ' A' 1035 ' ' LEU . . . -75.56 -51.54 12.67 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.357 -0.838 . . . . 0.0 113.25 -171.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.694 ' O ' ' HB2' ' A' ' 992' ' ' ASN . 2.3 pt20 -62.42 -28.35 69.73 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 119.649 -0.82 . . . . 0.0 109.703 179.046 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . 0.712 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 21.0 tttm -69.48 -40.82 76.84 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.323 -0.853 . . . . 0.0 112.204 170.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.442 ' HB3' ' O ' ' A' ' 987' ' ' ALA . 17.2 tp -50.5 -60.36 3.09 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.47 -0.786 . . . . 0.0 113.032 -176.438 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.712 HD23 HD12 ' A' 1035 ' ' LEU . 1.5 pt? -76.55 -20.42 56.88 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-O 121.508 0.671 . . . . 0.0 109.826 -178.305 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . 0.712 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 50.3 t-20 -50.9 -53.97 28.07 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 114.424 -1.262 . . . . 0.0 110.876 175.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 3.7 m -73.75 -34.75 64.86 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 120.792 -0.363 . . . . 0.0 111.741 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . 0.417 ' O ' ' HB2' ' A' ' 997' ' ' GLU . 0.3 OUTLIER -66.91 -32.93 74.51 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 119.829 -0.748 . . . . 0.0 111.904 178.272 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.64 ' HA ' ' HB3' ' A' ' 998' ' ' LEU . 3.3 tt -69.6 -20.89 63.62 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 122.222 0.209 . . . . 0.0 110.697 170.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -75.76 -26.33 57.31 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 119.671 -0.811 . . . . 0.0 109.665 170.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.602 ' O ' ' HG2' ' A' 1001 ' ' LYS . 56.0 mm-40 -71.33 -46.23 61.09 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 171.43 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.745 HD23 HD11 ' A' 1028 ' ' LEU . 0.0 OUTLIER -55.38 -45.76 76.57 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.713 -177.404 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.569 ' HA ' ' HG2' ' A' 1002 ' ' MET . 85.6 mt -65.08 -37.74 80.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.356 -175.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 26.6 m-80 -61.33 -40.32 93.8 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.176 0.512 . . . . 0.0 111.457 177.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.602 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 51.1 mmtt -76.38 -45.23 32.76 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.942 0.877 . . . . 0.0 108.998 -171.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.774 ' HB2' ' HB3' ' A' ' 951' ' ' TYR . 14.5 ptp -62.25 -30.5 71.16 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.88 -1.054 . . . . 0.0 109.026 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.56 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 6.0 tptm -64.55 -53.02 54.41 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.35 -167.376 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.709 ' HB3' HD12 ' A' 1013 ' ' LEU . 7.2 mp -75.34 -13.82 60.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.876 -178.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1005 ' ' ALA . . . . . 0.62 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -67.95 -43.7 78.48 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.099 -178.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.936 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -77.13 -23.82 51.71 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.349 -0.541 . . . . 0.0 111.485 174.373 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A 1007 ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -52.89 -47.72 67.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.361 0.601 . . . . 0.0 110.638 174.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.626 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 74.6 m-85 -121.5 38.72 4.02 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.988 174.519 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 1.044 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 11.9 p -48.61 -23.07 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.665 173.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 1.4 mpt? -37.38 -49.92 1.02 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.108 0.88 . . . . 0.0 111.328 173.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1011 ' ' THR . . . . . . . . . . . . . 71.4 m -163.56 -77.95 0.04 OUTLIER 'General case' 0 C--O 1.243 0.744 0 CA-C-O 121.125 0.488 . . . . 0.0 111.92 175.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1012 ' ' SER . . . . . 0.454 ' O ' ' HG2' ' A' 1015 ' ' GLN . 6.3 m -50.55 -76.43 0.02 OUTLIER 'General case' 0 C--O 1.241 0.624 0 CA-C-N 115.278 -0.874 . . . . 0.0 113.297 -166.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1013 ' ' LEU . . . . . 0.709 HD12 ' HB3' ' A' 1004 ' ' LEU . 2.8 mt -46.91 -42.57 17.84 Favored 'General case' 0 CA--C 1.501 -0.917 0 N-CA-C 113.569 0.951 . . . . 0.0 113.569 -178.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 1.044 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -55.68 -43.85 76.78 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.905 -166.907 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A 1015 ' ' GLN . . . . . 0.454 ' HG2' ' O ' ' A' 1012 ' ' SER . 24.3 pt20 -75.73 -40.79 54.99 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.814 -175.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -69.97 -53.63 16.93 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.487 0.66 . . . . 0.0 110.54 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.685 ' CE2' HD21 ' A' 1013 ' ' LEU . 7.8 m-85 -63.86 -35.77 81.73 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.865 -1.061 . . . . 0.0 113.263 -173.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.726 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 21.4 tptm -80.63 -28.0 37.08 Favored 'General case' 0 N--CA 1.458 -0.066 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.292 -177.424 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1019 ' ' LYS . . . . . 0.412 ' O ' HD22 ' A' 1022 ' ' LEU . 11.9 mptt -73.38 -51.55 16.95 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 175.585 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -50.79 -34.99 29.7 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.265 163.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.587 ' HG3' ' HB3' ' A' 1002 ' ' MET . 1.7 tmt? -65.34 -50.72 64.53 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 110.28 -0.266 . . . . 0.0 110.28 175.551 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1022 ' ' LEU . . . . . 0.66 ' HA ' ' HB1' ' A' 1025 ' ' ALA . 0.0 OUTLIER -77.5 -6.58 54.09 Favored 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 119.328 -0.949 . . . . 0.0 109.788 -175.712 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 86.5 m -80.05 -44.44 20.08 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 173.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.487 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.29 -20.76 50.9 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-O 121.309 0.576 . . . . 0.0 109.543 175.281 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.775 ' HB2' HG21 ' A' ' 936' ' ' VAL . . . -84.17 -25.19 29.76 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.17 170.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.578 ' O ' HG21 ' A' 1030 ' ' VAL . 16.1 t-80 -76.05 -26.47 56.6 Favored 'General case' 0 C--O 1.215 -0.737 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 165.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1027 ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -66.03 -43.34 87.84 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 122.962 0.505 . . . . 0.0 110.297 162.274 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.745 HD11 HD23 ' A' ' 998' ' ' LEU . 17.0 mt -59.37 -46.1 89.6 Favored 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 120.399 -0.52 . . . . 0.0 109.615 171.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1029 ' ' ALA . . . . . 0.611 ' O ' ' HB2' ' A' 1033 ' ' LYS . . . -57.45 -40.18 77.89 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.128 173.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.578 HG21 ' O ' ' A' 1026 ' ' HIS . 12.2 t -69.77 -51.45 40.71 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 CA-C-O 121.407 0.622 . . . . 0.0 110.644 -177.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.432 ' O ' ' HB3' ' A' 1035 ' ' LEU . 71.4 m-20 -75.11 -30.82 60.97 Favored 'General case' 0 C--O 1.221 -0.444 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.535 -173.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.815 ' HA ' HD23 ' A' 1035 ' ' LEU . . . -72.99 -35.46 66.87 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.841 0.353 . . . . 0.0 110.129 173.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.611 ' HB2' ' O ' ' A' 1029 ' ' ALA . 53.2 tttt -63.68 -46.24 86.44 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.944 0.878 . . . . 0.0 108.988 172.484 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.429 ' O ' HG22 ' A' 1038 ' ' VAL . 12.6 t30 -68.93 -51.84 35.58 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 113.996 -1.456 . . . . 0.0 112.485 -177.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.984 ' HB2' ' HB3' ' A' ' 987' ' ' ALA . 0.2 OUTLIER -59.24 -40.85 87.23 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 117.782 0.265 . . . . 0.0 111.139 -171.713 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.544 ' H ' HD21 ' A' 1035 ' ' LEU . 1.5 tm? -68.13 -47.56 67.79 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 118.574 -1.251 . . . . 0.0 109.289 -178.04 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 14.8 t70 -47.16 -45.92 23.1 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.363 171.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.447 ' HB ' ' O ' ' A' 1035 ' ' LEU . 22.4 t -56.18 -42.52 73.41 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.633 0 CA-C-N 113.912 -1.495 . . . . 0.0 112.818 177.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.554 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 1.6 mp -81.26 -31.77 11.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 119.304 0.956 . . . . 0.0 111.288 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.404 ' O ' ' HG3' ' A' 1043 ' ' ARG . 3.0 m-20 -59.38 -41.25 88.92 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 167.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -71.94 -37.57 69.97 Favored 'General case' 0 C--O 1.215 -0.737 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.578 173.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.554 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -53.29 -55.56 23.63 Favored 'General case' 0 CA--C 1.499 -0.988 0 C-N-CA 123.468 0.707 . . . . 0.0 111.566 -179.241 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.484 ' HA ' ' HG1' ' A' ' 980' ' ' THR . 0.0 OUTLIER -63.45 -37.36 86.98 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.34 -175.56 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.403 ' H ' ' HG3' ' A' 1043 ' ' ARG . 2.8 tm? . . . . . 0 N--CA 1.438 -1.047 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.164 178.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.596 ' HD2' ' N ' ' A' ' 924' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.735 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.789 ' HA ' ' ND2' ' A' ' 928' ' ' ASN . 4.2 p -59.84 -34.53 56.18 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 CA-C-N 119.708 1.14 . . . . 0.0 110.942 167.019 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . 0.422 ' HA ' ' HB ' ' A' ' 929' ' ' VAL . 2.4 p90 -77.23 -28.13 53.6 Favored 'General case' 0 CA--C 1.506 -0.737 0 O-C-N 121.601 -0.687 . . . . 0.0 109.394 174.458 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.85 -24.88 48.45 Favored 'General case' 0 C--N 1.307 -1.282 0 C-N-CA 118.698 -1.201 . . . . 0.0 113.962 178.243 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.789 ' ND2' ' HA ' ' A' ' 925' ' ' VAL . 13.0 p30 -72.21 -27.66 62.69 Favored 'General case' 0 C--N 1.317 -0.807 0 C-N-CA 118.661 -1.216 . . . . 0.0 108.992 166.06 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.778 HG22 ' HB1' ' A' 1032 ' ' ALA . 71.6 t -76.61 -30.7 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.137 179.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 930' ' ' THR . . . . . . . . . . . . . 26.8 m -61.2 -42.9 99.4 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 172.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -67.12 -52.72 30.38 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-N 114.61 -1.177 . . . . 0.0 113.808 176.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.657 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.4 pp -64.67 -49.47 70.85 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -174.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.525 ' O ' ' HB ' ' A' ' 936' ' ' VAL . 54.3 t -64.2 -37.84 80.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-O 121.311 0.576 . . . . 0.0 110.663 -176.146 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . . . . . . . . . 19.2 ttpp -59.87 -51.42 69.8 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.08 178.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -51.81 -39.69 59.17 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 111.672 0.249 . . . . 0.0 111.672 178.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.899 HG21 ' HB1' ' A' 1025 ' ' ALA . 92.0 t -46.73 -76.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 O-C-N 123.747 0.654 . . . . 0.0 111.852 177.256 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.434 HG13 ' N ' ' A' ' 938' ' ' GLU . 26.9 pt -68.66 -40.7 82.05 Favored 'Isoleucine or valine' 0 C--O 1.244 0.788 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -176.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.434 ' N ' HG13 ' A' ' 937' ' ' ILE . 30.8 tt0 -61.47 -52.86 62.77 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.117 -171.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 85.7 mtp -76.23 -26.93 56.55 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 119.782 -0.767 . . . . 0.0 110.721 -178.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.614 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 28.5 t . . . . . 0 CA--C 1.52 -0.21 0 O-C-N 123.925 0.766 . . . . 0.0 112.502 -170.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.859 ' CD1' ' HB3' ' A' 1006 ' ' GLN . 0.8 OUTLIER . . . . . 0 C--O 1.223 -0.324 0 CA-C-O 120.72 0.295 . . . . 0.0 110.509 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 0.77 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 26.6 t -59.5 -54.13 59.04 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.963 174.16 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 0.77 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 34.7 Cg_exo -49.01 -41.51 40.03 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 122.059 1.839 . . . . 0.0 112.628 171.535 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 954' ' ' MET . . . . . . . . . . . . . 27.0 ttt -64.36 -38.25 90.38 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.376 175.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.729 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 35.1 t -52.25 -47.44 45.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.378 169.397 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -64.21 -29.89 70.98 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.27 177.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -78.26 -46.07 21.23 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 121.151 0.5 . . . . 0.0 111.012 -174.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . . . . . . . . . 14.8 p -81.66 -26.48 9.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.482 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -67.05 -34.49 86.9 Favored Glycine 0 N--CA 1.447 -0.59 0 N-CA-C 110.493 -1.043 . . . . 0.0 110.493 171.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . 0.545 HD12 ' HD2' ' A' ' 963' ' ' ARG . 20.2 tp -63.88 -30.39 71.48 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.288 -0.456 . . . . 0.0 110.213 175.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.572 ' HB3' ' HB3' ' A' ' 932' ' ' LEU . . . -76.41 -56.86 4.25 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.105 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.583 ' O ' ' HB3' ' A' ' 965' ' ' LEU . 0.2 OUTLIER -44.07 -47.35 8.85 Favored 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 169.22 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.545 ' HD2' HD12 ' A' ' 960' ' ' LEU . 9.5 ptp180 -69.79 -27.18 64.68 Favored 'General case' 0 C--N 1.32 -0.699 0 O-C-N 120.848 -1.158 . . . . 0.0 110.831 179.159 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 964' ' ' THR . . . . . 0.459 HG21 ' HB3' ' A' ' 928' ' ' ASN . 93.0 m -68.94 -32.78 72.63 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 171.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.723 HD22 HD23 ' A' ' 991' ' ' LEU . 0.2 OUTLIER -65.44 -41.87 92.99 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.073 172.721 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.518 ' HG ' HE21 ' A' ' 988' ' ' GLN . 5.1 tt -69.98 -42.91 72.48 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.415 -0.811 . . . . 0.0 108.95 -174.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -66.99 -44.07 81.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.258 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.564 HG23 ' HB2' ' A' ' 924' ' ' LYS . 19.4 p -62.38 -48.48 79.57 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.77 0.319 . . . . 0.0 111.224 179.455 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 1.004 HG13 HG23 ' A' ' 984' ' ' ILE . 45.7 t -72.68 -31.43 37.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.81 178.393 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.814 ' HB2' HE22 ' A' ' 988' ' ' GLN . 15.1 t70 -69.96 -40.87 75.16 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 178.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.565 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 31.2 tt0 -64.79 -34.23 77.87 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 114.013 -1.449 . . . . 0.0 109.258 178.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.504 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 61.6 m -71.36 -18.81 62.35 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.324 178.058 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.732 ' HB2' HG21 ' A' ' 984' ' ' ILE . 9.7 tt -65.27 -49.78 63.08 Favored Pre-proline 0 CA--C 1.532 0.254 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.482 -176.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.692 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 4.9 Cg_exo -81.84 -9.68 11.93 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 121.659 1.573 . . . . 0.0 113.058 171.16 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.544 HG22 ' O ' ' A' ' 971' ' ' GLU . 25.4 t . . . . . 0 C--N 1.331 -0.212 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 171.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.454 HG23 ' HB2' ' A' 1042 ' ' ALA . 54.6 m . . . . . 0 CA--C 1.531 0.225 0 CA-C-O 121.936 0.874 . . . . 0.0 109.366 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.623 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 2.8 t60 -56.9 -35.09 68.58 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 114.187 -1.37 . . . . 0.0 111.427 178.486 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 6.0 ptp180 -84.54 -19.46 33.15 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -174.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.601 ' HG3' HG11 ' A' 1038 ' ' VAL . 0.4 OUTLIER -75.55 -33.98 60.71 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 121.903 0.859 . . . . 0.0 108.785 171.542 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 1.004 HG23 HG13 ' A' ' 969' ' ' VAL . 62.1 mt -72.95 -29.24 28.57 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.893 0 CA-C-N 114.219 -1.355 . . . . 0.0 109.596 177.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . 0.623 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 57.6 mt-10 -63.27 -47.87 80.55 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.512 0.672 . . . . 0.0 109.844 172.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 986' ' ' MET . . . . . 0.483 ' HG2' HD12 ' A' ' 990' ' ' LEU . 54.0 ttm -71.64 -47.38 54.79 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.88 -172.39 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.822 ' HA ' ' HG ' ' A' 1035 ' ' LEU . . . -61.1 -50.61 72.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.785 -175.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.814 HE22 ' HB2' ' A' ' 970' ' ' ASP . 53.4 mt-30 -56.99 -30.67 64.34 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.0 0.429 . . . . 0.0 110.696 177.056 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . 0.738 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 1.9 ttmt -79.09 -40.33 31.44 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 -178.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.483 HD12 ' HG2' ' A' ' 986' ' ' MET . 3.1 mp -60.33 -54.05 50.29 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 119.552 -0.859 . . . . 0.0 112.867 -178.119 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.723 HD23 HD22 ' A' ' 965' ' ' LEU . 11.7 tp -65.64 -26.44 67.81 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.061 -0.656 . . . . 0.0 109.401 177.225 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . 0.738 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 23.8 t-20 -52.97 -57.74 9.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.632 178.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 13.4 m -80.42 -36.3 33.91 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -175.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.43 -36.7 84.71 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 119.386 -0.926 . . . . 0.0 111.268 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.682 ' N ' HD23 ' A' 1028 ' ' LEU . 2.3 tm? -68.16 -24.79 65.02 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.308 171.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -71.61 -28.7 63.98 Favored 'General case' 0 C--N 1.316 -0.86 0 C-N-CA 119.283 -0.967 . . . . 0.0 109.978 170.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -76.26 -37.66 57.3 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 110.415 -0.217 . . . . 0.0 110.415 173.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.845 HD13 ' HB2' ' A' 1025 ' ' ALA . 1.1 tt -56.6 -46.77 80.68 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.293 0.568 . . . . 0.0 110.855 178.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.485 ' N ' HD22 ' A' ' 998' ' ' LEU . 84.7 mt -65.95 -46.76 87.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.722 -172.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -56.38 -40.28 74.32 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.333 0.587 . . . . 0.0 111.552 -177.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.669 ' HD3' ' HG2' ' A' 1020 ' ' GLN . 96.8 mttt -84.88 -33.92 22.7 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.79 -173.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.668 ' SD ' ' HE3' ' A' 1018 ' ' LYS . 5.3 ttp -62.4 -30.31 71.12 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 122.351 1.072 . . . . 0.0 108.574 173.267 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.502 ' O ' ' HG3' ' A' 1006 ' ' GLN . 3.8 tptm -67.38 -53.03 32.94 Favored 'General case' 0 N--CA 1.439 -0.975 0 CA-C-N 113.777 -1.556 . . . . 0.0 110.491 -171.001 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.696 ' HB3' HD21 ' A' 1013 ' ' LEU . 8.4 mp -69.95 -16.65 63.24 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.815 -179.356 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1005 ' ' ALA . . . . . 0.699 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -70.98 -39.45 72.47 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 119.344 -0.942 . . . . 0.0 110.219 -178.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.879 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.4 pp0? -74.75 -32.95 62.23 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 120.384 -0.526 . . . . 0.0 111.328 167.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.652 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 28.5 mt-30 -50.92 -44.51 60.13 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.258 0.551 . . . . 0.0 110.379 176.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.706 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 49.7 m-85 -122.2 41.1 3.49 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.561 172.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 1.036 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 14.9 p -50.52 -21.18 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.646 171.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1010 ' ' MET . . . . . 0.488 ' O ' HG23 ' A' 1011 ' ' THR . 97.0 mmm -38.7 -50.32 1.63 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.33 -1.304 . . . . 0.0 111.381 172.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1011 ' ' THR . . . . . 0.488 HG23 ' O ' ' A' 1010 ' ' MET . 0.7 OUTLIER -163.68 -86.15 0.02 OUTLIER 'General case' 0 C--O 1.246 0.897 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 179.369 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 42.5 t -54.02 -67.46 0.26 Allowed 'General case' 0 C--O 1.238 0.474 0 CA-C-N 114.786 -1.097 . . . . 0.0 112.605 -166.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1013 ' ' LEU . . . . . 0.708 ' HG ' ' CE1' ' A' 1017 ' ' TYR . 6.8 mp -50.09 -42.39 50.13 Favored 'General case' 0 CA--C 1.5 -0.967 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 -179.189 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 1.036 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -53.47 -48.53 68.79 Favored 'General case' 0 N--CA 1.442 -0.827 0 O-C-N 123.65 0.594 . . . . 0.0 111.222 -166.866 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 27.0 pt20 -74.45 -45.56 45.49 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.262 -176.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -66.53 -53.14 38.16 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.495 0.664 . . . . 0.0 110.751 -178.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.708 ' CE1' ' HG ' ' A' 1013 ' ' LEU . 15.9 m-85 -62.93 -37.63 87.8 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 114.628 -1.169 . . . . 0.0 113.37 -174.555 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.89 ' HE2' ' HE1' ' A' 1021 ' ' MET . 17.3 tptm -81.54 -29.1 33.62 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.988 -177.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -74.27 -51.74 14.41 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 174.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1020 ' ' GLN . . . . . 0.669 ' HG2' ' HD3' ' A' 1001 ' ' LYS . 10.5 tt0 -51.02 -34.47 29.62 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.07 163.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.89 ' HE1' ' HE2' ' A' 1018 ' ' LYS . 9.9 tmm? -62.87 -50.55 70.47 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 174.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1022 ' ' LEU . . . . . 0.83 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -80.11 -2.83 46.21 Favored 'General case' 0 C--O 1.221 -0.445 0 C-N-CA 119.276 -0.97 . . . . 0.0 109.858 -176.811 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 88.5 m -84.57 -39.56 18.59 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 171.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.511 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.21 -21.16 50.44 Favored 'General case' 0 C--O 1.22 -0.486 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 172.139 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.899 ' HB1' HG21 ' A' ' 936' ' ' VAL . . . -85.03 -25.11 27.86 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.137 170.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.57 ' O ' HG22 ' A' 1030 ' ' VAL . 61.0 t60 -75.78 -23.91 55.95 Favored 'General case' 0 C--O 1.217 -0.61 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 164.365 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1027 ' ' ALA . . . . . 0.483 ' HB1' ' O ' ' A' 1024 ' ' ALA . . . -71.01 -39.98 72.09 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 123.057 0.543 . . . . 0.0 109.8 164.118 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.682 HD23 ' N ' ' A' ' 995' ' ' LEU . 15.0 mt -62.47 -44.7 95.77 Favored 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.104 170.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -60.01 -36.43 77.19 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 111.286 0.106 . . . . 0.0 111.286 173.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.57 HG22 ' O ' ' A' 1026 ' ' HIS . 8.8 t -70.35 -50.81 43.4 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 CA-C-O 121.506 0.67 . . . . 0.0 109.795 -179.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1031 ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -71.16 -42.35 69.23 Favored 'General case' 0 C--O 1.208 -1.101 0 CA-C-N 114.784 -1.098 . . . . 0.0 111.483 -175.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.778 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -66.8 -32.64 74.06 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.668 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 65.4 tttp -64.37 -49.82 70.12 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.747 0.784 . . . . 0.0 110.116 170.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.466 ' O ' HG22 ' A' 1038 ' ' VAL . 59.9 t30 -72.28 -38.74 68.72 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 114.826 -1.079 . . . . 0.0 112.018 -173.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.822 ' HG ' ' HA ' ' A' ' 987' ' ' ALA . 0.0 OUTLIER -64.83 -40.5 95.29 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 119.215 -0.421 . . . . 0.0 110.817 -177.498 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.566 ' HB3' HG22 ' A' ' 925' ' ' VAL . 4.2 pp -67.8 -39.57 84.0 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 117.232 -1.787 . . . . 0.0 110.177 174.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.08 -39.26 59.47 Favored 'General case' 0 C--N 1.344 0.328 0 CA-C-O 121.725 0.774 . . . . 0.0 110.207 172.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.601 HG11 ' HG3' ' A' ' 983' ' ' GLU . 12.3 t -57.91 -46.35 87.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 114.321 -1.309 . . . . 0.0 111.841 176.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.582 ' HA ' ' HB1' ' A' 1042 ' ' ALA . 2.4 mp -73.91 -27.62 22.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 118.329 0.513 . . . . 0.0 111.484 174.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -64.45 -46.96 80.87 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.332 170.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -60.47 -46.09 91.34 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 172.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.582 ' HB1' ' HA ' ' A' 1039 ' ' ILE . . . -55.49 -51.4 67.09 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.58 -175.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.511 ' HG2' ' O ' ' A' 1039 ' ' ILE . 4.8 ptp85 -62.07 -34.73 76.82 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.034 -173.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 12.9 mt . . . . . 0 C--N 1.321 -0.66 0 C-N-CA 119.201 -1.0 . . . . 0.0 111.635 174.731 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.847 ' HB3' HG23 ' A' ' 968' ' ' THR . 14.0 tppt? . . . . . 0 N--CA 1.447 -0.59 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.584 HG11 HD12 ' A' ' 965' ' ' LEU . 3.6 t -64.29 -43.36 97.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-N 118.79 0.723 . . . . 0.0 111.274 -172.726 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -78.69 -19.06 53.36 Favored 'General case' 0 CA--C 1.502 -0.89 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.845 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.66 -23.32 53.25 Favored 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 119.64 -0.824 . . . . 0.0 111.147 168.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.439 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 8.2 m120 -74.74 -27.53 60.4 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 168.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.676 HG23 ' HB1' ' A' 1032 ' ' ALA . 60.0 t -77.51 -30.95 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.258 176.224 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 930' ' ' THR . . . . . . . . . . . . . 27.9 m -60.32 -41.36 93.35 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 171.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -68.72 -54.05 17.0 Favored Glycine 0 CA--C 1.526 0.761 0 CA-C-N 114.996 -1.002 . . . . 0.0 113.621 176.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.659 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.2 pp -63.44 -49.33 74.12 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -175.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 63.5 t -65.62 -36.84 78.56 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-O 121.112 0.482 . . . . 0.0 110.883 -175.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.725 ' HB3' ' HZ2' ' A' ' 934' ' ' LYS . 4.3 ttpm? -58.92 -46.58 87.58 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.178 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.403 ' O ' ' HB2' ' A' ' 939' ' ' MET . . . -55.3 -41.63 72.61 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 111.545 0.202 . . . . 0.0 111.545 176.268 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.736 HG22 ' HB1' ' A' 1025 ' ' ALA . 61.9 t -49.21 -75.49 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 123.206 0.603 . . . . 0.0 112.448 -177.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.41 HG13 ' N ' ' A' ' 938' ' ' GLU . 35.4 pt -74.3 -42.03 50.6 Favored 'Isoleucine or valine' 0 C--O 1.245 0.836 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -175.123 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.656 ' HB2' ' O ' ' A' ' 934' ' ' LYS . 25.4 mm-40 -60.86 -51.29 69.94 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.907 0.384 . . . . 0.0 110.529 -174.306 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.42 ' HE3' ' HG3' ' A' ' 957' ' ' GLU . 65.4 mtt -74.16 -26.52 60.35 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.861 -178.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.625 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 53.3 p . . . . . 0 CA--C 1.52 -0.202 0 O-C-N 123.705 0.628 . . . . 0.0 111.672 -170.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.651 ' CE1' ' HD3' ' A' 1018 ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.219 -0.552 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 0.964 HG23 ' HD3' ' A' ' 953' ' ' PRO . 0.9 OUTLIER -82.62 -39.22 0.83 Allowed Pre-proline 0 N--CA 1.453 -0.281 0 CA-C-O 119.219 -0.42 . . . . 0.0 111.415 176.175 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 0.964 ' HD3' HG23 ' A' ' 952' ' ' VAL . 35.8 Cg_exo -49.84 -42.15 45.05 Favored 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 121.417 1.412 . . . . 0.0 110.729 161.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.556 ' HG3' HG22 ' A' ' 958' ' ' VAL . 2.5 ttm -70.4 -28.96 65.49 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 113.831 -1.531 . . . . 0.0 111.846 177.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.868 HG23 ' HA ' ' A' ' 952' ' ' VAL . 76.0 t -53.39 -40.34 39.91 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 173.037 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.402 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 8.9 tmtt? -68.45 -33.17 73.72 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 114.973 -1.012 . . . . 0.0 111.723 173.601 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . 0.42 ' HG3' ' HE3' ' A' ' 939' ' ' MET . 6.9 mm-40 -78.35 -47.63 17.3 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -176.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.556 HG22 ' HG3' ' A' ' 954' ' ' MET . 2.7 t -84.54 -34.92 9.9 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.011 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 -178.143 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -59.8 -39.53 95.49 Favored Glycine 0 N--CA 1.434 -1.453 0 N-CA-C 110.636 -0.986 . . . . 0.0 110.636 178.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . 0.531 ' O ' ' HG2' ' A' ' 963' ' ' ARG . 9.1 tt -68.13 -36.17 79.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.348 -0.426 . . . . 0.0 110.626 175.276 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -76.25 -60.23 2.42 Favored 'General case' 0 C--N 1.321 -0.65 0 O-C-N 122.093 -0.379 . . . . 0.0 110.952 -174.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 1.079 HD13 HD21 ' A' ' 995' ' ' LEU . 3.4 pp -53.54 -34.13 57.11 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 112.435 0.531 . . . . 0.0 112.435 173.153 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.531 ' HG2' ' O ' ' A' ' 960' ' ' LEU . 3.7 ptm180 -71.83 -39.98 69.39 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 119.949 1.25 . . . . 0.0 111.166 174.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 38.3 m -61.24 -38.82 88.05 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 174.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.664 HD11 HD21 ' A' 1035 ' ' LEU . 0.3 OUTLIER -55.97 -54.72 41.42 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.66 174.738 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.657 ' HG ' HE21 ' A' ' 988' ' ' GLN . 5.2 tt -69.52 -34.68 74.62 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.164 -172.572 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . 0.415 ' O ' ' HB2' ' A' ' 971' ' ' GLU . . . -71.8 -29.16 64.15 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.807 178.108 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.847 HG23 ' HB3' ' A' ' 924' ' ' LYS . 23.7 m -71.99 -32.9 67.68 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 118.824 0.738 . . . . 0.0 109.79 172.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.986 HG12 HG21 ' A' ' 984' ' ' ILE . 24.3 t -70.24 -40.8 78.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.424 171.404 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.957 ' HB2' HE22 ' A' ' 988' ' ' GLN . 16.4 t70 -65.58 -42.1 92.13 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 122.301 1.048 . . . . 0.0 108.864 179.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.53 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 37.6 tt0 -62.16 -37.6 85.85 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 113.54 -1.664 . . . . 0.0 109.867 177.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 63.7 m -67.1 -18.76 65.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.085 176.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.612 ' HG ' ' HB2' ' A' ' 981' ' ' HIS . 9.4 tt -68.69 -51.74 20.56 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.648 -172.601 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.53 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 95.7 Cg_endo -84.37 -7.35 9.91 Favored 'Trans proline' 0 C--N 1.354 0.821 0 CA-C-N 119.883 0.994 . . . . 0.0 112.878 174.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.506 HG22 ' O ' ' A' ' 971' ' ' GLU . 75.3 t . . . . . 0 C--N 1.331 -0.228 0 C-N-CA 120.226 -0.59 . . . . 0.0 109.419 170.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.855 ' HA ' ' HB2' ' A' 1042 ' ' ALA . 89.4 m . . . . . 0 CA--C 1.531 0.229 0 N-CA-C 111.703 0.26 . . . . 0.0 111.703 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.612 ' HB2' ' HG ' ' A' ' 973' ' ' LEU . 0.5 OUTLIER -62.66 -33.81 75.8 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.961 -175.729 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 9.3 ptm180 -85.4 -19.82 30.77 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 121.046 -0.261 . . . . 0.0 111.046 -178.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.67 -34.48 69.75 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 166.256 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.986 HG21 HG12 ' A' ' 969' ' ' VAL . 44.9 mt -69.9 -33.01 53.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.637 176.872 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . 0.526 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 50.5 mt-10 -57.96 -49.81 75.53 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.559 175.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 50.9 ttp -72.83 -42.49 63.74 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 114.9 -1.046 . . . . 0.0 110.755 -175.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.822 ' HB2' ' HB2' ' A' 1035 ' ' LEU . . . -68.21 -50.27 55.25 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 114.898 -1.046 . . . . 0.0 112.279 -172.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.957 HE22 ' HB2' ' A' ' 970' ' ' ASP . 48.7 mt-30 -54.39 -43.73 71.67 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 176.2 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . 0.712 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 0.0 OUTLIER -63.52 -42.15 98.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.046 177.88 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 26.3 tp -51.86 -59.32 4.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.324 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.44 ' HA ' HD23 ' A' ' 991' ' ' LEU . 0.7 OUTLIER -63.43 -35.5 80.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.709 0.766 . . . . 0.0 108.936 178.143 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . 0.712 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 25.5 t-20 -50.37 -55.39 15.86 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 113.82 -1.536 . . . . 0.0 112.749 -176.661 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 5.5 m -77.86 -30.03 50.69 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.31 -0.556 . . . . 0.0 111.99 -178.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . 0.428 ' O ' ' HB3' ' A' ' 997' ' ' GLU . 0.1 OUTLIER -73.75 -33.79 64.46 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 118.877 -1.129 . . . . 0.0 111.667 179.826 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 1.079 HD21 HD13 ' A' ' 962' ' ' LEU . 1.9 pp -68.02 -19.12 64.88 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 169.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -78.21 -23.93 47.31 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 119.414 -0.914 . . . . 0.0 110.133 169.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.428 ' HB3' ' O ' ' A' ' 994' ' ' ASP . 6.9 tp10 -74.23 -43.96 55.04 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.976 -0.749 . . . . 0.0 108.976 171.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.719 HD11 ' HB2' ' A' 1025 ' ' ALA . 7.5 tp -56.91 -48.06 79.09 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.266 -179.371 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.865 ' HA ' ' SD ' ' A' 1002 ' ' MET . 67.5 mt -68.76 -38.08 78.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.828 -171.278 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 25.8 m-80 -62.76 -35.41 79.72 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.63 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.471 ' O ' ' HB3' ' A' 1017 ' ' TYR . 0.7 OUTLIER -85.4 -39.84 17.13 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.293 0.568 . . . . 0.0 110.816 -175.469 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.865 ' SD ' ' HA ' ' A' ' 999' ' ' ILE . 8.2 ptm -62.29 -27.08 68.77 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 122.255 1.026 . . . . 0.0 108.653 177.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.66 ' O ' ' HG3' ' A' 1006 ' ' GLN . 19.9 tptt -73.92 -54.04 8.81 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 114.158 -1.383 . . . . 0.0 110.575 -171.056 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.572 ' HA ' ' HB2' ' A' 1007 ' ' GLN . 6.4 mt -69.54 -12.52 61.72 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.004 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1005 ' ' ALA . . . . . 0.707 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -75.73 -38.7 58.27 Favored 'General case' 0 C--O 1.213 -0.838 0 C-N-CA 119.296 -0.962 . . . . 0.0 108.594 -178.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.954 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 1.3 pp0? -74.33 -36.7 63.66 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.764 -0.375 . . . . 0.0 111.126 170.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.572 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 33.9 mt-30 -49.26 -43.32 42.86 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.034 0.445 . . . . 0.0 111.289 178.599 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.635 ' HB2' ' HG ' ' A' 1013 ' ' LEU . 49.4 m-85 -126.04 44.74 2.78 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.313 0.578 . . . . 0.0 110.839 169.17 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 1.001 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 7.9 p -53.17 -20.21 2.57 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.409 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.63 171.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1010 ' ' MET . . . . . 0.465 ' O ' HG22 ' A' 1011 ' ' THR . 60.2 mtm -48.42 -40.59 26.51 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.162 -1.381 . . . . 0.0 111.915 174.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1011 ' ' THR . . . . . 0.465 HG22 ' O ' ' A' 1010 ' ' MET . 1.0 OUTLIER -160.66 -94.18 0.02 OUTLIER 'General case' 0 C--O 1.248 0.998 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 -179.344 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 4.6 m -59.12 -62.65 1.72 Allowed 'General case' 0 C--O 1.24 0.555 0 CA-C-N 114.517 -1.22 . . . . 0.0 113.121 -162.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1013 ' ' LEU . . . . . 0.696 HD22 ' HE2' ' A' 1017 ' ' TYR . 14.6 mt -53.57 -37.38 62.86 Favored 'General case' 0 CA--C 1.498 -1.044 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.735 -178.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 1.001 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -53.78 -54.56 36.46 Favored 'General case' 0 N--CA 1.441 -0.919 0 O-C-N 123.867 0.729 . . . . 0.0 110.817 -166.693 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -70.57 -42.45 71.07 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.82 -175.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -67.0 -53.76 28.26 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.555 0.693 . . . . 0.0 111.149 -179.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.707 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 12.0 m-85 -62.56 -34.34 76.77 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 113.823 1.045 . . . . 0.0 113.823 -176.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.651 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 54.1 tptt -79.05 -31.38 44.51 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 114.92 -1.036 . . . . 0.0 110.247 -176.122 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -71.81 -42.51 66.96 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 175.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -56.16 -36.25 68.1 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.539 163.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.552 ' HB3' ' HA ' ' A' 1018 ' ' LYS . 0.0 OUTLIER -66.82 -51.74 52.0 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.377 0.132 . . . . 0.0 110.834 -177.032 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A 1022 ' ' LEU . . . . . 0.402 ' O ' ' HG ' ' A' 1022 ' ' LEU . 0.0 OUTLIER -78.09 -13.48 59.85 Favored 'General case' 0 C--O 1.218 -0.558 0 C-N-CA 119.595 -0.842 . . . . 0.0 109.955 -176.036 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A 1023 ' ' THR . . . . . 0.48 ' HA ' ' HB3' ' A' 1026 ' ' HIS . 87.5 m -88.44 -32.75 18.14 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.671 177.093 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.495 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.28 -23.36 47.24 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 171.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.736 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -86.21 -21.67 27.34 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.255 169.307 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.64 ' O ' HG22 ' A' 1030 ' ' VAL . 84.9 t60 -76.38 -27.07 56.22 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 165.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1027 ' ' ALA . . . . . 0.432 ' HB1' ' O ' ' A' 1024 ' ' ALA . . . -68.98 -41.51 77.78 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 123.806 0.842 . . . . 0.0 109.957 163.19 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.631 ' HB2' ' HA ' ' A' 1025 ' ' ALA . 12.3 mt -61.23 -39.95 92.18 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 119.989 -0.684 . . . . 0.0 109.666 170.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -60.96 -37.34 82.05 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.484 0.183 . . . . 0.0 110.973 171.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.64 HG22 ' O ' ' A' 1026 ' ' HIS . 18.1 t -69.28 -50.45 52.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 121.746 0.784 . . . . 0.0 110.109 -178.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1031 ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -74.18 -32.83 63.25 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-N 114.445 -1.252 . . . . 0.0 111.024 -174.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.875 ' HA ' HD22 ' A' 1035 ' ' LEU . . . -71.39 -32.36 68.35 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 173.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -63.73 -43.89 95.17 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.661 0.743 . . . . 0.0 109.363 171.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.431 ' O ' ' HB3' ' A' 1037 ' ' ASP . 48.3 t30 -79.22 -49.25 12.81 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 114.865 -1.061 . . . . 0.0 112.364 -173.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.875 HD22 ' HA ' ' A' 1032 ' ' ALA . 0.2 OUTLIER -60.33 -39.7 88.01 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 118.012 0.369 . . . . 0.0 110.662 -174.422 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.637 ' H ' HD23 ' A' 1035 ' ' LEU . 2.5 tm? -68.83 -43.19 76.02 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 117.998 -1.481 . . . . 0.0 108.87 178.669 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.431 ' HB3' ' O ' ' A' 1034 ' ' ASN . 27.8 t70 -52.6 -41.76 63.95 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.457 174.49 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.455 ' HB ' ' O ' ' A' 1035 ' ' LEU . 24.6 t -56.41 -41.38 71.71 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.694 0 CA-C-N 114.182 -1.372 . . . . 0.0 111.706 174.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.647 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 1.6 mp -81.16 -28.63 10.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 118.215 0.461 . . . . 0.0 111.282 177.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -59.23 -48.6 81.01 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 168.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -70.76 -33.43 70.78 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.53 175.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.855 ' HB2' ' HA ' ' A' ' 980' ' ' THR . . . -55.37 -50.22 70.27 Favored 'General case' 0 CA--C 1.512 -0.511 0 C-N-CA 123.384 0.673 . . . . 0.0 112.422 178.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.587 ' HG2' ' O ' ' A' 1039 ' ' ILE . 4.0 ptp85 -64.58 -34.87 79.28 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.911 -0.404 . . . . 0.0 109.911 -177.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 51.7 tp . . . . . 0 C--N 1.328 -0.334 0 CA-C-O 121.102 0.477 . . . . 0.0 110.61 173.16 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.423 ' HA ' ' HD2' ' A' ' 924' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--O 1.224 -0.27 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.576 HG23 ' HB2' ' A' 1036 ' ' LEU . 20.0 m -60.42 -29.22 43.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.318 0.58 . . . . 0.0 110.744 175.221 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.79 -35.16 64.9 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.004 -0.544 . . . . 0.0 112.205 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . 0.908 ' HA ' ' HB ' ' A' ' 930' ' ' THR . 12.1 pt-20 -76.26 -22.71 54.79 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 119.566 1.075 . . . . 0.0 110.736 179.388 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.416 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 1.4 m120 -71.81 -30.3 65.35 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 174.306 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.678 HG23 ' HB1' ' A' 1032 ' ' ALA . 75.6 t -80.53 -32.5 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.297 0 CA-C-N 114.593 -1.185 . . . . 0.0 109.556 172.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.908 ' HB ' ' HA ' ' A' ' 927' ' ' GLU . 1.2 m -54.4 -44.72 72.59 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 167.137 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -68.35 -53.2 22.59 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-N 115.006 -0.997 . . . . 0.0 114.008 175.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.641 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.0 pp -64.68 -48.32 75.18 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 117.518 0.659 . . . . 0.0 112.772 -175.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 49.7 t -66.64 -36.69 77.88 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.394 0 CA-C-O 121.04 0.448 . . . . 0.0 110.925 -174.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.404 ' HE2' ' HB3' ' A' ' 934' ' ' LYS . 22.0 ttpt -60.09 -41.98 93.65 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.303 179.046 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -62.46 -32.1 72.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.554 0.216 . . . . 0.0 111.543 176.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.774 HG21 ' HB2' ' A' 1025 ' ' ALA . 98.6 t -58.6 -75.83 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -177.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 27.4 pt -73.35 -39.45 55.38 Favored 'Isoleucine or valine' 0 C--O 1.239 0.516 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -173.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -63.09 -51.9 64.79 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.686 0.755 . . . . 0.0 109.809 -174.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.703 ' HG3' ' SD ' ' A' ' 954' ' ' MET . 21.6 mmt -73.32 -26.59 61.11 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.877 -177.383 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.658 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 25.7 p . . . . . 0 CA--C 1.519 -0.247 0 O-C-N 123.746 0.654 . . . . 0.0 111.458 -173.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.839 ' CE1' ' HD3' ' A' 1018 ' ' LYS . 23.6 m-85 . . . . . 0 N--CA 1.466 0.355 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 0.84 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -54.69 -51.78 75.83 Favored Pre-proline 0 CA--C 1.542 0.643 0 CA-C-O 119.077 -0.487 . . . . 0.0 111.877 178.76 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 0.84 ' HD3' HG13 ' A' ' 952' ' ' VAL . 5.7 Cg_exo -46.4 -49.18 12.15 Favored 'Trans proline' 0 C--N 1.354 0.827 0 C-N-CA 122.522 2.148 . . . . 0.0 113.73 169.492 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.802 ' HA ' ' HE1' ' A' ' 954' ' ' MET . 2.3 tpt -58.47 -49.03 78.8 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.546 0.688 . . . . 0.0 110.233 176.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.884 HG23 ' HG2' ' A' 1002 ' ' MET . 56.8 t -53.37 -33.57 21.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 114.56 -1.2 . . . . 0.0 112.414 171.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 5.7 mptp? -63.36 -31.68 72.9 Favored 'General case' 0 C--N 1.315 -0.901 0 C-N-CA 119.737 -0.785 . . . . 0.0 111.149 173.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . 0.424 ' O ' ' HB3' ' A' ' 960' ' ' LEU . 45.0 mm-40 -79.76 -42.76 23.85 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.545 0.212 . . . . 0.0 111.506 176.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' ' 954' ' ' MET . 2.0 t -69.42 -33.46 57.55 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 177.639 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -66.1 -37.4 93.03 Favored Glycine 0 N--CA 1.435 -1.401 0 N-CA-C 110.352 -1.099 . . . . 0.0 110.352 173.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . 0.536 HD12 ' HD3' ' A' ' 963' ' ' ARG . 16.3 tp -62.81 -31.98 73.08 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 115.034 -0.583 . . . . 0.0 110.045 172.538 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.451 ' CB ' ' HB3' ' A' ' 932' ' ' LEU . . . -73.76 -58.54 3.23 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.763 -0.198 . . . . 0.0 110.588 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.522 ' HG ' ' N ' ' A' ' 963' ' ' ARG . 0.1 OUTLIER -39.22 -53.65 1.88 Allowed 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 166.682 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.536 ' HD3' HD12 ' A' ' 960' ' ' LEU . 6.5 ptm180 -67.7 -31.96 72.27 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 119.318 0.963 . . . . 0.0 111.516 -178.111 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 83.5 m -65.96 -35.6 81.04 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 175.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.909 HD22 HD12 ' A' 1035 ' ' LEU . 52.9 tp -70.88 -37.76 73.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.52 -1.218 . . . . 0.0 109.63 176.569 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 9.7 tt -68.21 -40.37 82.12 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 114.628 -1.169 . . . . 0.0 108.36 -175.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -70.63 -37.18 73.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.531 -0.759 . . . . 0.0 112.262 178.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 7.6 p -66.07 -41.42 90.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 118.802 0.728 . . . . 0.0 110.169 176.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.947 HG13 HG22 ' A' ' 984' ' ' ILE . 77.0 t -71.1 -38.58 71.87 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.324 174.619 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.619 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 7.1 t70 -68.01 -41.49 82.16 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.647 0.736 . . . . 0.0 109.045 -178.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.448 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 45.5 tt0 -62.93 -33.37 75.19 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.519 176.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.421 ' HB2' ' O ' ' A' ' 969' ' ' VAL . 62.2 m -67.06 -20.03 65.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.184 176.396 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.7 ' HB2' HG23 ' A' ' 984' ' ' ILE . 9.1 tt -68.64 -53.18 16.88 Favored Pre-proline 0 CA--C 1.534 0.352 0 CA-C-O 119.513 -0.28 . . . . 0.0 110.907 -174.192 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.696 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 4.1 Cg_endo -89.29 -2.69 6.06 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 121.766 1.644 . . . . 0.0 113.143 176.647 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . . . . . . . . . 20.9 t . . . . . 0 C--N 1.328 -0.363 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.616 175.137 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.828 HG23 ' HB2' ' A' 1042 ' ' ALA . 23.7 m . . . . . 0 CA--C 1.54 0.563 0 CA-C-O 120.923 0.392 . . . . 0.0 111.625 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.459 ' HA ' ' HG ' ' A' ' 973' ' ' LEU . 7.9 p80 -52.98 -32.62 47.29 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -179.525 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . 0.613 ' HA ' ' HG2' ' A' ' 985' ' ' GLU . 4.4 ptm180 -83.46 -21.57 32.84 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 120.268 -0.573 . . . . 0.0 111.714 -174.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.4 ' HG2' ' HB3' ' A' 1042 ' ' ALA . 0.4 OUTLIER -79.33 -39.88 31.67 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 121.882 0.849 . . . . 0.0 109.232 171.63 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.947 HG22 HG13 ' A' ' 969' ' ' VAL . 75.0 mt -69.02 -33.22 57.75 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 CA-C-N 114.254 -1.339 . . . . 0.0 110.0 -178.334 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . 0.613 ' HG2' ' HA ' ' A' ' 982' ' ' ARG . 12.8 pt-20 -71.2 -43.54 67.17 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 119.553 -0.859 . . . . 0.0 109.525 -179.499 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 54.3 tpp -71.3 -43.52 66.94 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 114.583 -1.189 . . . . 0.0 111.344 -172.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.941 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -74.83 -50.09 18.33 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.879 -1.055 . . . . 0.0 112.687 -170.327 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.587 HE22 ' HB2' ' A' ' 970' ' ' ASP . 3.6 pt20 -60.02 -29.1 68.27 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.972 176.472 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . 0.726 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 20.8 tttm -70.03 -39.64 75.66 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.19 172.479 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.453 ' HB3' ' O ' ' A' ' 987' ' ' ALA . 16.7 tp -50.37 -60.54 2.89 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.412 -0.813 . . . . 0.0 112.651 -179.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.723 HD21 ' HG ' ' A' 1035 ' ' LEU . 1.6 pt? -73.46 -22.25 60.23 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.584 0.707 . . . . 0.0 110.036 -177.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . 0.726 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 48.8 t-20 -51.94 -55.43 20.37 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 114.317 -1.311 . . . . 0.0 110.965 175.363 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 14.6 m -73.16 -31.87 64.51 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.854 -179.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.5 -31.73 68.94 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 119.58 -0.848 . . . . 0.0 112.059 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.586 ' N ' HD22 ' A' 1028 ' ' LEU . 8.3 tt -71.05 -16.65 62.61 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 122.168 -0.333 . . . . 0.0 110.227 171.187 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -76.81 -24.41 52.79 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 119.854 -0.738 . . . . 0.0 109.901 168.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -74.1 -42.93 59.34 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 109.144 -0.688 . . . . 0.0 109.144 171.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.713 HD11 ' HE3' ' A' 1021 ' ' MET . 0.4 OUTLIER -55.69 -43.48 76.47 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.34 -0.846 . . . . 0.0 111.024 -179.597 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.773 HG12 HG12 ' A' ' 955' ' ' VAL . 75.5 mt -64.45 -43.94 96.98 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.957 -177.016 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 29.1 m-80 -63.8 -33.75 76.38 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.321 0.582 . . . . 0.0 111.856 -178.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.964 ' HD3' ' HG2' ' A' 1020 ' ' GLN . 89.7 mttt -82.55 -42.48 18.29 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.539 -174.055 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.884 ' HG2' HG23 ' A' ' 955' ' ' VAL . 0.0 OUTLIER -62.88 -25.48 68.32 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.919 0.866 . . . . 0.0 108.893 176.341 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.61 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 10.4 tptp -71.04 -54.97 9.3 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.432 -168.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.756 ' HB3' HD21 ' A' 1013 ' ' LEU . 80.3 mt -70.69 -14.11 62.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.343 179.242 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1005 ' ' ALA . . . . . 0.716 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -70.5 -50.95 32.46 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 119.704 -0.798 . . . . 0.0 110.002 178.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.674 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.2 pp0? -74.11 -30.4 62.31 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.319 -0.553 . . . . 0.0 112.049 173.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.635 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 12.1 mt-30 -50.78 -45.42 59.11 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.524 0.678 . . . . 0.0 110.175 173.165 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.628 ' CD1' HD23 ' A' 1013 ' ' LEU . 73.3 m-85 -121.93 43.58 2.82 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.267 175.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 1.111 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 7.7 p -51.92 -29.44 11.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-O 121.79 0.805 . . . . 0.0 110.65 173.256 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1010 ' ' MET . . . . . 0.409 ' HG3' ' OG1' ' A' 1011 ' ' THR . 24.1 ptp -69.04 -5.69 23.46 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.003 -0.999 . . . . 0.0 111.897 176.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1011 ' ' THR . . . . . 0.911 HG22 ' H ' ' A' 1012 ' ' SER . 1.2 m -141.55 -168.45 2.66 Favored 'General case' 0 C--O 1.258 1.544 0 CA-C-O 122.952 1.358 . . . . 0.0 113.98 -172.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1012 ' ' SER . . . . . 0.911 ' H ' HG22 ' A' 1011 ' ' THR . 15.5 m -57.72 -32.57 67.53 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 114.2 -1.364 . . . . 0.0 111.899 -175.615 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1013 ' ' LEU . . . . . 0.756 HD21 ' HB3' ' A' 1004 ' ' LEU . 7.5 mp -49.72 -43.32 47.63 Favored 'General case' 0 CA--C 1.499 -1.006 0 C-N-CA 120.425 -0.51 . . . . 0.0 112.206 172.388 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 1.111 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -56.63 -50.16 72.85 Favored 'General case' 0 N--CA 1.439 -1.016 0 C-N-CA 119.871 -0.731 . . . . 0.0 109.437 -173.533 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A 1015 ' ' GLN . . . . . 0.457 ' N ' HE21 ' A' 1014 ' ' GLN . 3.7 pt20 -71.31 -42.15 69.0 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 114.869 -1.059 . . . . 0.0 111.965 -175.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -67.12 -56.31 10.53 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.352 0.596 . . . . 0.0 111.623 179.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.716 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 13.8 m-85 -63.93 -33.1 74.95 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 -173.298 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.839 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 42.2 tptt -79.68 -30.8 41.24 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.453 -178.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1019 ' ' LYS . . . . . 0.499 ' O ' HD21 ' A' 1022 ' ' LEU . 1.1 mptm? -70.68 -51.21 29.19 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 173.152 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1020 ' ' GLN . . . . . 0.964 ' HG2' ' HD3' ' A' 1001 ' ' LYS . 8.0 tt0 -50.69 -33.56 23.24 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.761 -1.109 . . . . 0.0 111.206 165.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.713 ' HE3' HD11 ' A' ' 998' ' ' LEU . 1.9 tmt? -68.32 -46.82 69.21 Favored 'General case' 0 CA--C 1.512 -0.508 0 O-C-N 122.168 -0.333 . . . . 0.0 110.355 176.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1022 ' ' LEU . . . . . 0.637 ' HA ' ' HB1' ' A' 1025 ' ' ALA . 0.0 OUTLIER -80.47 -7.29 59.11 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 118.857 -1.137 . . . . 0.0 109.595 -179.28 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 84.8 m -83.93 -40.4 18.58 Favored 'General case' 0 C--N 1.333 -0.133 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 174.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.553 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -77.27 -21.13 54.13 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 172.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.774 ' HB2' HG21 ' A' ' 936' ' ' VAL . . . -85.09 -23.01 28.69 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.401 169.437 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.564 ' O ' HG21 ' A' 1030 ' ' VAL . 16.3 t60 -76.96 -24.84 52.3 Favored 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 166.26 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1027 ' ' ALA . . . . . 0.422 ' HA ' ' HB ' ' A' 1030 ' ' VAL . . . -73.74 -39.01 64.58 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 123.489 0.716 . . . . 0.0 109.67 165.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.682 ' HB2' ' HA ' ' A' 1025 ' ' ALA . 22.7 mt -60.63 -44.34 96.48 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 168.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -59.99 -38.45 82.62 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 111.445 0.165 . . . . 0.0 111.445 173.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.564 HG21 ' O ' ' A' 1026 ' ' HIS . 7.8 t -69.93 -50.31 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.166 0 CA-C-O 121.488 0.661 . . . . 0.0 110.071 -178.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.447 ' O ' HD13 ' A' 1035 ' ' LEU . 23.8 m-20 -66.63 -38.05 86.11 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 114.687 -1.142 . . . . 0.0 110.496 -178.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.678 ' HB1' HG23 ' A' ' 929' ' ' VAL . . . -59.76 -42.57 93.57 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.349 173.237 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 50.9 mttp -64.03 -53.14 54.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.665 0.745 . . . . 0.0 110.054 173.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.421 ' O ' HG23 ' A' 1038 ' ' VAL . 9.0 t30 -63.18 -52.18 63.4 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.175 -1.375 . . . . 0.0 111.813 -171.207 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.941 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 0.0 OUTLIER -65.31 -38.0 88.85 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 119.307 -0.378 . . . . 0.0 110.825 -173.204 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.732 ' H ' HD11 ' A' 1035 ' ' LEU . 4.0 pp -72.98 -35.1 66.83 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 116.951 -1.899 . . . . 0.0 109.718 -179.326 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.421 ' N ' HD13 ' A' 1036 ' ' LEU . 38.3 t70 -59.12 -42.86 91.56 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 114.988 -1.006 . . . . 0.0 109.823 174.494 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' 1034 ' ' ASN . 19.6 t -53.9 -42.3 52.77 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.706 0 CA-C-N 113.847 -1.524 . . . . 0.0 111.522 173.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.651 ' O ' ' HG2' ' A' 1043 ' ' ARG . 1.7 mp -79.11 -31.11 14.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 118.35 0.523 . . . . 0.0 111.387 177.466 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.83 -50.39 72.53 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.655 0.74 . . . . 0.0 109.511 169.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -65.61 -42.93 91.04 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.222 174.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.828 ' HB2' HG23 ' A' ' 980' ' ' THR . . . -52.33 -48.46 65.44 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 122.973 0.509 . . . . 0.0 112.37 -175.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.651 ' HG2' ' O ' ' A' 1039 ' ' ILE . 13.4 ptt180 -64.27 -47.76 78.31 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.905 -178.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 47.5 tp . . . . . 0 N--CA 1.469 0.498 0 C-N-CA 120.461 -0.496 . . . . 0.0 111.221 178.766 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.794 ' HB3' HG22 ' A' ' 968' ' ' THR . 11.2 tptm . . . . . 0 N--CA 1.447 -0.595 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.592 HG12 ' HB ' ' A' ' 968' ' ' THR . 14.0 m -65.86 -31.74 55.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 CA-C-O 121.045 0.45 . . . . 0.0 110.421 177.173 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.14 -23.52 51.7 Favored 'General case' 0 CA--C 1.504 -0.797 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 174.525 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.78 -25.27 48.91 Favored 'General case' 0 C--N 1.301 -1.529 0 C-N-CA 120.067 -0.653 . . . . 0.0 111.542 173.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.579 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 3.2 m120 -77.16 -30.34 54.96 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 174.226 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.629 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 62.6 t -79.74 -29.52 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.766 175.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.468 ' O ' ' HB3' ' A' ' 934' ' ' LYS . 84.8 m -57.8 -39.97 78.81 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 119.127 0.876 . . . . 0.0 108.642 169.043 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -72.7 -52.52 9.63 Favored Glycine 0 CA--C 1.527 0.812 0 CA-C-N 114.978 -1.01 . . . . 0.0 113.775 177.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.629 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.1 pp -63.2 -45.43 91.76 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 117.745 0.772 . . . . 0.0 112.706 -176.062 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 61.5 t -65.56 -39.44 85.06 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 CA-C-O 121.253 0.549 . . . . 0.0 110.366 -178.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.468 ' HB3' ' O ' ' A' ' 930' ' ' THR . 1.4 tmtt? -61.08 -35.94 78.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.942 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.432 ' HB1' ' SD ' ' A' ' 954' ' ' MET . . . -64.61 -41.98 95.83 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 118.129 0.422 . . . . 0.0 110.801 177.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.801 HG23 ' HB1' ' A' 1025 ' ' ALA . 58.0 t -47.63 -73.84 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.974 -179.485 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.401 HG13 ' N ' ' A' ' 938' ' ' GLU . 25.6 pt -65.64 -41.38 90.46 Favored 'Isoleucine or valine' 0 C--O 1.244 0.813 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -177.015 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.401 ' N ' HG13 ' A' ' 937' ' ' ILE . 36.2 tt0 -69.6 -51.89 31.01 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.588 -170.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 23.8 mmt -73.71 -27.18 61.08 Favored 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 119.757 -0.777 . . . . 0.0 109.371 -174.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.58 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 59.9 p . . . . . 0 C--N 1.343 0.288 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.429 -174.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.781 ' HB3' ' HG3' ' A' 1002 ' ' MET . 1.0 OUTLIER . . . . . 0 CA--C 1.536 0.43 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 0.596 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 23.8 t -53.41 -45.4 98.51 Favored Pre-proline 0 C--N 1.323 -0.563 0 C-N-CA 123.151 0.58 . . . . 0.0 111.608 171.047 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 0.596 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 38.4 Cg_exo -51.58 -39.42 65.52 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.186 1.924 . . . . 0.0 112.53 174.029 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.432 ' SD ' ' HB1' ' A' ' 935' ' ' ALA . 5.3 tpt -73.96 -36.41 64.59 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.762 175.073 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.683 HG23 ' HE1' ' A' 1002 ' ' MET . 71.2 t -52.67 -40.74 35.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.794 168.166 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 3.1 tmtm? -66.59 -33.02 74.73 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.597 175.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . 0.412 ' HB3' ' HA ' ' A' ' 954' ' ' MET . 7.0 tp10 -77.55 -45.81 24.24 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 121.002 0.429 . . . . 0.0 111.01 -174.278 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.484 HG13 HD22 ' A' ' 998' ' ' LEU . 14.6 p -87.05 -27.53 5.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.618 -178.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -63.82 -38.91 96.84 Favored Glycine 0 N--CA 1.447 -0.567 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 173.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . 0.464 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 17.0 tp -63.11 -38.26 90.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.279 -0.46 . . . . 0.0 109.893 174.264 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.405 ' HB3' ' HB3' ' A' ' 932' ' ' LEU . . . -70.3 -40.76 74.06 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.706 -176.154 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.587 HD11 HD12 ' A' ' 991' ' ' LEU . 0.2 OUTLIER -67.74 -44.16 78.23 Favored 'General case' 0 C--O 1.217 -0.644 0 CA-C-O 118.782 -0.627 . . . . 0.0 111.437 173.423 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.464 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 6.1 ptp180 -64.85 -31.68 73.03 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 120.187 1.358 . . . . 0.0 110.457 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 964' ' ' THR . . . . . 0.443 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 30.4 m -69.33 -39.11 78.39 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 176.602 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.981 HD12 HD22 ' A' 1036 ' ' LEU . 37.5 tp -62.79 -44.11 97.04 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.559 -1.2 . . . . 0.0 109.949 175.179 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.728 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.5 tt -68.2 -35.22 77.66 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.318 -0.856 . . . . 0.0 109.119 -172.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -69.81 -43.48 71.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.815 178.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.794 HG22 ' HB3' ' A' ' 924' ' ' LYS . 4.6 m -64.41 -41.11 96.8 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 119.843 -0.743 . . . . 0.0 110.134 178.321 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.715 HG13 HG23 ' A' ' 984' ' ' ILE . 43.6 t -67.65 -38.09 79.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.178 173.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.639 ' HB2' HE22 ' A' ' 988' ' ' GLN . 19.2 t70 -66.73 -38.61 87.01 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 122.21 1.005 . . . . 0.0 108.696 -178.325 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.451 ' C ' ' HD2' ' A' ' 974' ' ' PRO . 28.1 tt0 -76.01 -21.94 56.34 Favored 'General case' 0 N--CA 1.437 -1.106 0 CA-C-N 113.964 -1.471 . . . . 0.0 110.128 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.589 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 52.7 m -72.08 -17.67 61.98 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.708 171.651 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.817 ' HA ' HD12 ' A' ' 984' ' ' ILE . 9.4 tt -66.04 -51.0 48.95 Favored Pre-proline 0 CA--C 1.53 0.176 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 179.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.507 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 95.0 Cg_endo -81.97 -2.44 11.3 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 120.964 1.109 . . . . 0.0 113.546 171.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.589 ' HB ' ' HA ' ' A' ' 972' ' ' SER . 0.3 OUTLIER . . . . . 0 CA--C 1.537 0.464 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.691 178.351 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.582 ' HG1' ' HA ' ' A' 1043 ' ' ARG . 15.8 m . . . . . 0 CA--C 1.542 0.668 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.65 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 0.3 OUTLIER -51.82 -34.85 42.12 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -175.542 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -82.22 -21.03 36.56 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.116 0.871 . . . . 0.0 111.94 -171.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.554 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 0.4 OUTLIER -77.77 -33.81 52.55 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.386 0.612 . . . . 0.0 109.723 169.615 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.817 HD12 ' HA ' ' A' ' 973' ' ' LEU . 69.3 mt -70.8 -30.28 41.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 CA-C-N 114.889 -1.05 . . . . 0.0 108.469 179.319 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . 0.65 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 45.9 mt-10 -63.97 -54.47 34.01 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.302 174.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 986' ' ' MET . . . . . 0.549 ' HA ' ' HD2' ' A' ' 989' ' ' LYS . 75.2 mtp -70.61 -41.52 72.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.789 -170.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.942 ' HB3' ' HB2' ' A' 1035 ' ' LEU . . . -65.24 -50.81 64.38 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.19 -0.914 . . . . 0.0 112.167 -173.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.728 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 3.7 pt20 -61.83 -28.2 69.31 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 120.452 -0.499 . . . . 0.0 111.074 178.528 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . 0.664 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 55.9 mttm -70.0 -43.42 71.45 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.449 0.643 . . . . 0.0 111.182 173.418 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.684 HD22 ' HB3' ' A' 1035 ' ' LEU . 7.7 tp -50.52 -60.08 3.38 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 114.694 -1.139 . . . . 0.0 112.539 -176.647 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.617 ' HB2' ' CD2' ' A' 1035 ' ' LEU . 0.4 OUTLIER -63.9 -33.49 75.83 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 121.398 0.618 . . . . 0.0 109.401 179.643 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . 0.664 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 44.7 t-20 -52.44 -51.89 56.88 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.584 -1.189 . . . . 0.0 110.546 177.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 993' ' ' SER . . . . . 0.486 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 32.7 t -75.01 -42.44 57.4 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.464 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.54 -36.31 80.23 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.971 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.642 ' HG ' HD21 ' A' ' 998' ' ' LEU . 8.1 tt -73.18 -19.75 61.04 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 122.198 -0.314 . . . . 0.0 110.617 172.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -75.0 -25.55 58.9 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 119.841 -0.744 . . . . 0.0 109.788 168.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.548 ' O ' ' HG2' ' A' 1001 ' ' LYS . 4.6 mm-40 -75.43 -40.16 57.98 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 172.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.762 HD13 ' HB2' ' A' 1025 ' ' ALA . 0.2 OUTLIER -56.18 -47.01 79.13 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.325 177.917 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.529 HG13 ' O ' ' A' ' 995' ' ' LEU . 95.8 mt -64.73 -42.12 94.1 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.575 -174.545 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 14.5 m-80 -59.49 -39.41 83.69 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.345 0.593 . . . . 0.0 111.856 -178.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 69.5 mmtt -77.96 -37.61 47.12 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 122.097 0.951 . . . . 0.0 108.739 -177.028 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.867 ' HB2' ' HG3' ' A' 1021 ' ' MET . 1.7 ttp -61.64 -28.71 69.57 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 114.061 -1.427 . . . . 0.0 109.179 175.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.463 ' O ' ' HG3' ' A' 1006 ' ' GLN . 2.9 tptm -73.76 -47.03 42.03 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.948 -167.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.827 HD12 ' HG3' ' A' 1007 ' ' GLN . 3.8 mm? -77.5 -13.56 59.89 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.102 179.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1005 ' ' ALA . . . . . 0.812 ' HB3' ' HB3' ' A' 1017 ' ' TYR . . . -75.38 -32.21 60.72 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 119.443 -0.903 . . . . 0.0 110.61 -177.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.712 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 5.2 pp0? -75.13 -33.27 61.54 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 118.867 -0.587 . . . . 0.0 110.961 165.406 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.827 ' HG3' HD12 ' A' 1004 ' ' LEU . 13.7 mm100 -48.33 -44.12 33.88 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.126 0.488 . . . . 0.0 110.497 176.245 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.851 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 28.6 m-85 -130.01 47.4 2.51 Favored 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 120.014 -0.674 . . . . 0.0 111.074 170.027 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 1.033 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 7.2 p -50.95 -24.47 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 CA-C-O 121.945 0.878 . . . . 0.0 109.599 167.293 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 16.4 mmt -48.68 -44.6 38.05 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 113.838 -1.528 . . . . 0.0 110.922 175.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1011 ' ' THR . . . . . . . . . . . . . 2.6 p -154.98 -101.9 0.04 OUTLIER 'General case' 0 C--O 1.251 1.182 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 -177.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 16.4 p -57.67 -64.02 1.04 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-N 114.552 -1.204 . . . . 0.0 112.881 -164.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1013 ' ' LEU . . . . . 0.851 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 4.6 mp -45.99 -42.94 13.75 Favored 'General case' 0 CA--C 1.5 -0.98 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 1.033 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -55.03 -47.77 74.29 Favored 'General case' 0 N--CA 1.438 -1.042 0 O-C-N 123.866 0.729 . . . . 0.0 110.345 -168.499 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A 1015 ' ' GLN . . . . . 0.602 ' O ' ' HD3' ' A' 1019 ' ' LYS . 97.8 mt-30 -69.37 -51.57 35.42 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.08 -177.458 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -64.35 -48.0 77.19 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.36 0.6 . . . . 0.0 111.188 -176.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.812 ' HB3' ' HB3' ' A' 1005 ' ' ALA . 7.2 m-85 -68.24 -37.52 80.87 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.258 -0.883 . . . . 0.0 113.139 -173.393 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.587 ' HD3' ' CE2' ' A' ' 951' ' ' TYR . 47.1 tptt -80.96 -28.42 35.68 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.3 -176.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1019 ' ' LYS . . . . . 0.602 ' HD3' ' O ' ' A' 1015 ' ' GLN . 5.6 mptp? -73.32 -53.27 11.21 Favored 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 174.091 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1020 ' ' GLN . . . . . 0.476 ' HG2' ' HG3' ' A' 1001 ' ' LYS . 9.2 tt0 -50.56 -32.01 17.35 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.809 164.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.867 ' HG3' ' HB2' ' A' 1002 ' ' MET . 2.4 ttp -68.69 -50.66 49.18 Favored 'General case' 0 CA--C 1.514 -0.417 0 O-C-N 122.333 -0.23 . . . . 0.0 110.621 176.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1022 ' ' LEU . . . . . 0.656 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -84.9 -9.41 58.13 Favored 'General case' 0 C--O 1.219 -0.553 0 C-N-CA 119.629 -0.829 . . . . 0.0 110.317 -174.035 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 52.4 m -83.34 -34.8 25.57 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 171.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.521 ' O ' ' HB1' ' A' 1027 ' ' ALA . . . -78.28 -21.85 49.14 Favored 'General case' 0 C--O 1.223 -0.319 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 171.018 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.801 ' HB1' HG23 ' A' ' 936' ' ' VAL . . . -85.64 -23.38 27.52 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.176 170.187 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.586 ' O ' HG23 ' A' 1030 ' ' VAL . 46.9 t-80 -75.77 -24.58 56.03 Favored 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 165.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1027 ' ' ALA . . . . . 0.521 ' HB1' ' O ' ' A' 1024 ' ' ALA . . . -70.68 -38.88 73.78 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 123.53 0.732 . . . . 0.0 109.654 164.236 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.613 HD12 HD23 ' A' ' 998' ' ' LEU . 21.6 mt -60.95 -47.21 87.49 Favored 'General case' 0 C--N 1.314 -0.939 0 C-N-CA 120.191 -0.604 . . . . 0.0 109.495 169.681 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -57.74 -40.92 80.79 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 111.366 0.135 . . . . 0.0 111.366 173.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.586 HG23 ' O ' ' A' 1026 ' ' HIS . 16.1 t -70.18 -52.17 32.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-O 121.232 0.539 . . . . 0.0 110.711 -177.093 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.702 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 5.7 m-20 -77.27 -29.14 53.75 Favored 'General case' 0 C--O 1.214 -0.783 0 CA-C-N 115.441 -0.8 . . . . 0.0 112.746 -174.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.584 ' O ' ' HG ' ' A' 1036 ' ' LEU . . . -66.51 -32.68 74.18 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 170.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.491 ' HB3' ' O ' ' A' 1030 ' ' VAL . 22.9 tttm -64.96 -51.24 62.88 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 122.078 0.942 . . . . 0.0 109.098 168.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.702 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 32.4 t30 -61.58 -52.11 65.75 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 113.396 -1.729 . . . . 0.0 112.572 -173.399 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.942 ' HB2' ' HB3' ' A' ' 987' ' ' ALA . 1.5 pp -62.45 -37.95 87.89 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 118.941 -0.552 . . . . 0.0 110.23 -176.187 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.981 HD22 HD12 ' A' ' 965' ' ' LEU . 19.9 mt -66.95 -45.86 76.48 Favored 'General case' 0 C--O 1.224 -0.279 0 C-N-CA 116.809 -1.956 . . . . 0.0 108.785 176.795 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.473 ' HB3' ' O ' ' A' 1034 ' ' ASN . 28.3 t70 -50.19 -40.79 48.07 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 114.46 -1.245 . . . . 0.0 111.038 175.273 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.506 ' HB ' ' O ' ' A' 1035 ' ' LEU . 24.2 t -53.33 -51.09 43.84 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.692 0 CA-C-N 114.267 -1.333 . . . . 0.0 111.66 173.015 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.804 HG12 HG12 ' A' ' 984' ' ' ILE . 3.0 mp -72.4 -33.08 44.58 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.428 0 CA-C-N 118.917 0.78 . . . . 0.0 110.738 176.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.46 ' HB2' ' O ' ' A' 1037 ' ' ASP . 90.1 m-20 -52.88 -52.59 56.92 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 122.317 1.056 . . . . 0.0 109.343 173.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -75.61 -35.72 60.45 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.524 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.657 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -53.96 -50.05 67.37 Favored 'General case' 0 CA--C 1.499 -0.994 0 C-N-CA 123.465 0.706 . . . . 0.0 111.998 -178.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.702 ' HD3' ' N ' ' A' 1044 ' ' LEU . 0.1 OUTLIER -62.2 -41.09 98.04 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -177.394 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.702 ' N ' ' HD3' ' A' 1043 ' ' ARG . 50.7 tp . . . . . 0 CA--C 1.534 0.353 0 CA-C-O 121.52 0.676 . . . . 0.0 110.319 -177.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.519 ' HB2' HG21 ' A' ' 968' ' ' THR . 68.2 mmtt . . . . . 0 N--CA 1.456 -0.128 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.61 ' O ' HG23 ' A' ' 929' ' ' VAL . 34.0 m -57.51 -32.52 41.99 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.36 0 CA-C-O 121.164 0.507 . . . . 0.0 110.494 175.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.56 -41.72 60.04 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.337 -179.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . 0.469 ' O ' HG23 ' A' ' 930' ' ' THR . 10.8 pt-20 -76.59 -25.6 54.12 Favored 'General case' 0 C--N 1.317 -0.807 0 C-N-CA 119.175 -1.01 . . . . 0.0 111.342 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -66.17 -28.59 68.89 Favored 'General case' 0 C--N 1.319 -0.754 0 O-C-N 121.651 -0.655 . . . . 0.0 110.346 167.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.61 HG23 ' O ' ' A' ' 925' ' ' VAL . 69.2 t -79.23 -34.9 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.312 172.535 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.469 HG23 ' O ' ' A' ' 927' ' ' GLU . 1.3 t -67.99 -30.43 69.69 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 120.369 1.44 . . . . 0.0 108.275 173.151 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -73.17 -53.11 8.02 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-N 115.398 -0.819 . . . . 0.0 113.084 174.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.47 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 0.9 OUTLIER -65.79 -49.69 67.4 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -178.414 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.415 ' O ' ' HB ' ' A' ' 936' ' ' VAL . 72.6 t -68.59 -32.39 54.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 CA-C-O 121.185 0.517 . . . . 0.0 110.733 -174.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . . . . . . . . . 24.7 ttpt -61.99 -45.96 91.33 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.084 176.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.468 ' O ' ' HB2' ' A' ' 939' ' ' MET . . . -56.38 -35.33 67.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.464 0.173 . . . . 0.0 111.366 176.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.806 HG23 ' HB1' ' A' 1025 ' ' ALA . 57.8 t -52.79 -74.95 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.696 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 23.5 pt -74.74 -42.64 47.55 Favored 'Isoleucine or valine' 0 C--O 1.245 0.851 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -175.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -64.9 -51.41 62.06 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.383 0.611 . . . . 0.0 109.99 -171.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.468 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 65.4 mtt -73.55 -25.49 60.41 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.254 -178.211 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.74 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 32.6 p . . . . . 0 C--N 1.347 0.468 0 O-C-N 123.797 0.686 . . . . 0.0 111.346 -173.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.944 ' HB3' ' HG3' ' A' 1002 ' ' MET . 20.2 m-85 . . . . . 0 N--CA 1.469 0.504 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 0.788 ' O ' ' HB ' ' A' ' 955' ' ' VAL . 25.3 t -63.49 -48.4 81.51 Favored Pre-proline 0 C--N 1.324 -0.511 0 O-C-N 122.49 -0.131 . . . . 0.0 110.863 178.604 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 0.653 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 25.7 Cg_exo -50.6 -40.0 55.47 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 121.928 1.752 . . . . 0.0 112.806 166.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.462 ' HE2' ' HB3' ' A' ' 939' ' ' MET . 36.9 ttm -67.33 -31.92 72.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.034 0.445 . . . . 0.0 110.235 175.752 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.788 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 49.7 t -52.59 -39.12 28.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.087 168.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.548 ' HB2' ' O ' ' A' ' 953' ' ' PRO . 12.8 mptt -64.82 -36.4 84.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.592 0.234 . . . . 0.0 111.293 172.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -78.87 -46.93 17.53 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.768 0.318 . . . . 0.0 111.773 -172.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.572 HG22 HD21 ' A' ' 962' ' ' LEU . 14.5 p -80.75 -32.01 12.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 179.214 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -59.72 -42.84 98.13 Favored Glycine 0 N--CA 1.446 -0.674 0 N-CA-C 110.719 -0.953 . . . . 0.0 110.719 174.134 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . 0.552 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 7.7 tt -67.39 -41.35 85.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.822 0.344 . . . . 0.0 110.305 177.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -66.97 -43.45 83.05 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.063 0.459 . . . . 0.0 111.689 -174.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.739 HD12 HD23 ' A' ' 995' ' ' LEU . 4.0 pp -84.94 -26.47 27.18 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.01 -178.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.602 ' HG3' ' N ' ' A' ' 964' ' ' THR . 8.6 ptt180 -66.82 -39.08 87.56 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 118.656 -1.218 . . . . 0.0 109.606 171.149 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 964' ' ' THR . . . . . 0.602 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 12.5 m -64.67 -31.51 72.76 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.693 HD21 HD21 ' A' ' 991' ' ' LEU . 54.2 tp -63.44 -51.43 65.75 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 121.561 0.695 . . . . 0.0 109.541 173.436 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.746 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.3 tt -63.36 -37.81 88.73 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 114.52 -1.218 . . . . 0.0 109.081 -175.114 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . 0.465 ' HA ' ' HB3' ' A' ' 970' ' ' ASP . . . -74.37 -28.66 61.22 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.667 179.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.519 HG21 ' HB2' ' A' ' 924' ' ' LYS . 31.4 m -72.0 -32.53 67.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 119.19 0.905 . . . . 0.0 109.214 171.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.621 HG12 HG21 ' A' ' 984' ' ' ILE . 71.3 t -71.35 -40.1 72.79 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.166 171.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.61 ' HB2' HE22 ' A' ' 988' ' ' GLN . 24.8 t70 -69.23 -38.65 78.63 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 122.033 0.921 . . . . 0.0 108.572 -179.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.643 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 6.8 tp10 -63.78 -35.34 80.26 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.583 174.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.445 ' HB2' ' O ' ' A' ' 969' ' ' VAL . 64.8 m -64.9 -17.93 64.75 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.12 174.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.742 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 2.4 tm? -66.18 -53.07 34.78 Favored Pre-proline 0 CA--C 1.537 0.456 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -176.51 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.742 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 94.0 Cg_endo -91.31 -19.31 0.88 Allowed 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 121.236 1.291 . . . . 0.0 114.23 174.275 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . . . . . . . . . 3.4 t . . . . . 0 N--CA 1.466 0.356 0 CA-C-N 118.019 0.372 . . . . 0.0 110.666 177.947 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.797 ' HG1' ' HA ' ' A' 1043 ' ' ARG . 55.1 m . . . . . 0 CA--C 1.532 0.25 0 CA-C-O 121.366 0.603 . . . . 0.0 110.1 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.469 ' HA ' HD11 ' A' ' 984' ' ' ILE . 0.3 OUTLIER -52.56 -25.7 11.23 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 114.816 -1.083 . . . . 0.0 113.825 -176.73 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . 0.652 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 0.0 OUTLIER -84.37 -20.16 32.42 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.396 -0.815 . . . . 0.0 111.6 -177.409 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.474 ' CB ' ' HB3' ' A' 1042 ' ' ALA . 0.3 OUTLIER -78.5 -34.96 47.04 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.808 0.813 . . . . 0.0 109.157 168.912 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.621 HG21 HG12 ' A' ' 969' ' ' VAL . 70.4 mt -69.58 -30.13 44.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 114.459 -1.246 . . . . 0.0 109.31 179.459 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . 0.652 ' HG3' ' O ' ' A' ' 982' ' ' ARG . 2.4 pp20? -70.37 -44.01 68.95 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 121.494 0.664 . . . . 0.0 109.923 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 24.9 ttt -72.09 -42.78 65.76 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.474 -173.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.965 ' HB2' ' HB2' ' A' 1035 ' ' LEU . . . -74.44 -51.77 13.94 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.984 -1.007 . . . . 0.0 112.488 -170.31 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.746 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 4.2 pt20 -61.87 -23.15 66.11 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.277 177.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . 0.794 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 15.1 tttt -73.07 -37.24 66.87 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.887 171.654 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.626 HD23 ' OD1' ' A' 1031 ' ' ASP . 15.7 tp -60.37 -57.73 11.5 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 119.616 -0.833 . . . . 0.0 111.89 179.128 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.693 HD21 HD21 ' A' ' 965' ' ' LEU . 11.6 tp -53.42 -33.95 55.93 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.475 0.655 . . . . 0.0 110.162 175.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . 0.794 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 24.6 t-20 -50.04 -53.84 24.22 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.065 -1.425 . . . . 0.0 111.426 -179.417 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 20.0 m -79.57 -26.79 41.27 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 179.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.64 -44.03 75.02 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.569 -0.852 . . . . 0.0 111.011 178.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.739 HD23 HD12 ' A' ' 962' ' ' LEU . 0.8 OUTLIER -66.02 -21.93 66.42 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 123.179 0.591 . . . . 0.0 110.478 172.405 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -75.91 -26.16 56.7 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 119.171 -1.012 . . . . 0.0 110.009 171.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.491 ' CD ' ' HZ2' ' A' 1001 ' ' LYS . 4.8 tp10 -75.38 -43.38 50.59 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 171.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.872 HD23 HD11 ' A' 1028 ' ' LEU . 0.1 OUTLIER -56.37 -48.1 77.54 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.316 -0.857 . . . . 0.0 111.742 -177.683 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.717 HD11 HG12 ' A' ' 955' ' ' VAL . 47.5 mm -69.65 -37.76 74.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.455 -175.018 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 11.7 m-80 -63.66 -36.1 82.73 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 121.126 0.489 . . . . 0.0 111.83 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.587 ' HD3' ' HB3' ' A' 1020 ' ' GLN . 35.2 mttp -82.47 -35.34 27.56 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.477 0.656 . . . . 0.0 110.453 -176.499 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.944 ' HG3' ' HB3' ' A' ' 951' ' ' TYR . 15.2 tpp -60.42 -29.45 69.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 122.423 1.106 . . . . 0.0 108.514 173.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 2.7 tptm -73.69 -52.66 12.54 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 113.865 -1.516 . . . . 0.0 111.04 -167.02 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.764 ' HA ' ' HB2' ' A' 1007 ' ' GLN . 7.8 mp -76.8 -13.43 60.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.731 -178.393 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1005 ' ' ALA . . . . . 0.71 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -69.12 -44.58 72.08 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 119.317 -0.953 . . . . 0.0 109.434 179.348 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.802 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 2.9 pp0? -71.86 -34.03 68.89 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 120.127 -0.629 . . . . 0.0 111.435 170.134 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.764 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 51.8 mt-30 -47.14 -48.95 23.19 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.993 0.425 . . . . 0.0 110.901 176.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.809 ' HB2' HD13 ' A' 1013 ' ' LEU . 89.0 m-85 -125.15 47.75 2.12 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.191 -0.603 . . . . 0.0 110.529 171.465 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 1.004 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 12.5 p -51.76 -22.04 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 115.087 -0.961 . . . . 0.0 110.434 171.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1010 ' ' MET . . . . . 0.466 ' O ' HG22 ' A' 1011 ' ' THR . 22.7 mmt -41.67 -36.61 1.0 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.402 -1.272 . . . . 0.0 111.961 176.117 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1011 ' ' THR . . . . . 0.466 HG22 ' O ' ' A' 1010 ' ' MET . 0.2 OUTLIER -167.7 -92.42 0.01 OUTLIER 'General case' 0 C--O 1.246 0.911 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 176.522 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 12.2 m -53.1 -64.62 0.76 Allowed 'General case' 0 C--O 1.237 0.408 0 CA-C-N 114.571 -1.195 . . . . 0.0 113.311 -164.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1013 ' ' LEU . . . . . 0.809 HD13 ' HB2' ' A' 1008 ' ' TYR . 4.1 mp -52.7 -40.28 62.81 Favored 'General case' 0 CA--C 1.496 -1.099 0 O-C-N 123.25 0.343 . . . . 0.0 111.365 -177.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 1.004 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.09 -48.33 70.8 Favored 'General case' 0 N--CA 1.44 -0.93 0 O-C-N 123.639 0.587 . . . . 0.0 110.506 -168.206 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A 1015 ' ' GLN . . . . . 0.53 ' O ' ' HD3' ' A' 1019 ' ' LYS . 25.1 mt-30 -71.39 -47.92 53.18 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 120.343 -0.543 . . . . 0.0 111.605 -179.076 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -67.5 -56.33 9.98 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.148 0.499 . . . . 0.0 111.25 -176.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.71 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 10.3 m-85 -56.46 -38.6 71.89 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.283 -177.148 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.933 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 22.9 tptm -80.01 -30.89 39.68 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 114.865 -1.061 . . . . 0.0 110.808 -177.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1019 ' ' LYS . . . . . 0.53 ' HD3' ' O ' ' A' 1015 ' ' GLN . 1.6 mptm? -70.87 -52.88 17.52 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 174.302 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1020 ' ' GLN . . . . . 0.587 ' HB3' ' HD3' ' A' 1001 ' ' LYS . 25.3 mt-30 -50.79 -32.86 21.21 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.107 164.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.481 ' SD ' HD12 ' A' ' 998' ' ' LEU . 10.7 tmm? -65.73 -50.73 63.74 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 177.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1022 ' ' LEU . . . . . 0.692 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -81.08 -5.01 57.14 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 119.301 -0.96 . . . . 0.0 109.707 -177.023 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 87.4 m -88.21 -35.9 17.08 Favored 'General case' 0 C--O 1.223 -0.306 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 173.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.548 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -77.76 -21.73 51.31 Favored 'General case' 0 C--O 1.22 -0.478 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 170.705 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.806 ' HB1' HG23 ' A' ' 936' ' ' VAL . . . -85.34 -24.09 27.77 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.368 169.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.608 ' O ' HG22 ' A' 1030 ' ' VAL . 28.4 t60 -76.97 -24.14 52.3 Favored 'General case' 0 C--O 1.215 -0.743 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 166.095 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1027 ' ' ALA . . . . . 0.514 ' HA ' ' HB ' ' A' 1030 ' ' VAL . . . -73.23 -39.81 65.18 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 123.88 0.872 . . . . 0.0 109.875 165.068 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.872 HD11 HD23 ' A' ' 998' ' ' LEU . 39.7 mt -59.68 -45.11 93.07 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 168.237 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -61.45 -34.88 76.17 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.592 0.234 . . . . 0.0 111.41 173.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.608 HG22 ' O ' ' A' 1026 ' ' HIS . 4.3 t -66.85 -50.33 66.16 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -179.49 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.745 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 34.2 t70 -74.55 -28.4 60.94 Favored 'General case' 0 C--O 1.206 -1.212 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.424 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.581 ' HB3' HG22 ' A' ' 929' ' ' VAL . . . -55.16 -45.59 75.71 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 171.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.402 ' O ' ' HB2' ' A' 1037 ' ' ASP . 78.0 tttt -67.82 -40.7 83.76 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.421 174.003 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.745 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 7.0 t30 -77.96 -56.1 4.76 Favored 'General case' 0 C--O 1.221 -0.444 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.176 -170.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.965 ' HB2' ' HB2' ' A' ' 987' ' ' ALA . 0.2 OUTLIER -61.37 -39.99 92.69 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 118.978 -0.534 . . . . 0.0 110.654 -175.025 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.64 HD12 ' N ' ' A' 1037 ' ' ASP . 0.0 OUTLIER -72.94 -29.57 63.2 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 116.029 -2.268 . . . . 0.0 109.644 -179.372 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.64 ' N ' HD12 ' A' 1036 ' ' LEU . 15.2 t70 -63.03 -41.92 99.65 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-O 122.116 0.96 . . . . 0.0 109.314 174.349 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.438 HG22 ' O ' ' A' 1034 ' ' ASN . 36.3 t -59.95 -45.48 95.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 113.764 -1.562 . . . . 0.0 111.591 177.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.615 HD12 ' HA ' ' A' ' 984' ' ' ILE . 2.0 mp -72.79 -31.63 37.28 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 C-N-CA 119.972 -0.691 . . . . 0.0 110.917 174.064 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 1.7 t0 -58.54 -46.34 87.03 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.317 0.579 . . . . 0.0 109.746 170.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1041 ' ' GLN . . . . . 0.483 ' HG3' ' O ' ' A' 1037 ' ' ASP . 78.2 mt-30 -60.36 -49.43 77.61 Favored 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 173.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.721 ' CB ' HG21 ' A' ' 980' ' ' THR . . . -54.2 -52.27 61.77 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 114.279 -1.328 . . . . 0.0 113.353 -173.146 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.797 ' HA ' ' HG1' ' A' ' 980' ' ' THR . 0.0 OUTLIER -64.07 -41.24 97.4 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 -176.2 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.603 ' N ' ' HD3' ' A' 1043 ' ' ARG . 3.0 tm? . . . . . 0 N--CA 1.44 -0.94 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 -177.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.48 ' HB2' HG21 ' A' ' 968' ' ' THR . 27.8 mmtp . . . . . 0 CA--C 1.531 0.231 0 N-CA-C 112.605 0.595 . . . . 0.0 112.605 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.871 ' HA ' HD22 ' A' ' 928' ' ' ASN . 16.3 m -65.87 -28.76 44.86 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.394 0 CA-C-O 120.96 0.41 . . . . 0.0 110.575 178.237 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -78.71 -31.76 46.64 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.814 172.326 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -77.08 -24.14 51.89 Favored 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 118.837 -1.145 . . . . 0.0 113.528 -177.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.871 HD22 ' HA ' ' A' ' 925' ' ' VAL . 8.8 p30 -70.75 -45.8 64.14 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 118.388 -1.325 . . . . 0.0 109.106 166.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.681 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 98.3 t -53.04 -33.84 20.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 N-CA-C 113.809 1.041 . . . . 0.0 113.809 171.031 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 930' ' ' THR . . . . . . . . . . . . . 33.1 m -62.05 -43.42 98.88 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 119.884 1.22 . . . . 0.0 108.836 174.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -67.8 -51.73 33.49 Favored Glycine 0 CA--C 1.53 1.025 0 CA-C-N 114.65 -1.159 . . . . 0.0 113.574 175.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.681 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.8 pp -65.66 -49.13 69.76 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -174.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.457 HG23 HG11 ' A' ' 929' ' ' VAL . 53.3 t -65.89 -37.97 81.07 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.417 0 CA-C-O 121.101 0.477 . . . . 0.0 110.466 -176.007 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.558 ' HD2' ' C ' ' A' ' 934' ' ' LYS . 4.1 tmmm? -58.51 -41.01 84.44 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.99 178.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -67.45 -31.69 72.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.804 0.335 . . . . 0.0 111.498 -179.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.74 HG22 ' HB1' ' A' 1025 ' ' ALA . 80.2 t -54.45 -65.92 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.052 178.502 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 25.6 pt -70.24 -39.33 76.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.414 -178.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -65.51 -52.21 54.34 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 120.194 -0.602 . . . . 0.0 110.451 -173.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -70.52 -24.97 62.92 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.462 -176.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.543 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 28.7 p . . . . . 0 N--CA 1.454 -0.253 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.737 -171.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.801 ' CE1' ' HD3' ' A' 1018 ' ' LYS . 30.9 m-85 . . . . . 0 C--O 1.217 -0.617 0 N-CA-C 114.544 1.312 . . . . 0.0 114.544 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 0.588 ' HA ' ' CG2' ' A' ' 955' ' ' VAL . 46.9 t -53.15 -45.38 98.3 Favored Pre-proline 0 C--N 1.319 -0.737 0 C-N-CA 122.944 0.497 . . . . 0.0 111.256 170.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 0.573 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 48.8 Cg_exo -51.53 -38.31 64.32 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 122.071 1.847 . . . . 0.0 112.078 172.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.429 ' O ' HG11 ' A' ' 958' ' ' VAL . 7.0 tpt -77.45 -32.48 54.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.076 -0.966 . . . . 0.0 110.644 175.624 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.635 HG22 ' SD ' ' A' 1002 ' ' MET . 88.9 t -52.92 -38.71 29.42 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 167.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.537 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 12.4 tmtt? -66.87 -35.48 80.11 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.451 175.346 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -78.66 -46.79 18.36 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -177.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.526 ' O ' ' HG ' ' A' ' 962' ' ' LEU . 11.2 p -83.58 -30.36 7.92 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.365 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.299 -178.311 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -61.09 -38.89 96.31 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 110.617 -0.993 . . . . 0.0 110.617 174.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . 0.568 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 9.4 tt -70.15 -36.41 74.72 Favored 'General case' 0 C--O 1.223 -0.296 0 CA-C-O 120.935 0.397 . . . . 0.0 110.146 177.297 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.571 ' O ' ' HB2' ' A' ' 928' ' ' ASN . . . -72.68 -42.56 64.12 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.152 0.501 . . . . 0.0 111.523 -176.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 1.034 HD12 HD23 ' A' ' 995' ' ' LEU . 4.1 pp -81.5 -24.63 36.57 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.466 -179.167 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.568 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 4.9 ptp180 -73.73 -31.04 63.18 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 119.159 -1.017 . . . . 0.0 109.934 168.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 93.1 m -62.86 -32.52 73.77 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 174.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.97 HD22 HD21 ' A' ' 991' ' ' LEU . 63.5 tp -65.46 -55.66 16.7 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.235 174.055 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.516 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 9.5 tt -55.54 -41.18 72.86 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 114.199 -1.364 . . . . 0.0 109.901 -175.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -72.43 -36.74 68.65 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.289 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.48 HG21 ' HB2' ' A' ' 924' ' ' LYS . 22.2 m -66.29 -42.04 88.95 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.446 176.203 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.702 HG12 HG21 ' A' ' 984' ' ' ILE . 18.0 t -73.22 -33.55 41.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.929 178.412 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.847 ' HB2' HE22 ' A' ' 988' ' ' GLN . 7.6 t70 -68.16 -42.46 80.02 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 122.087 0.946 . . . . 0.0 108.815 178.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.644 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 31.9 tt0 -69.82 -29.86 67.23 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-N 114.082 -1.417 . . . . 0.0 109.874 178.114 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 73.2 m -67.21 -17.66 64.91 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.664 174.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.702 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 10.2 tt -68.64 -51.69 21.14 Favored Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 121.064 -0.254 . . . . 0.0 110.39 -178.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.702 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 2.6 Cg_endo -84.95 -27.62 1.16 Allowed 'Trans proline' 0 C--N 1.359 1.08 0 C-N-CA 121.771 1.647 . . . . 0.0 114.206 174.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . . . . . . . . . 52.3 t . . . . . 0 N--CA 1.468 0.44 0 O-C-N 122.155 -0.341 . . . . 0.0 111.376 -177.041 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.639 HG21 ' HB3' ' A' 1042 ' ' ALA . 74.7 m . . . . . 0 CA--C 1.536 0.43 0 CA-C-O 121.595 0.712 . . . . 0.0 109.184 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.572 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 1.7 p80 -48.88 -35.28 14.4 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 114.214 -1.357 . . . . 0.0 114.563 -174.367 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 3.8 ptp180 -78.96 -19.33 51.96 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 118.867 0.758 . . . . 0.0 111.062 -169.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.531 ' HG2' ' HB1' ' A' 1042 ' ' ALA . 0.0 OUTLIER -76.52 -37.94 55.93 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 120.401 -0.52 . . . . 0.0 109.865 171.928 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.792 HG13 HG12 ' A' 1039 ' ' ILE . 3.6 mp -66.51 -35.75 75.63 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.486 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 175.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . 0.572 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 40.5 mt-10 -56.99 -52.88 63.51 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.598 178.428 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 89.9 mtp -70.57 -39.88 73.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.478 -174.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.982 ' HB3' ' HB2' ' A' 1035 ' ' LEU . . . -76.9 -52.41 9.5 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.868 -1.06 . . . . 0.0 112.792 -169.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.847 HE22 ' HB2' ' A' ' 970' ' ' ASP . 3.7 pt20 -64.32 -24.88 67.8 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 121.6 0.714 . . . . 0.0 109.498 179.32 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . 0.794 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 31.7 tttm -73.39 -38.87 65.49 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.748 -1.115 . . . . 0.0 111.742 172.558 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.486 ' HG ' ' OD2' ' A' 1031 ' ' ASP . 17.1 tp -57.39 -58.27 9.02 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.423 -0.511 . . . . 0.0 112.275 178.277 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.97 HD21 HD22 ' A' ' 965' ' ' LEU . 13.6 tp -55.03 -34.45 63.52 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-O 121.365 0.602 . . . . 0.0 110.085 175.784 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . 0.794 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 24.7 t-20 -48.47 -53.21 18.8 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.197 -1.365 . . . . 0.0 111.606 -178.163 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 6.5 p -77.6 -29.95 52.2 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 120.591 -0.443 . . . . 0.0 112.131 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . 0.443 ' O ' ' HB2' ' A' ' 997' ' ' GLU . 0.9 OUTLIER -69.76 -39.04 76.95 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 119.646 -0.822 . . . . 0.0 110.741 -179.866 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 1.034 HD23 HD12 ' A' ' 962' ' ' LEU . 2.2 pp -68.41 -17.44 64.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.7 171.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -78.43 -24.38 46.18 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 119.523 -0.871 . . . . 0.0 110.259 168.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.64 ' O ' ' HG2' ' A' 1001 ' ' LYS . 71.6 mm-40 -72.08 -45.99 58.55 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 172.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.693 HD22 HD12 ' A' 1028 ' ' LEU . 0.2 OUTLIER -56.03 -46.76 78.74 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.752 -178.147 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.751 ' HA ' ' SD ' ' A' 1002 ' ' MET . 84.1 mt -66.99 -36.8 78.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.428 -173.392 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 19.9 m-80 -64.05 -35.36 80.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.124 0.488 . . . . 0.0 111.5 177.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.64 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 44.7 mmtm -77.4 -45.28 26.38 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.78 0.8 . . . . 0.0 109.792 -174.258 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.985 ' HB3' ' HG3' ' A' 1021 ' ' MET . 7.1 ptm -63.76 -25.92 68.41 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 122.165 0.983 . . . . 0.0 108.973 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.617 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 9.4 tptm -69.55 -52.66 24.26 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.439 -167.446 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.779 HD12 ' HG3' ' A' 1007 ' ' GLN . 4.0 mm? -75.33 -12.59 60.3 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.483 -0.781 . . . . 0.0 111.592 179.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1005 ' ' ALA . . . . . 0.732 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -71.96 -37.78 69.87 Favored 'General case' 0 C--O 1.213 -0.828 0 C-N-CA 119.389 -0.924 . . . . 0.0 110.52 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.681 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.4 pp0? -76.3 -30.69 57.85 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 119.105 -0.474 . . . . 0.0 110.984 173.132 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.779 ' HG3' HD12 ' A' 1004 ' ' LEU . 17.2 mm-40 -48.3 -49.28 34.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.393 0.616 . . . . 0.0 109.989 175.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.547 ' HB2' HD12 ' A' 1013 ' ' LEU . 68.7 m-85 -129.09 55.04 1.76 Allowed 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 121.483 0.659 . . . . 0.0 110.419 170.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 1.019 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 4.7 p -56.51 -25.54 21.15 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.527 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.786 168.155 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 59.8 mtt -74.01 1.32 11.21 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 114.818 -1.083 . . . . 0.0 111.081 176.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1011 ' ' THR . . . . . 0.598 HG21 ' H ' ' A' 1012 ' ' SER . 0.2 OUTLIER -151.63 -154.77 0.56 Allowed 'General case' 0 C--O 1.26 1.606 0 CA-C-O 122.9 1.333 . . . . 0.0 114.043 -176.357 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A 1012 ' ' SER . . . . . 0.598 ' H ' HG21 ' A' 1011 ' ' THR . 15.1 m -59.06 -43.84 91.77 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 113.902 -1.499 . . . . 0.0 112.376 -170.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1013 ' ' LEU . . . . . 0.676 ' O ' ' HB2' ' A' 1017 ' ' TYR . 13.2 mt -48.6 -43.23 35.94 Favored 'General case' 0 CA--C 1.494 -1.183 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.888 178.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 1.019 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.72 -54.08 46.56 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-O 121.521 0.677 . . . . 0.0 109.798 -171.374 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -67.01 -44.94 79.02 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 114.283 -1.326 . . . . 0.0 110.825 -174.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -65.67 -56.21 13.37 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.296 0.569 . . . . 0.0 111.799 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.732 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 6.7 m-85 -62.02 -34.52 76.37 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.988 -1.005 . . . . 0.0 113.149 -172.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.801 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 55.6 tptt -80.61 -30.72 36.77 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.74 -176.683 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -73.0 -49.79 26.88 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 174.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -54.65 -30.54 55.5 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 114.999 -1.001 . . . . 0.0 110.782 165.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.985 ' HG3' ' HB3' ' A' 1002 ' ' MET . 2.5 ttp -68.95 -48.16 63.89 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 175.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1022 ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' 1022 ' ' LEU . 0.0 OUTLIER -79.13 -12.28 59.99 Favored 'General case' 0 C--O 1.216 -0.702 0 C-N-CA 119.835 -0.746 . . . . 0.0 109.977 -177.016 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 97.8 m -84.45 -36.07 22.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.111 175.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.513 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.73 -22.08 47.09 Favored 'General case' 0 C--O 1.222 -0.369 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 171.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.74 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -84.92 -21.98 29.45 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.877 -0.602 . . . . 0.0 109.887 169.069 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.523 ' O ' HG21 ' A' 1030 ' ' VAL . 8.5 t60 -76.0 -27.18 57.32 Favored 'General case' 0 C--O 1.217 -0.624 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 165.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1027 ' ' ALA . . . . . 0.44 ' HB2' ' O ' ' A' 1024 ' ' ALA . . . -69.27 -39.94 78.09 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 123.355 0.662 . . . . 0.0 110.09 164.045 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.693 HD12 HD22 ' A' ' 998' ' ' LEU . 26.0 mt -61.3 -44.61 96.92 Favored 'General case' 0 C--N 1.315 -0.921 0 C-N-CA 120.353 -0.539 . . . . 0.0 109.615 170.427 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -59.09 -40.28 84.81 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.529 0.204 . . . . 0.0 111.476 173.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.523 HG21 ' O ' ' A' 1026 ' ' HIS . 9.5 t -69.11 -46.31 78.41 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 CA-C-O 121.7 0.762 . . . . 0.0 110.179 -178.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.486 ' OD2' ' HG ' ' A' ' 990' ' ' LEU . 5.5 t70 -71.84 -42.54 66.81 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 114.339 -1.301 . . . . 0.0 110.187 -174.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.574 ' HB2' HG22 ' A' ' 929' ' ' VAL . . . -59.98 -36.27 76.8 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 174.309 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 36.4 tttm -66.14 -55.01 18.52 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.631 0.729 . . . . 0.0 110.001 173.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.458 ' O ' ' HB3' ' A' 1037 ' ' ASP . 9.6 t30 -64.91 -48.66 73.38 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 114.587 -1.188 . . . . 0.0 112.552 -172.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.982 ' HB2' ' HB3' ' A' ' 987' ' ' ALA . 2.0 pp -63.99 -40.67 96.89 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 119.401 -0.333 . . . . 0.0 110.108 -176.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.63 HD21 HG22 ' A' ' 925' ' ' VAL . 4.0 pp -70.59 -33.68 71.33 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 117.232 -1.787 . . . . 0.0 109.618 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.458 ' HB3' ' O ' ' A' 1034 ' ' ASN . 18.3 t70 -58.25 -44.36 88.27 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.654 173.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.442 ' HB ' ' O ' ' A' 1035 ' ' LEU . 24.8 t -55.09 -39.38 50.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 113.708 -1.587 . . . . 0.0 111.269 174.284 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.792 HG12 HG13 ' A' ' 984' ' ' ILE . 1.7 mp -80.45 -33.13 13.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.374 176.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.61 -44.26 76.85 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 121.536 0.684 . . . . 0.0 109.482 170.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -70.06 -39.22 75.81 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.058 174.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.639 ' HB3' HG21 ' A' ' 980' ' ' THR . . . -55.62 -52.51 63.55 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -177.414 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.668 ' HG2' ' O ' ' A' 1039 ' ' ILE . 5.7 ptm180 -66.1 -41.14 91.02 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 -176.379 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 44.5 tp . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 115.987 -0.552 . . . . 0.0 109.895 174.225 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.705 ' HB2' HG23 ' A' ' 968' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.539 0 N-CA-C 114.444 1.276 . . . . 0.0 114.444 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.689 ' H ' ' HD2' ' A' ' 924' ' ' LYS . 4.1 t -53.62 -40.57 42.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 CA-C-N 119.148 0.886 . . . . 0.0 111.895 -169.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -80.03 -20.94 44.17 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.084 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 924' ' ' LYS . 9.3 pt-20 -76.71 -24.17 53.11 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 120.173 1.351 . . . . 0.0 109.542 169.286 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.535 ' OD1' ' HA ' ' A' ' 925' ' ' VAL . 1.1 m120 -68.57 -29.7 68.31 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 170.601 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.67 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 44.3 t -80.5 -30.24 12.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 114.726 -1.125 . . . . 0.0 109.841 175.258 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.453 ' OG1' ' HA ' ' A' ' 927' ' ' GLU . 31.1 m -57.36 -43.4 83.47 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 168.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -66.55 -52.35 35.43 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-N 114.518 -1.219 . . . . 0.0 114.106 176.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.67 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.2 pp -65.29 -49.32 69.96 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -175.269 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.45 HG23 ' CB ' ' A' 1029 ' ' ALA . 76.7 t -62.1 -42.17 94.0 Favored 'Isoleucine or valine' 0 C--O 1.242 0.68 0 CA-C-O 121.399 0.619 . . . . 0.0 110.312 -176.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.477 ' O ' ' HB2' ' A' ' 938' ' ' GLU . 4.7 tmmm? -58.52 -39.04 79.02 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.612 -1.176 . . . . 0.0 109.906 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.546 ' HA ' ' SD ' ' A' ' 939' ' ' MET . . . -66.75 -35.41 80.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.569 0.223 . . . . 0.0 111.169 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.598 HG22 ' HB1' ' A' 1025 ' ' ALA . 59.8 t -53.24 -77.12 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.687 -179.513 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.509 ' O ' ' HB2' ' A' ' 940' ' ' SER . 27.1 pt -67.43 -42.57 87.4 Favored 'Isoleucine or valine' 0 C--O 1.249 1.062 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -174.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.477 ' HB2' ' O ' ' A' ' 934' ' ' LYS . 7.5 mm-40 -66.49 -46.5 76.1 Favored 'General case' 0 C--N 1.315 -0.929 0 C-N-CA 120.932 -0.307 . . . . 0.0 110.928 -170.149 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.546 ' SD ' ' HA ' ' A' ' 935' ' ' ALA . 1.0 OUTLIER -69.84 -28.33 65.6 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.174 178.032 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.749 ' HA ' ' NZ ' ' A' 1018 ' ' LYS . 4.6 m . . . . . 0 CA--C 1.514 -0.434 0 O-C-N 123.542 0.526 . . . . 0.0 112.355 -171.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 1.013 ' HB3' ' HG3' ' A' 1002 ' ' MET . 16.5 m-85 . . . . . 0 C--O 1.214 -0.79 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 0.791 ' O ' HG13 ' A' ' 955' ' ' VAL . 66.6 t -53.82 -54.06 50.81 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 117.949 0.34 . . . . 0.0 111.142 174.079 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 0.687 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 12.8 Cg_exo -48.3 -43.82 30.88 Favored 'Trans proline' 0 CA--C 1.545 1.071 0 C-N-CA 121.703 1.602 . . . . 0.0 113.413 170.588 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.492 ' HE2' ' HB2' ' A' ' 935' ' ' ALA . 5.2 tpt -71.12 -48.21 53.56 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.547 0.739 . . . . 0.0 112.023 -179.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.791 HG13 ' O ' ' A' ' 952' ' ' VAL . 0.3 OUTLIER -54.27 -29.65 19.8 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.772 169.059 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.53 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 9.5 tmtt? -68.64 -31.61 70.87 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.585 0.231 . . . . 0.0 111.296 169.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . 0.671 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 18.6 mm-40 -77.76 -44.69 26.84 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.395 0.617 . . . . 0.0 110.247 -176.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.416 HG12 ' HA ' ' A' ' 955' ' ' VAL . 7.3 p -77.01 -27.38 16.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.283 178.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . 0.515 ' HA2' HD12 ' A' ' 995' ' ' LEU . . . -65.44 -34.96 90.69 Favored Glycine 0 N--CA 1.448 -0.529 0 N-CA-C 110.293 -1.123 . . . . 0.0 110.293 170.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . 0.559 HD12 ' HD3' ' A' ' 963' ' ' ARG . 25.8 tp -63.67 -32.66 74.21 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.022 -0.589 . . . . 0.0 110.526 174.405 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.441 ' HB3' ' HB3' ' A' ' 932' ' ' LEU . . . -75.58 -58.19 3.43 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 121.137 -0.225 . . . . 0.0 110.612 -178.324 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.597 HD13 HD13 ' A' ' 991' ' ' LEU . 0.4 OUTLIER -42.82 -50.7 5.64 Favored 'General case' 0 C--O 1.212 -0.918 0 N-CA-C 112.748 0.648 . . . . 0.0 112.748 168.827 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.559 ' HD3' HD12 ' A' ' 960' ' ' LEU . 3.5 ptm180 -65.82 -28.51 69.04 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 119.654 1.116 . . . . 0.0 110.745 -177.626 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 38.8 m -68.78 -39.26 80.28 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 173.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.525 HD22 HD22 ' A' 1035 ' ' LEU . 0.1 OUTLIER -66.36 -38.96 88.79 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.389 -1.278 . . . . 0.0 110.66 177.287 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.821 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 9.9 tt -76.48 -38.79 54.76 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 115.415 -0.811 . . . . 0.0 108.92 -172.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -71.13 -31.66 68.0 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.304 177.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.705 HG23 ' HB2' ' A' ' 924' ' ' LYS . 11.8 p -68.77 -39.98 79.94 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 118.654 0.661 . . . . 0.0 110.29 175.289 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.865 HG13 HG22 ' A' ' 984' ' ' ILE . 97.7 t -71.14 -40.73 75.38 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.045 173.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.808 ' HB2' HE22 ' A' ' 988' ' ' GLN . 19.4 t70 -64.79 -42.98 94.62 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 122.003 0.906 . . . . 0.0 108.691 -179.103 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.687 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 11.2 tp10 -61.48 -38.13 86.16 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 114.032 -1.44 . . . . 0.0 109.415 177.123 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.711 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 58.8 m -64.42 -18.94 65.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.772 179.053 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.844 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 8.8 tt -66.89 -53.24 27.77 Favored Pre-proline 0 CA--C 1.536 0.434 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 -179.618 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.844 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 4.8 Cg_exo -80.83 -17.61 9.54 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 121.71 1.606 . . . . 0.0 113.78 172.063 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.711 ' HB ' ' HA ' ' A' ' 972' ' ' SER . 3.5 t . . . . . 0 N--CA 1.467 0.386 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -178.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.674 HG23 ' CB ' ' A' 1042 ' ' ALA . 67.4 m . . . . . 0 N--CA 1.448 -0.562 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.496 ' HA ' HD13 ' A' ' 984' ' ' ILE . 2.0 p-80 -52.04 -23.33 5.07 Favored 'General case' 0 C--O 1.216 -0.669 0 CA-C-N 113.971 -1.468 . . . . 0.0 113.403 179.03 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -82.56 -21.42 35.3 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 119.081 0.855 . . . . 0.0 110.755 178.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.636 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 0.2 OUTLIER -78.63 -33.98 46.87 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 168.454 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.865 HG22 HG13 ' A' ' 969' ' ' VAL . 53.5 mt -70.15 -30.65 44.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 114.766 -1.106 . . . . 0.0 108.055 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . 0.527 ' O ' ' HG3' ' A' ' 989' ' ' LYS . 9.6 mm-40 -64.1 -55.35 22.67 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.783 174.417 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 65.3 mtt -71.11 -44.78 64.95 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.131 -0.94 . . . . 0.0 111.619 -168.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.987 ' HB2' ' HB2' ' A' 1035 ' ' LEU . . . -66.6 -49.38 66.49 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.069 -0.968 . . . . 0.0 112.288 -173.352 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.821 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 3.2 pt20 -61.76 -29.92 70.45 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 119.817 -0.753 . . . . 0.0 111.26 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . 0.745 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 50.9 mttm -70.5 -39.16 74.31 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.616 0.722 . . . . 0.0 111.396 174.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.598 HD21 ' HB3' ' A' 1035 ' ' LEU . 15.8 tp -49.94 -60.49 2.87 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.447 -178.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.719 HD22 ' HA ' ' A' 1028 ' ' LEU . 0.3 OUTLIER -67.99 -28.55 67.53 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.522 0.677 . . . . 0.0 109.788 -179.885 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . 0.745 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 22.7 t-20 -52.27 -55.44 21.31 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.346 -1.297 . . . . 0.0 111.023 178.278 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 30.8 t -76.41 -34.75 58.82 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.383 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . 0.45 ' O ' ' HB3' ' A' ' 997' ' ' GLU . 0.7 OUTLIER -65.27 -37.04 85.97 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.6 -0.44 . . . . 0.0 112.162 179.306 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 1.052 ' HG ' HD23 ' A' ' 998' ' ' LEU . 6.8 tt -72.0 -17.49 62.04 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 122.32 -0.238 . . . . 0.0 110.546 172.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -72.8 -25.73 61.25 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 119.446 -0.901 . . . . 0.0 110.032 166.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.45 ' HB3' ' O ' ' A' ' 994' ' ' ASP . 12.1 tp10 -74.97 -38.4 61.68 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 173.371 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 1.052 HD23 ' HG ' ' A' ' 995' ' ' LEU . 0.1 OUTLIER -56.38 -46.39 80.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.039 178.629 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.583 ' O ' ' HB2' ' A' 1003 ' ' LYS . 76.2 mt -60.7 -46.11 96.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.679 -175.429 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -58.04 -39.87 79.49 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -175.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.559 ' O ' ' HB3' ' A' 1017 ' ' TYR . 32.7 mmtp -84.15 -37.05 22.42 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.721 0.772 . . . . 0.0 110.119 -175.551 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1002 ' ' MET . . . . . 1.013 ' HG3' ' HB3' ' A' ' 951' ' ' TYR . 34.3 tpp -57.97 -32.54 67.96 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.731 -1.122 . . . . 0.0 108.821 172.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.583 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 13.4 tptp -70.39 -53.7 15.46 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 113.808 -1.542 . . . . 0.0 111.369 -167.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.635 HD12 ' HG3' ' A' 1007 ' ' GLN . 4.1 mm? -76.9 -13.16 60.02 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.681 -177.383 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1005 ' ' ALA . . . . . 0.593 ' HB1' ' HB3' ' A' 1017 ' ' TYR . . . -68.45 -47.98 65.73 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 119.664 -0.814 . . . . 0.0 109.762 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.941 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 8.4 pt20 -70.87 -36.16 72.69 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 119.941 -0.704 . . . . 0.0 111.898 171.486 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.635 ' HG3' HD12 ' A' 1004 ' ' LEU . 12.4 mm100 -43.13 -51.55 5.86 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.108 0.48 . . . . 0.0 110.734 177.086 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.667 ' HB2' ' HG ' ' A' 1013 ' ' LEU . 66.4 m-85 -123.71 52.3 1.45 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.52 0.676 . . . . 0.0 110.088 169.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 1.022 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 13.0 p -53.73 -18.05 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.423 0 CA-C-N 114.576 -1.193 . . . . 0.0 110.288 169.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1010 ' ' MET . . . . . 0.487 ' C ' ' HG1' ' A' 1011 ' ' THR . 16.4 ptp -62.31 81.17 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.078 166.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1011 ' ' THR . . . . . 0.487 ' HG1' ' C ' ' A' 1010 ' ' MET . 45.8 p 68.0 -89.08 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 126.231 1.812 . . . . 0.0 114.589 175.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 37.6 m -45.98 -79.38 0.01 OUTLIER 'General case' 0 C--O 1.241 0.638 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 -165.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1013 ' ' LEU . . . . . 0.667 ' HG ' ' HB2' ' A' 1008 ' ' TYR . 13.3 mt -54.57 -35.17 63.02 Favored 'General case' 0 CA--C 1.501 -0.92 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 -174.784 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 1.022 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.39 -48.61 71.36 Favored 'General case' 0 N--CA 1.445 -0.718 0 O-C-N 123.646 0.591 . . . . 0.0 110.912 -167.78 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -75.17 -41.06 58.88 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.565 -176.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -72.64 -46.74 52.5 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.203 0.525 . . . . 0.0 111.042 -176.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.593 ' HB3' ' HB1' ' A' 1005 ' ' ALA . 6.9 m-85 -67.87 -36.5 80.39 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.48 -176.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 1.047 ' HE2' ' HE3' ' A' 1021 ' ' MET . 9.5 tptm -79.86 -26.61 40.3 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.587 -175.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -74.18 -42.16 60.3 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 174.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -57.34 -35.04 69.41 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.191 163.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1021 ' ' MET . . . . . 1.047 ' HE3' ' HE2' ' A' 1018 ' ' LYS . 6.6 tmm? -66.41 -53.6 33.94 Favored 'General case' 0 C--O 1.219 -0.505 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 -179.039 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1022 ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' 1022 ' ' LEU . 0.0 OUTLIER -78.98 -8.53 58.99 Favored 'General case' 0 C--O 1.22 -0.46 0 C-N-CA 119.367 -0.933 . . . . 0.0 109.852 -171.472 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 82.6 m -88.15 -35.27 17.51 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.944 174.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.479 ' O ' ' HB2' ' A' 1027 ' ' ALA . . . -79.0 -22.72 45.12 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-O 121.222 0.534 . . . . 0.0 109.582 171.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.598 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -86.18 -23.92 26.33 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.927 170.213 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.517 ' O ' HG21 ' A' 1030 ' ' VAL . 63.8 t60 -75.96 -22.58 55.76 Favored 'General case' 0 C--O 1.214 -0.777 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 164.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1027 ' ' ALA . . . . . 0.479 ' HB2' ' O ' ' A' 1024 ' ' ALA . . . -73.2 -39.11 65.83 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 123.282 0.633 . . . . 0.0 109.386 165.231 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.719 ' HA ' HD22 ' A' ' 991' ' ' LEU . 14.4 mt -59.87 -48.15 82.85 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 168.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1029 ' ' ALA . . . . . 0.45 ' CB ' HG23 ' A' ' 933' ' ' VAL . . . -57.73 -42.72 84.44 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.867 -0.151 . . . . 0.0 111.358 175.234 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.517 HG21 ' O ' ' A' 1026 ' ' HIS . 8.0 t -69.19 -51.79 39.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.318 0.58 . . . . 0.0 110.877 -176.623 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.475 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 12.4 m-20 -77.15 -29.38 54.56 Favored 'General case' 0 C--O 1.214 -0.779 0 CA-C-N 115.338 -0.847 . . . . 0.0 112.661 -174.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.405 ' HA ' ' CD2' ' A' 1035 ' ' LEU . . . -70.32 -31.24 68.46 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 172.224 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.532 ' HE2' ' O ' ' A' 1033 ' ' LYS . 1.0 OUTLIER -63.83 -49.95 70.81 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 168.892 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.515 ' O ' ' HB3' ' A' 1037 ' ' ASP . 42.2 t30 -64.13 -53.94 41.66 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-N 113.921 -1.49 . . . . 0.0 112.474 -175.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.987 ' HB2' ' HB2' ' A' ' 987' ' ' ALA . 2.3 pp -60.47 -41.27 93.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 119.638 -0.22 . . . . 0.0 110.551 -172.242 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.519 ' HG ' ' HB ' ' A' ' 925' ' ' VAL . 1.0 OUTLIER -68.77 -43.95 74.69 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 117.974 -1.491 . . . . 0.0 109.142 179.12 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.515 ' HB3' ' O ' ' A' 1034 ' ' ASN . 12.1 t70 -49.28 -42.91 42.54 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 114.801 -1.091 . . . . 0.0 110.22 173.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.593 ' CG1' ' HG3' ' A' ' 983' ' ' GLU . 21.2 t -56.82 -48.7 80.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 113.488 -1.687 . . . . 0.0 111.966 176.064 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.733 ' O ' ' HG2' ' A' 1043 ' ' ARG . 2.0 mp -70.68 -31.48 46.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 118.761 0.709 . . . . 0.0 111.435 177.039 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.405 ' HA ' ' HD2' ' A' 1043 ' ' ARG . 0.2 OUTLIER -63.38 -47.41 82.18 Favored 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.559 174.204 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -61.58 -43.87 98.06 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.006 0.432 . . . . 0.0 109.863 172.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.674 ' CB ' HG23 ' A' ' 980' ' ' THR . . . -54.1 -50.99 65.58 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -176.399 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.733 ' HG2' ' O ' ' A' 1039 ' ' ILE . 1.3 ptp180 -63.7 -46.94 83.2 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.477 -174.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.513 HD21 ' HG3' ' A' 1043 ' ' ARG . 3.7 mm? . . . . . 0 C--N 1.332 -0.191 0 CA-C-O 120.764 0.316 . . . . 0.0 111.016 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.46 ' O ' ' HG2' ' A' ' 927' ' ' GLU . 4.9 tptp . . . . . 0 N--CA 1.47 0.56 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.838 HG12 ' HB2' ' A' 1036 ' ' LEU . 1.5 p -62.45 -28.81 45.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 CA-C-O 121.291 0.567 . . . . 0.0 110.83 177.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . 0.522 ' HA ' HD23 ' A' 1036 ' ' LEU . 0.0 OUTLIER -68.09 -30.02 69.1 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.498 0.719 . . . . 0.0 111.555 174.986 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . 0.466 ' O ' HG22 ' A' ' 930' ' ' THR . 3.6 pt-20 -74.97 -23.22 58.25 Favored 'General case' 0 C--N 1.315 -0.935 0 C-N-CA 118.661 -1.215 . . . . 0.0 109.636 -179.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.416 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 1.6 m120 -75.48 -30.98 60.07 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 172.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.664 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 83.3 t -81.68 -30.41 10.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.745 178.247 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.466 HG22 ' O ' ' A' ' 927' ' ' GLU . 3.1 t -65.37 -26.69 68.12 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 170.139 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -72.03 -52.87 10.21 Favored Glycine 0 CA--C 1.531 1.044 0 CA-C-N 115.047 -0.978 . . . . 0.0 113.379 172.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.664 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 3.2 pp -65.8 -47.43 75.15 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -177.617 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.41 HG22 ' HA ' ' A' 1029 ' ' ALA . 95.6 t -64.37 -34.39 69.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 CA-C-O 121.375 0.607 . . . . 0.0 110.237 -177.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.474 ' O ' ' HB3' ' A' ' 938' ' ' GLU . 37.9 tptt -62.48 -34.03 76.03 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.516 176.131 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -68.62 -40.31 80.4 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.316 -0.554 . . . . 0.0 110.644 174.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.788 HG22 ' HB2' ' A' 1025 ' ' ALA . 88.3 t -47.38 -78.92 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 123.417 0.687 . . . . 0.0 112.511 -178.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 19.2 pt -70.49 -41.94 78.22 Favored 'Isoleucine or valine' 0 C--O 1.249 1.028 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -175.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.474 ' HB3' ' O ' ' A' ' 934' ' ' LYS . 5.2 tp10 -70.46 -48.08 57.54 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.426 -168.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.547 ' SD ' ' HB2' ' A' ' 954' ' ' MET . 16.2 ttt -74.49 -27.27 60.49 Favored 'General case' 0 C--N 1.308 -1.219 0 C-N-CA 119.276 -0.97 . . . . 0.0 110.05 -178.395 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.681 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 26.3 t . . . . . 0 CA--C 1.519 -0.247 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.512 -171.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.97 ' HB3' ' HG2' ' A' 1002 ' ' MET . 20.5 m-30 . . . . . 0 CA--C 1.539 0.55 0 N-CA-C 114.255 1.206 . . . . 0.0 114.255 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 0.524 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 45.6 t -48.1 -44.69 62.07 Favored Pre-proline 0 CA--C 1.541 0.597 0 C-N-CA 122.849 0.46 . . . . 0.0 112.058 172.327 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 0.524 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 19.0 Cg_exo -47.62 -44.13 26.6 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 122.572 2.181 . . . . 0.0 113.185 173.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.656 ' SD ' ' HE1' ' A' 1002 ' ' MET . 14.1 ttt -71.76 -37.55 70.5 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 120.897 0.379 . . . . 0.0 110.227 175.774 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.503 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 86.2 t -52.96 -40.62 37.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.809 170.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.502 ' HE2' ' OE2' ' A' ' 957' ' ' GLU . 0.8 OUTLIER -62.7 -34.03 76.3 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.788 174.376 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . 0.502 ' OE2' ' HE2' ' A' ' 956' ' ' LYS . 69.7 mm-40 -77.87 -44.83 26.0 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.195 0.522 . . . . 0.0 111.111 -179.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.453 HG21 ' HB2' ' A' ' 932' ' ' LEU . 14.6 p -78.79 -29.37 14.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.928 -177.375 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -69.62 -35.52 74.6 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 110.549 -1.02 . . . . 0.0 110.549 172.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . 0.435 ' O ' ' HG2' ' A' ' 963' ' ' ARG . 8.6 tt -62.77 -41.22 99.13 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 174.121 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.417 ' CB ' ' HB3' ' A' ' 932' ' ' LEU . . . -69.32 -57.99 4.6 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 121.132 -0.227 . . . . 0.0 110.966 -179.593 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.601 ' HB2' HD22 ' A' ' 991' ' ' LEU . 0.1 OUTLIER -42.86 -49.22 5.85 Favored 'General case' 0 C--O 1.217 -0.642 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 169.763 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.456 ' N ' ' HG ' ' A' ' 962' ' ' LEU . 11.2 ptm180 -67.89 -28.77 67.8 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 120.108 1.322 . . . . 0.0 111.064 -179.529 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 28.0 m -68.3 -35.53 77.97 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 173.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.718 HD23 HD12 ' A' ' 991' ' ' LEU . 0.0 OUTLIER -66.57 -38.64 87.48 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 114.523 -1.217 . . . . 0.0 109.467 174.686 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 10.3 tt -65.92 -40.36 91.36 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-N 114.314 -1.312 . . . . 0.0 108.271 -177.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -65.29 -44.69 87.16 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.397 -0.82 . . . . 0.0 112.249 178.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 13.8 p -64.81 -41.02 96.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 118.858 0.753 . . . . 0.0 110.412 179.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.703 HG13 HG22 ' A' ' 984' ' ' ILE . 87.3 t -72.96 -41.85 60.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.021 176.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.718 ' HB2' HE22 ' A' ' 988' ' ' GLN . 14.0 t70 -67.03 -38.83 86.62 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 -177.57 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.609 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 14.2 tt0 -60.83 -33.85 73.66 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.012 -0.995 . . . . 0.0 109.773 174.231 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.515 ' HB2' ' O ' ' A' ' 969' ' ' VAL . 64.2 m -65.57 -18.29 65.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.085 177.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.727 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 10.5 tt -70.61 -52.02 11.45 Favored Pre-proline 0 CA--C 1.537 0.48 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.256 -178.529 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.727 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 2.2 Cg_endo -88.01 -4.7 6.95 Favored 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 121.758 1.639 . . . . 0.0 113.94 173.751 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.453 HG22 ' O ' ' A' ' 971' ' ' GLU . 15.9 t . . . . . 0 C--N 1.329 -0.287 0 C-N-CA 120.157 -0.617 . . . . 0.0 109.766 171.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.579 HG21 ' CD1' ' A' ' 984' ' ' ILE . 32.5 m . . . . . 0 CA--C 1.542 0.662 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.681 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 2.5 p80 -50.13 -34.52 22.45 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -175.352 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -82.66 -20.79 35.55 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -168.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.59 -37.65 41.93 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.316 0.579 . . . . 0.0 109.684 172.58 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.777 HG13 HG12 ' A' 1039 ' ' ILE . 2.5 mp -65.68 -29.74 47.94 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.524 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 176.005 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . 0.681 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 42.3 mt-10 -63.79 -52.45 60.2 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-O 121.36 0.6 . . . . 0.0 110.579 176.164 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 58.7 mtt -70.06 -46.34 65.17 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 114.978 -1.01 . . . . 0.0 111.424 -169.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.436 ' CA ' ' HG ' ' A' 1035 ' ' LEU . . . -75.09 -51.11 14.29 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.719 -1.128 . . . . 0.0 112.776 -169.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.718 HE22 ' HB2' ' A' ' 970' ' ' ASP . 2.2 pt20 -63.29 -20.95 65.93 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 119.406 -0.918 . . . . 0.0 109.209 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . 0.622 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 9.1 ttmm -73.94 -42.43 60.58 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.042 -0.981 . . . . 0.0 112.591 170.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.491 HD13 HD13 ' A' 1035 ' ' LEU . 1.2 mt -56.29 -54.05 49.96 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -178.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.718 HD12 HD23 ' A' ' 965' ' ' LEU . 1.2 tt -65.22 -32.21 73.77 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 175.774 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . 0.652 ' HB2' ' O ' ' A' ' 988' ' ' GLN . 47.3 t-20 -53.95 -56.88 13.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.932 179.003 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 20.7 t -79.32 -33.88 42.77 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -177.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . 0.49 ' O ' ' HB3' ' A' ' 997' ' ' GLU . 0.2 OUTLIER -69.0 -33.41 73.63 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.17 -0.612 . . . . 0.0 111.705 178.946 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.601 ' N ' HD23 ' A' 1028 ' ' LEU . 2.9 tm? -69.33 -19.63 63.87 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 169.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -76.08 -21.76 56.36 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 119.434 -0.906 . . . . 0.0 110.415 167.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.608 ' HA ' ' ND2' ' A' 1000 ' ' ASN . 7.7 tp10 -75.25 -42.41 55.19 Favored 'General case' 0 C--O 1.239 0.528 0 C-N-CA 122.367 0.267 . . . . 0.0 110.532 173.228 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.912 HD12 ' HB3' ' A' 1025 ' ' ALA . 1.6 tt -56.53 -44.21 80.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.725 0.298 . . . . 0.0 110.366 177.518 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.559 HG13 ' O ' ' A' ' 995' ' ' LEU . 88.5 mt -66.46 -46.87 85.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 CA-C-N 115.868 -0.605 . . . . 0.0 112.274 -172.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1000 ' ' ASN . . . . . 0.608 ' ND2' ' HA ' ' A' ' 997' ' ' GLU . 10.2 p30 -63.21 -37.51 87.54 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.438 0.637 . . . . 0.0 111.374 -172.147 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.569 ' HD3' ' HB3' ' A' 1020 ' ' GLN . 49.9 mttp -83.96 -34.15 24.48 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.086 -178.883 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.97 ' HG2' ' HB3' ' A' ' 951' ' ' TYR . 12.7 ttt -62.48 -27.23 68.99 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 122.054 0.93 . . . . 0.0 109.013 175.537 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.548 ' O ' ' HG3' ' A' 1007 ' ' GLN . 10.3 tptp -72.91 -55.28 6.84 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-N 113.724 -1.58 . . . . 0.0 110.224 -170.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.414 ' HA ' ' HB2' ' A' 1007 ' ' GLN . 90.5 mt -66.24 -13.53 60.52 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.615 179.435 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1005 ' ' ALA . . . . . 0.702 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -72.88 -51.76 17.4 Favored 'General case' 0 C--O 1.212 -0.898 0 C-N-CA 119.634 -0.827 . . . . 0.0 110.147 178.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.979 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -68.86 -32.39 72.02 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 118.332 0.515 . . . . 0.0 111.94 174.272 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.548 ' HG3' ' O ' ' A' 1003 ' ' LYS . 19.4 mt-30 -51.79 -40.86 61.11 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.18 0.514 . . . . 0.0 111.282 175.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.5 ' HB2' ' HG ' ' A' 1013 ' ' LEU . 54.9 m-85 -126.49 39.06 4.01 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.333 173.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 1.035 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 12.9 p -54.28 -22.14 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 CA-C-O 121.692 0.758 . . . . 0.0 110.332 177.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1010 ' ' MET . . . . . 0.509 ' O ' HG22 ' A' 1011 ' ' THR . 59.1 mtt -50.03 -29.32 8.47 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.355 -1.293 . . . . 0.0 111.831 177.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1011 ' ' THR . . . . . 0.509 HG22 ' O ' ' A' 1010 ' ' MET . 0.6 OUTLIER -163.79 -99.51 0.02 OUTLIER 'General case' 0 C--O 1.253 1.275 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 177.311 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 4.7 p -56.92 -65.24 0.65 Allowed 'General case' 0 C--O 1.237 0.438 0 CA-C-N 114.267 -1.333 . . . . 0.0 113.57 -163.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1013 ' ' LEU . . . . . 0.619 ' HB3' ' CD2' ' A' 1017 ' ' TYR . 8.9 mt -52.1 -37.01 52.64 Favored 'General case' 0 CA--C 1.501 -0.913 0 N-CA-C 111.558 0.207 . . . . 0.0 111.558 -177.395 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 1.035 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.35 -52.72 60.69 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-O 121.202 0.525 . . . . 0.0 110.974 -168.998 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A 1015 ' ' GLN . . . . . 0.685 ' O ' ' HB3' ' A' 1019 ' ' LYS . 4.6 pp0? -71.42 -36.83 71.44 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.261 -174.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1016 ' ' GLU . . . . . 0.449 ' HA ' ' HD2' ' A' 1019 ' ' LYS . 17.3 tt0 -73.2 -51.64 17.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.8 0.809 . . . . 0.0 111.015 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.702 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 12.2 m-85 -66.85 -37.79 85.14 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -174.587 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.571 ' HD2' ' HE1' ' A' 1021 ' ' MET . 45.7 tptt -79.99 -29.31 39.49 Favored 'General case' 0 N--CA 1.461 0.094 0 CA-C-N 115.056 -0.974 . . . . 0.0 109.967 -177.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1019 ' ' LYS . . . . . 0.685 ' HB3' ' O ' ' A' 1015 ' ' GLN . 0.0 OUTLIER -74.29 -40.41 62.29 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.778 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A 1020 ' ' GLN . . . . . 0.569 ' HB3' ' HD3' ' A' 1001 ' ' LYS . 48.0 mt-30 -60.86 -33.28 72.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.526 162.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.571 ' HE1' ' HD2' ' A' 1018 ' ' LYS . 11.5 tmm? -65.19 -51.27 62.07 Favored 'General case' 0 CA--C 1.506 -0.723 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 -178.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1022 ' ' LEU . . . . . 0.758 ' HA ' ' HB1' ' A' 1025 ' ' ALA . 0.1 OUTLIER -84.39 -2.67 57.52 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 119.231 -0.988 . . . . 0.0 109.76 -174.485 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 53.1 m -89.0 -34.07 16.96 Favored 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 171.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.526 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.76 -21.31 48.11 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 169.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.912 ' HB3' HD12 ' A' ' 998' ' ' LEU . . . -85.55 -24.4 27.26 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.785 169.514 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.568 ' O ' HG23 ' A' 1030 ' ' VAL . 53.6 t-80 -75.84 -23.09 55.71 Favored 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 164.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1027 ' ' ALA . . . . . 0.46 ' HB1' ' O ' ' A' 1024 ' ' ALA . . . -73.04 -40.47 65.08 Favored 'General case' 0 C--N 1.318 -0.8 0 C-N-CA 123.345 0.658 . . . . 0.0 109.419 165.528 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.601 HD23 ' N ' ' A' ' 995' ' ' LEU . 26.3 mt -61.3 -43.92 98.08 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 170.288 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1029 ' ' ALA . . . . . 0.41 ' HA ' HG22 ' A' ' 933' ' ' VAL . . . -59.5 -42.78 92.95 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 111.429 0.159 . . . . 0.0 111.429 173.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' 1026 ' ' HIS . 10.5 t -66.42 -50.58 66.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.237 0 CA-C-O 121.61 0.719 . . . . 0.0 110.346 -178.276 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1031 ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -72.24 -39.54 68.4 Favored 'General case' 0 C--O 1.204 -1.308 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.113 -176.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.514 ' HB1' HG23 ' A' ' 929' ' ' VAL . . . -63.83 -35.44 80.63 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.917 -0.313 . . . . 0.0 110.235 176.429 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 8.0 tmtm? -61.57 -44.23 97.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.607 0.718 . . . . 0.0 109.624 172.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.51 ' O ' HG22 ' A' 1038 ' ' VAL . 40.5 t30 -70.8 -53.57 14.88 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 114.868 -1.06 . . . . 0.0 111.165 -177.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.616 HD22 ' HB2' ' A' ' 991' ' ' LEU . 0.0 OUTLIER -59.0 -42.17 89.43 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.192 -173.375 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.838 ' HB2' HG12 ' A' ' 925' ' ' VAL . 3.9 pp -62.9 -48.59 78.29 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 118.372 -1.331 . . . . 0.0 109.762 178.411 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.434 ' N ' HD11 ' A' 1036 ' ' LEU . 24.0 t70 -52.21 -38.61 58.45 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 114.165 -1.38 . . . . 0.0 110.784 175.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.512 HG13 HD13 ' A' 1039 ' ' ILE . 25.3 t -62.46 -50.62 79.14 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.916 0 CA-C-N 113.96 -1.473 . . . . 0.0 112.827 -179.383 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.777 HG12 HG13 ' A' ' 984' ' ' ILE . 1.5 mp -76.36 -29.33 18.79 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 CA-C-N 119.881 1.219 . . . . 0.0 111.666 -177.185 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.576 ' O ' ' HG3' ' A' 1043 ' ' ARG . 1.2 m-20 -55.87 -51.16 68.53 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.278 167.346 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1041 ' ' GLN . . . . . 0.613 ' O ' ' HB3' ' A' 1044 ' ' LEU . 36.2 mt-30 -77.1 -23.29 51.85 Favored 'General case' 0 C--N 1.312 -1.036 0 O-C-N 121.911 -0.493 . . . . 0.0 111.552 177.028 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.641 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -55.53 -52.94 62.01 Favored 'General case' 0 CA--C 1.495 -1.161 0 CA-C-O 121.577 0.703 . . . . 0.0 111.011 176.372 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.576 ' HG3' ' O ' ' A' 1040 ' ' ASP . 0.0 OUTLIER -63.55 -35.53 80.79 Favored 'General case' 0 N--CA 1.432 -1.365 0 CA-C-N 114.775 -1.102 . . . . 0.0 108.401 -179.536 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.613 ' HB3' ' O ' ' A' 1041 ' ' GLN . 6.7 tt . . . . . 0 C--N 1.332 -0.168 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.407 175.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt . . . . . 0 CA--C 1.531 0.216 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.765 HG11 HD12 ' A' 1036 ' ' LEU . 0.2 OUTLIER -70.72 -29.88 39.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 172.899 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . 0.549 ' HA ' ' HB ' ' A' ' 929' ' ' VAL . 0.1 OUTLIER -79.02 -21.0 47.58 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 178.566 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -73.15 -43.43 61.56 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 114.602 -1.181 . . . . 0.0 109.893 171.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.706 ' OD1' ' HB ' ' A' ' 964' ' ' THR . 69.7 m-80 -74.95 -27.32 60.14 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 119.159 0.89 . . . . 0.0 111.581 174.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.6 HG13 HG21 ' A' ' 933' ' ' VAL . 42.8 t -65.78 -33.31 62.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.194 167.245 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.677 ' O ' ' HB2' ' A' ' 934' ' ' LYS . 98.8 m -65.58 -42.68 91.46 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 119.372 0.987 . . . . 0.0 109.778 174.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -73.41 -53.9 7.21 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 120.603 -0.808 . . . . 0.0 113.621 179.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.495 ' O ' HG22 ' A' ' 936' ' ' VAL . 1.5 pp -64.47 -47.62 78.33 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -176.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.6 HG21 HG13 ' A' ' 929' ' ' VAL . 72.8 t -67.49 -36.61 76.87 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 CA-C-O 121.073 0.463 . . . . 0.0 111.028 -175.208 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.677 ' HB2' ' O ' ' A' ' 930' ' ' THR . 4.1 mmtp -62.75 -42.81 99.85 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.149 -179.642 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.499 ' HA ' ' SD ' ' A' ' 939' ' ' MET . . . -59.31 -35.47 73.86 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.717 0.294 . . . . 0.0 111.36 177.204 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.757 ' O ' ' HB2' ' A' ' 940' ' ' SER . 66.8 t -54.55 -74.87 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.729 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 21.1 pt -71.61 -42.5 71.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -174.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -64.42 -53.31 50.36 Favored 'General case' 0 C--O 1.243 0.738 0 CA-C-O 121.521 0.676 . . . . 0.0 110.634 -172.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.544 ' HB3' ' HE1' ' A' ' 954' ' ' MET . 1.8 mpt? -71.21 -24.67 62.25 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 119.439 -0.904 . . . . 0.0 109.131 -178.545 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.757 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 5.0 t . . . . . 0 N--CA 1.454 -0.265 0 CA-C-O 121.824 0.821 . . . . 0.0 110.867 -175.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.594 ' CE1' ' HD3' ' A' 1018 ' ' LYS . 23.1 m-85 . . . . . 0 C--O 1.216 -0.69 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 0.739 ' HA ' ' CG2' ' A' ' 955' ' ' VAL . 43.4 t -56.13 -44.71 99.83 Favored Pre-proline 0 C--N 1.323 -0.57 0 C-N-CA 123.005 0.522 . . . . 0.0 111.322 171.014 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 0.576 ' O ' ' HB3' ' A' ' 956' ' ' LYS . 47.0 Cg_exo -52.34 -36.36 68.31 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 121.843 1.696 . . . . 0.0 111.915 170.169 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.544 ' HE1' ' HB3' ' A' ' 939' ' ' MET . 32.3 ttm -76.69 -31.01 56.95 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.123 176.001 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.837 HG22 ' HE2' ' A' 1002 ' ' MET . 85.4 t -53.26 -39.36 34.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 168.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.576 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 0.7 OUTLIER -63.8 -39.64 94.74 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.124 175.104 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -76.18 -46.7 27.23 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.442 -171.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.641 HG21 HD22 ' A' ' 962' ' ' LEU . 11.7 p -87.8 -28.45 5.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.347 -178.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . 0.507 ' O ' ' HG2' ' A' ' 963' ' ' ARG . . . -61.99 -46.93 93.05 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.471 -0.871 . . . . 0.0 111.2 176.379 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . 0.457 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 9.5 tt -64.62 -34.27 77.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.039 0.447 . . . . 0.0 110.206 177.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.43 ' O ' ' HB3' ' A' ' 928' ' ' ASN . . . -72.5 -46.78 53.12 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -178.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.842 HD11 HD21 ' A' ' 995' ' ' LEU . 4.0 pp -84.55 -18.07 36.86 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 119.345 -0.36 . . . . 0.0 111.482 -176.37 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.507 ' HG2' ' O ' ' A' ' 959' ' ' GLY . 8.5 ptp180 -70.31 -37.9 74.84 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 118.829 -1.148 . . . . 0.0 110.091 166.673 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 964' ' ' THR . . . . . 0.706 ' HB ' ' OD1' ' A' ' 928' ' ' ASN . 10.5 m -71.13 -26.46 63.02 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.488 ' CD1' HG23 ' A' ' 925' ' ' VAL . 9.7 tp -63.27 -46.36 87.19 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.618 169.145 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.786 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 9.7 tt -66.62 -33.25 75.24 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -177.437 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . 0.514 ' HA ' ' HB3' ' A' ' 970' ' ' ASP . . . -75.24 -32.95 61.26 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 115.342 -0.845 . . . . 0.0 112.224 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 2.4 p -71.53 -35.26 70.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.173 0.511 . . . . 0.0 110.157 176.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.735 HG11 HG22 ' A' ' 984' ' ' ILE . 48.6 t -74.45 -34.92 37.41 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.731 170.345 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.618 ' HB2' HE22 ' A' ' 988' ' ' GLN . 12.8 t70 -66.66 -41.57 87.97 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 122.422 1.106 . . . . 0.0 108.77 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.671 ' O ' HG21 ' A' ' 975' ' ' VAL . 36.0 tt0 -66.23 -29.11 69.29 Favored 'General case' 0 N--CA 1.436 -1.171 0 CA-C-N 113.818 -1.537 . . . . 0.0 110.308 178.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 69.0 m -69.62 -19.09 63.64 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.643 175.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.905 ' HA ' HD13 ' A' ' 984' ' ' ILE . 5.8 tt -66.09 -51.14 47.58 Favored Pre-proline 0 N--CA 1.454 -0.272 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.333 -177.747 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.67 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 1.1 Cg_endo -85.7 0.18 8.53 Favored 'Trans proline' 0 C--N 1.357 1.01 0 C-N-CA 121.85 1.7 . . . . 0.0 113.416 173.191 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.671 HG21 ' O ' ' A' ' 971' ' ' GLU . 11.6 t . . . . . 0 N--CA 1.465 0.291 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.045 171.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.66 HG22 ' HB2' ' A' 1042 ' ' ALA . 14.4 m . . . . . 0 CA--C 1.532 0.278 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.649 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 16.1 m-70 -50.25 -39.1 43.95 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.013 -177.714 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 14.9 ptm180 -82.1 -18.56 42.59 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.675 -0.239 . . . . 0.0 111.121 -170.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.879 ' HG2' ' HB3' ' A' 1042 ' ' ALA . 1.3 tp10 -75.19 -43.02 54.38 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 172.231 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.905 HD13 ' HA ' ' A' ' 973' ' ' LEU . 3.2 mp -65.54 -32.63 59.06 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 177.227 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . 0.649 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 34.6 mt-10 -55.25 -52.4 63.51 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.305 0.574 . . . . 0.0 110.262 174.417 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 45.8 ttm -72.71 -40.39 66.21 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 114.979 -1.01 . . . . 0.0 111.261 -173.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.802 ' HB3' ' HB2' ' A' 1035 ' ' LEU . . . -75.02 -50.93 14.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.524 -1.216 . . . . 0.0 112.71 -172.189 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.786 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 3.1 pt20 -62.88 -21.99 66.39 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 120.074 -0.651 . . . . 0.0 109.803 175.443 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . 0.722 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 59.2 tttt -74.91 -39.97 61.14 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.491 170.625 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.425 ' HB3' ' O ' ' A' ' 987' ' ' ALA . 18.0 tp -52.54 -59.22 4.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.665 177.576 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.552 ' HB3' ' CD1' ' A' 1035 ' ' LEU . 2.4 pp -59.8 -34.84 73.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.771 0.796 . . . . 0.0 109.481 177.795 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . 0.722 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 24.6 t-20 -52.85 -54.03 40.27 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 113.747 -1.569 . . . . 0.0 112.08 -178.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 6.0 m -78.83 -30.32 45.22 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 112.054 0.391 . . . . 0.0 112.054 -179.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.12 -42.76 88.74 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 119.488 -0.885 . . . . 0.0 111.488 176.33 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.842 HD21 HD11 ' A' ' 962' ' ' LEU . 1.2 pp -62.62 -23.26 66.97 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 122.717 0.407 . . . . 0.0 110.223 170.549 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -78.45 -27.23 46.39 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 119.456 -0.898 . . . . 0.0 110.406 174.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -73.99 -45.71 48.29 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 170.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.853 HD23 ' HE2' ' A' 1021 ' ' MET . 0.7 OUTLIER -56.7 -42.97 80.05 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.559 -1.2 . . . . 0.0 111.184 -178.508 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.686 ' HA ' ' HE1' ' A' 1002 ' ' MET . 69.0 mt -65.37 -43.99 94.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 O-C-N 122.458 -0.151 . . . . 0.0 111.255 -179.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 23.6 m-80 -60.4 -36.02 77.12 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.233 0.54 . . . . 0.0 111.446 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.48 ' O ' ' HB3' ' A' 1017 ' ' TYR . 13.5 mptt -73.56 -47.18 42.63 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.729 -174.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1002 ' ' MET . . . . . 1.018 ' HB3' ' HG3' ' A' 1021 ' ' MET . 16.1 ptt? -65.1 -23.79 67.25 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.841 0.829 . . . . 0.0 109.577 179.139 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.529 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 8.7 tptm -70.99 -44.99 64.8 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.162 -165.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.568 ' HB3' HD22 ' A' 1013 ' ' LEU . 6.7 mp -83.02 -13.09 56.57 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.913 178.62 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1005 ' ' ALA . . . . . 0.622 ' HB2' ' CB ' ' A' 1017 ' ' TYR . . . -70.47 -37.41 74.25 Favored 'General case' 0 C--O 1.211 -0.951 0 C-N-CA 118.904 -1.118 . . . . 0.0 109.532 178.202 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.815 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 3.9 pp0? -75.47 -40.12 57.81 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 119.151 -0.452 . . . . 0.0 111.874 171.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.571 ' HG3' ' CD2' ' A' 1008 ' ' TYR . 5.6 pt20 -53.68 -37.97 63.73 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 121.32 0.581 . . . . 0.0 110.349 -175.747 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.81 ' HB2' HD21 ' A' 1013 ' ' LEU . 73.4 m-85 -128.99 43.18 3.19 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.364 169.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 1.028 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 14.7 p -48.99 -21.91 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.702 169.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1010 ' ' MET . . . . . 0.484 ' N ' HG11 ' A' 1009 ' ' VAL . 65.3 mtt -31.8 -55.97 0.29 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.111 -1.404 . . . . 0.0 111.548 172.062 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1011 ' ' THR . . . . . 0.416 HG23 ' O ' ' A' 1010 ' ' MET . 1.7 p -159.25 -91.04 0.03 OUTLIER 'General case' 0 C--O 1.249 1.062 0 N-CA-C 113.332 0.864 . . . . 0.0 113.332 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 32.4 t -51.27 -65.57 0.53 Allowed 'General case' 0 C--O 1.237 0.41 0 CA-C-N 114.411 -1.268 . . . . 0.0 112.399 -166.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1013 ' ' LEU . . . . . 0.81 HD21 ' HB2' ' A' 1008 ' ' TYR . 8.0 mp -47.88 -43.26 28.46 Favored 'General case' 0 CA--C 1.507 -0.674 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -179.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 1.028 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -57.08 -47.79 80.17 Favored 'General case' 0 C--N 1.319 -0.753 0 O-C-N 123.299 0.374 . . . . 0.0 111.509 -167.724 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A 1015 ' ' GLN . . . . . 0.725 ' O ' ' HB3' ' A' 1019 ' ' LYS . 15.0 mm100 -72.46 -37.98 68.37 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-O 120.93 0.395 . . . . 0.0 111.13 -176.651 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -69.33 -55.28 10.91 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.631 0.729 . . . . 0.0 110.828 -179.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.695 ' CE2' ' HG ' ' A' 1013 ' ' LEU . 13.6 m-85 -65.49 -39.57 92.07 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.758 -1.11 . . . . 0.0 113.779 -174.489 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.594 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 25.5 tptp -79.9 -28.91 39.8 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.501 -176.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1019 ' ' LYS . . . . . 0.725 ' HB3' ' O ' ' A' 1015 ' ' GLN . 0.0 OUTLIER -73.23 -45.32 56.77 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 175.072 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -54.91 -35.34 64.05 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.822 162.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1021 ' ' MET . . . . . 1.018 ' HG3' ' HB3' ' A' 1002 ' ' MET . 1.9 tmt? -64.71 -51.92 59.85 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 110.275 -0.268 . . . . 0.0 110.275 -179.021 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1022 ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' 1022 ' ' LEU . 0.0 OUTLIER -78.69 -8.61 58.86 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 119.511 -0.876 . . . . 0.0 109.778 -175.613 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 91.8 m -86.09 -36.88 19.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.08 174.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.549 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -79.28 -22.76 44.22 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-O 121.412 0.625 . . . . 0.0 109.415 173.743 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.678 ' HB3' HG21 ' A' ' 936' ' ' VAL . . . -86.27 -24.83 25.81 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.193 169.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.55 ' O ' HG21 ' A' 1030 ' ' VAL . 53.3 t60 -69.21 -36.28 77.09 Favored 'General case' 0 C--O 1.211 -0.947 0 N-CA-C 108.569 -0.901 . . . . 0.0 108.569 164.104 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1027 ' ' ALA . . . . . 0.549 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -58.4 -45.43 88.37 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 123.453 0.701 . . . . 0.0 111.204 162.043 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.638 ' HB2' ' HA ' ' A' 1025 ' ' ALA . 31.4 mt -56.96 -46.57 82.07 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 118.706 0.684 . . . . 0.0 109.64 173.642 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -59.33 -43.64 92.69 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 173.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.55 HG21 ' O ' ' A' 1026 ' ' HIS . 17.0 t -66.15 -50.68 67.01 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 CA-C-O 121.854 0.835 . . . . 0.0 110.721 -177.104 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.77 ' O ' HD13 ' A' 1035 ' ' LEU . 17.3 m-20 -75.96 -31.05 58.85 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.139 -175.137 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.569 ' HA ' ' CD1' ' A' 1035 ' ' LEU . . . -69.13 -34.02 74.36 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 171.684 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.544 ' HB3' ' O ' ' A' 1030 ' ' VAL . 0.0 OUTLIER -58.63 -37.4 75.85 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 167.63 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.448 ' O ' ' HB3' ' A' 1037 ' ' ASP . 53.2 t30 -79.35 -51.41 9.44 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 114.334 -1.303 . . . . 0.0 112.702 -173.057 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.802 ' HB2' ' HB3' ' A' ' 987' ' ' ALA . 0.0 OUTLIER -59.8 -31.39 69.66 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 119.142 0.883 . . . . 0.0 111.485 -174.137 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.765 HD12 HG11 ' A' ' 925' ' ' VAL . 9.9 tp -68.82 -51.24 42.8 Favored 'General case' 0 C--N 1.344 0.338 0 C-N-CA 117.262 -1.775 . . . . 0.0 109.41 175.148 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.448 ' HB3' ' O ' ' A' 1034 ' ' ASN . 25.3 t70 -45.03 -42.32 8.3 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 114.856 -1.066 . . . . 0.0 111.251 173.181 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.468 ' CG1' ' HG3' ' A' ' 983' ' ' GLU . 45.6 t -61.7 -40.6 87.34 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.489 0 CA-C-N 114.559 -1.201 . . . . 0.0 112.476 177.635 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.777 HG12 HG13 ' A' ' 984' ' ' ILE . 1.9 mp -83.31 -25.0 7.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 118.589 0.632 . . . . 0.0 110.522 177.327 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.746 ' O ' ' HG3' ' A' 1043 ' ' ARG . 68.9 m-20 -61.2 -45.1 95.97 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 164.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -62.04 -48.89 78.25 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.653 173.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.879 ' HB3' ' HG2' ' A' ' 983' ' ' GLU . . . -54.98 -45.86 75.03 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.61 -176.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.746 ' HG3' ' O ' ' A' 1040 ' ' ASP . 0.0 OUTLIER -59.9 -42.76 94.54 Favored 'General case' 0 N--CA 1.441 -0.875 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.906 -174.799 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.416 ' N ' ' HD3' ' A' 1043 ' ' ARG . 43.0 tp . . . . . 0 N--CA 1.451 -0.391 0 CA-C-O 121.13 0.49 . . . . 0.0 110.582 -178.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.433 ' HA ' ' HG2' ' A' ' 927' ' ' GLU . 35.0 mmtp . . . . . 0 CA--C 1.53 0.195 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.643 HG22 HD21 ' A' 1036 ' ' LEU . 32.2 m -62.93 -30.95 50.82 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-O 121.365 0.602 . . . . 0.0 110.322 178.325 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.38 -30.69 53.84 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.696 178.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . 0.603 ' O ' HG23 ' A' ' 930' ' ' THR . 7.7 pt-20 -76.4 -24.0 54.06 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 119.096 -1.042 . . . . 0.0 110.785 176.582 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -71.41 -29.94 65.49 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 171.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.6 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 86.9 t -80.35 -30.07 12.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.236 175.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.603 HG23 ' O ' ' A' ' 927' ' ' GLU . 2.8 t -65.81 -33.73 76.54 Favored 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 118.215 -1.394 . . . . 0.0 108.257 171.24 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -74.01 -53.51 7.02 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-N 115.366 -0.834 . . . . 0.0 113.572 176.341 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.6 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.2 pp -64.38 -48.37 75.75 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -177.16 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.448 HG23 HG11 ' A' ' 929' ' ' VAL . 54.6 t -69.35 -31.78 50.86 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.319 0 CA-C-O 120.755 0.312 . . . . 0.0 110.852 -175.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.573 ' HD2' ' C ' ' A' ' 934' ' ' LYS . 2.1 tmmm? -56.26 -50.3 71.73 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 175.44 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -57.88 -36.26 72.12 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.154 0.284 . . . . 0.0 111.29 -178.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.792 HG21 ' HB3' ' A' 1025 ' ' ALA . 86.1 t -50.82 -73.9 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.583 178.083 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 28.4 pt -67.25 -35.83 75.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -177.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -67.49 -55.73 12.38 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.733 0.778 . . . . 0.0 110.77 -174.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -73.47 -23.9 60.13 Favored 'General case' 0 N--CA 1.438 -1.067 0 C-N-CA 119.776 -0.77 . . . . 0.0 108.969 -176.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.734 ' HG ' HD12 ' A' 1022 ' ' LEU . 44.5 t . . . . . 0 N--CA 1.443 -0.817 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.617 -178.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.716 ' HB3' ' HG3' ' A' 1002 ' ' MET . 21.0 m-85 . . . . . 0 C--O 1.221 -0.396 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 0.888 HG11 ' HD3' ' A' ' 953' ' ' PRO . 3.4 p -52.22 -36.81 36.05 Favored Pre-proline 0 CA--C 1.55 0.959 0 CA-C-N 118.506 0.594 . . . . 0.0 112.557 175.045 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 0.888 ' HD3' HG11 ' A' ' 952' ' ' VAL . 37.3 Cg_exo -53.47 -40.01 80.11 Favored 'Trans proline' 0 C--N 1.358 1.045 0 C-N-CA 121.699 1.599 . . . . 0.0 112.208 169.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.65 ' O ' HG23 ' A' ' 958' ' ' VAL . 8.5 ttt -76.33 -48.86 18.56 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.005 177.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.704 HG13 ' HA ' ' A' ' 952' ' ' VAL . 0.4 OUTLIER -54.05 -31.42 21.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.545 173.736 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 5.5 tttm -65.52 -40.97 93.61 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.064 170.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . 0.552 ' HG2' ' O ' ' A' ' 954' ' ' MET . 14.5 pt-20 -79.38 -42.95 24.4 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 120.393 -0.523 . . . . 0.0 111.023 -176.2 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 954' ' ' MET . 2.2 t -66.26 -38.26 81.49 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.821 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 173.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . 0.426 ' O ' ' HG2' ' A' ' 963' ' ' ARG . . . -58.49 -38.88 92.16 Favored Glycine 0 N--CA 1.434 -1.462 0 N-CA-C 110.813 -0.915 . . . . 0.0 110.813 176.15 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . 0.607 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 25.3 tp -69.14 -35.82 76.77 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 120.766 0.317 . . . . 0.0 110.818 174.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -72.29 -43.31 64.43 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.135 0.493 . . . . 0.0 111.643 -176.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.866 HD11 ' HG ' ' A' ' 995' ' ' LEU . 4.4 pp -86.33 -16.7 36.61 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.968 -176.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.607 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 0.5 OUTLIER -75.42 -32.79 60.83 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 119.064 -1.054 . . . . 0.0 109.939 164.239 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 964' ' ' THR . . . . . 0.568 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 59.1 m -64.55 -34.44 78.25 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 175.169 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.474 HD21 HD22 ' A' 1035 ' ' LEU . 26.9 tp -62.78 -41.51 99.28 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.776 173.328 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.732 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.0 tt -70.06 -36.68 75.16 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.049 -175.327 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -72.45 -38.13 68.37 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.306 178.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 7.9 p -66.07 -41.01 91.33 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 118.644 0.656 . . . . 0.0 110.005 175.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.525 HG12 HG23 ' A' ' 984' ' ' ILE . 74.4 t -68.25 -39.11 80.58 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.526 173.631 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.816 ' HB2' HE22 ' A' ' 988' ' ' GLN . 13.1 t70 -66.53 -39.68 88.75 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 122.228 1.014 . . . . 0.0 108.77 -177.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.57 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 28.7 tt0 -70.69 -30.58 67.19 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 114.488 -1.233 . . . . 0.0 110.335 178.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 70.2 m -66.26 -17.74 64.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.272 173.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.604 ' HA ' HD13 ' A' ' 984' ' ' ILE . 10.5 tt -69.41 -51.81 16.17 Favored Pre-proline 0 CA--C 1.53 0.187 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.776 -176.085 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.57 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 94.9 Cg_endo -87.42 2.04 6.9 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 121.178 1.252 . . . . 0.0 113.45 174.426 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.436 HG22 ' O ' ' A' ' 971' ' ' GLU . 25.1 t . . . . . 0 C--N 1.328 -0.331 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.253 172.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.621 ' OG1' ' HA ' ' A' 1043 ' ' ARG . 85.5 m . . . . . 0 CA--C 1.537 0.47 0 CA-C-O 121.147 0.499 . . . . 0.0 110.778 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -50.79 -27.36 7.11 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 178.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . 0.563 ' HA ' ' HG2' ' A' ' 985' ' ' GLU . 0.0 OUTLIER -83.11 -21.87 33.55 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 119.481 1.037 . . . . 0.0 111.149 -176.127 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.433 ' HG2' ' HB3' ' A' 1042 ' ' ALA . 1.4 mp0 -77.03 -38.7 52.32 Favored 'General case' 0 CA--C 1.499 -0.981 0 CA-C-O 121.764 0.792 . . . . 0.0 109.143 168.552 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.808 HG12 HG12 ' A' 1039 ' ' ILE . 73.8 mt -68.17 -36.28 74.63 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.18 0 CA-C-N 114.145 -1.389 . . . . 0.0 109.503 -176.354 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . 0.767 ' O ' ' HD3' ' A' ' 989' ' ' LYS . 13.3 pt-20 -74.29 -40.8 62.03 Favored 'General case' 0 N--CA 1.439 -0.988 0 C-N-CA 118.159 -1.416 . . . . 0.0 109.426 -178.557 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 986' ' ' MET . . . . . 0.516 ' O ' ' HB2' ' A' ' 989' ' ' LYS . 2.1 tmt? -68.63 -40.0 80.5 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.56 -174.428 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.993 ' HB2' ' HB2' ' A' 1035 ' ' LEU . . . -71.88 -45.78 60.09 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.571 -174.104 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.816 HE22 ' HB2' ' A' ' 970' ' ' ASP . 4.4 pt20 -60.31 -23.89 64.56 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.808 175.284 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . 0.796 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 2.6 mptp? -72.55 -39.05 67.78 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.986 0.898 . . . . 0.0 111.05 171.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.584 ' HB3' ' O ' ' A' ' 987' ' ' ALA . 18.6 tp -54.32 -59.66 4.38 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.414 -1.267 . . . . 0.0 111.853 179.135 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.519 ' HB2' HD13 ' A' 1035 ' ' LEU . 0.4 OUTLIER -59.96 -33.06 71.41 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.745 0.783 . . . . 0.0 109.417 177.722 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . 0.796 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 22.7 t-20 -52.03 -52.57 50.01 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 113.911 -1.495 . . . . 0.0 111.438 179.569 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 2.6 p -77.59 -31.61 53.12 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.673 0.619 . . . . 0.0 112.673 -178.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -68.47 -40.51 80.99 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 119.729 -0.789 . . . . 0.0 111.189 176.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.866 ' HG ' HD11 ' A' ' 962' ' ' LEU . 0.9 OUTLIER -57.09 -36.65 70.84 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.066 0.546 . . . . 0.0 109.935 166.843 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -66.65 -30.39 70.63 Favored 'General case' 0 C--N 1.312 -1.052 0 C-N-CA 118.985 -1.086 . . . . 0.0 110.903 174.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -75.42 -38.33 59.86 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.853 -0.53 . . . . 0.0 110.678 174.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.866 HD12 ' HB1' ' A' 1025 ' ' ALA . 1.7 tp -56.23 -44.85 80.0 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 120.968 0.413 . . . . 0.0 110.843 178.546 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.508 ' O ' ' HB2' ' A' 1003 ' ' LYS . 77.8 mt -61.21 -43.97 97.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.084 -176.493 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 32.0 m-80 -58.64 -37.49 76.06 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.251 0.548 . . . . 0.0 111.915 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.501 ' O ' ' HB3' ' A' 1017 ' ' TYR . 33.6 mmtp -79.1 -40.92 29.88 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 122.291 1.043 . . . . 0.0 108.656 -176.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.716 ' HG3' ' HB3' ' A' ' 951' ' ' TYR . 9.0 tpp -61.15 -30.09 70.18 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 113.693 -1.594 . . . . 0.0 109.461 176.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.56 ' O ' ' HG3' ' A' 1006 ' ' GLN . 4.8 tptm -75.41 -53.54 8.54 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 114.928 -1.033 . . . . 0.0 111.696 -166.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.728 ' HB3' HD21 ' A' 1013 ' ' LEU . 7.3 mp -76.61 -12.43 60.01 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.149 -178.593 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1005 ' ' ALA . . . . . 0.653 ' HB3' ' HB3' ' A' 1017 ' ' TYR . . . -67.91 -42.63 80.81 Favored 'General case' 0 C--O 1.212 -0.874 0 C-N-CA 119.525 -0.87 . . . . 0.0 109.153 177.034 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.882 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -74.77 -33.16 62.25 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 119.024 -0.512 . . . . 0.0 111.668 170.3 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.637 ' HA ' HE21 ' A' 1007 ' ' GLN . 0.0 OUTLIER -47.53 -53.37 14.62 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.116 0.484 . . . . 0.0 110.388 175.609 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.88 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 40.1 m-85 -119.6 40.35 3.4 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.277 -0.569 . . . . 0.0 110.407 175.249 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 1.106 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 14.8 p -51.62 -22.29 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 121.382 0.611 . . . . 0.0 110.632 173.733 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1010 ' ' MET . . . . . 0.425 ' N ' HG12 ' A' 1009 ' ' VAL . 20.0 mmt -41.16 -38.18 1.03 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.242 -1.345 . . . . 0.0 111.706 175.486 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1011 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -174.47 -81.77 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 174.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 16.6 p -53.43 -73.52 0.04 OUTLIER 'General case' 0 C--O 1.241 0.649 0 CA-C-N 115.12 -0.945 . . . . 0.0 113.051 -166.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1013 ' ' LEU . . . . . 0.88 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 3.2 mp -46.1 -42.17 13.27 Favored 'General case' 0 CA--C 1.501 -0.921 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -179.502 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 1.106 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -57.33 -46.37 83.33 Favored 'General case' 0 N--CA 1.438 -1.035 0 O-C-N 123.753 0.658 . . . . 0.0 111.616 -166.552 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A 1015 ' ' GLN . . . . . 0.708 ' O ' ' HB3' ' A' 1019 ' ' LYS . 47.2 mt-30 -72.52 -34.46 67.6 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 121.013 0.435 . . . . 0.0 110.103 -174.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -71.17 -53.25 15.11 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.856 0.836 . . . . 0.0 110.466 176.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.711 ' CE2' ' HG ' ' A' 1013 ' ' LEU . 7.1 m-85 -67.77 -38.82 83.92 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.618 -1.174 . . . . 0.0 113.95 -172.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.573 ' HZ2' ' HE1' ' A' ' 951' ' ' TYR . 24.0 tptm -80.03 -29.88 39.42 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.91 -176.216 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1019 ' ' LYS . . . . . 0.708 ' HB3' ' O ' ' A' 1015 ' ' GLN . 1.5 tmtt? -76.21 -40.32 52.51 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.73 176.552 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1020 ' ' GLN . . . . . 0.424 ' N ' ' HD3' ' A' 1019 ' ' LYS . 25.4 mt-30 -63.9 -28.48 69.86 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.731 162.84 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.698 ' HG2' HD11 ' A' ' 998' ' ' LEU . 1.6 ttp -65.61 -47.11 76.77 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 176.622 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1022 ' ' LEU . . . . . 0.734 HD12 ' HG ' ' A' ' 940' ' ' SER . 0.0 OUTLIER -79.19 -8.96 59.42 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 119.165 -1.014 . . . . 0.0 109.767 -179.249 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 92.2 m -77.0 -44.03 32.5 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 172.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.465 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.88 -21.1 47.96 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-O 121.383 0.611 . . . . 0.0 109.659 175.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.866 ' HB1' HD12 ' A' ' 998' ' ' LEU . . . -83.94 -24.01 30.88 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.128 170.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.523 ' HB2' ' O ' ' A' 1022 ' ' LEU . 1.9 t60 -77.96 -22.66 49.15 Favored 'General case' 0 C--O 1.216 -0.658 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 165.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1027 ' ' ALA . . . . . 0.459 ' HB1' ' O ' ' A' 1024 ' ' ALA . . . -69.6 -42.39 74.47 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 123.094 0.558 . . . . 0.0 109.768 162.378 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.655 HD23 ' N ' ' A' ' 995' ' ' LEU . 34.7 mt -57.25 -49.48 75.93 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 169.696 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -58.05 -43.23 86.77 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 174.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.459 ' O ' ' HB2' ' A' 1033 ' ' LYS . 2.8 t -67.72 -51.01 55.23 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.234 0 CA-C-O 121.287 0.565 . . . . 0.0 110.394 -176.1 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.583 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 18.0 m-20 -76.6 -27.31 55.73 Favored 'General case' 0 C--O 1.213 -0.821 0 CA-C-N 115.475 -0.784 . . . . 0.0 112.024 -176.424 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.644 ' HA ' HD23 ' A' 1035 ' ' LEU . . . -61.47 -40.7 95.47 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 167.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.459 ' HB2' ' O ' ' A' 1030 ' ' VAL . 94.3 mttt -62.86 -39.72 95.27 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.444 0.64 . . . . 0.0 109.72 171.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.583 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 46.6 t30 -76.26 -54.67 6.45 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.856 -170.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.993 ' HB2' ' HB2' ' A' ' 987' ' ' ALA . 0.6 OUTLIER -61.71 -42.99 99.69 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 118.782 -0.628 . . . . 0.0 110.953 -173.307 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.648 ' H ' HD21 ' A' 1035 ' ' LEU . 4.6 pp -70.04 -39.87 75.46 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 116.472 -2.091 . . . . 0.0 109.628 -178.67 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.503 ' N ' HD12 ' A' 1036 ' ' LEU . 38.2 t70 -53.23 -43.33 67.21 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 122.098 0.951 . . . . 0.0 110.83 173.249 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.538 ' HB ' ' O ' ' A' 1035 ' ' LEU . 9.7 t -50.83 -48.82 27.99 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.585 0 CA-C-N 114.061 -1.427 . . . . 0.0 111.299 172.29 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.808 HG12 HG12 ' A' ' 984' ' ' ILE . 2.7 mp -74.95 -34.05 31.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 118.45 0.568 . . . . 0.0 110.912 178.36 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.493 ' O ' ' HG3' ' A' 1043 ' ' ARG . 83.5 m-20 -51.39 -53.9 31.94 Favored 'General case' 0 C--O 1.246 0.88 0 CA-C-O 122.403 1.097 . . . . 0.0 109.237 172.165 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -76.78 -32.14 57.48 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 115.122 -0.945 . . . . 0.0 110.9 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.658 ' HB1' ' HA ' ' A' 1039 ' ' ILE . . . -54.82 -50.84 67.6 Favored 'General case' 0 CA--C 1.501 -0.922 0 C-N-CA 123.389 0.676 . . . . 0.0 111.62 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.655 ' HD3' ' N ' ' A' 1044 ' ' LEU . 0.0 OUTLIER -61.94 -37.66 85.54 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.723 -176.622 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.655 ' N ' ' HD3' ' A' 1043 ' ' ARG . 15.4 mt . . . . . 0 CA--C 1.532 0.285 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.967 178.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.568 ' HB3' HG22 ' A' ' 968' ' ' THR . 51.2 mmtt . . . . . 0 N--CA 1.447 -0.6 0 CA-C-O 120.906 0.384 . . . . 0.0 111.249 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.658 ' CG2' ' HB2' ' A' 1036 ' ' LEU . 17.0 m -62.04 -35.06 66.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.365 0.602 . . . . 0.0 110.8 -178.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.5 -27.16 51.78 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 118.598 -0.715 . . . . 0.0 111.863 177.383 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . 0.497 ' O ' HG21 ' A' ' 930' ' ' THR . 6.6 pt-20 -75.75 -23.81 56.03 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 120.482 1.492 . . . . 0.0 109.784 178.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -76.36 -29.14 57.07 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 121.347 0.594 . . . . 0.0 110.19 172.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.619 HG22 HD21 ' A' 1036 ' ' LEU . 82.0 t -82.15 -31.99 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.729 175.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.497 HG21 ' O ' ' A' ' 927' ' ' GLU . 5.8 t -62.47 -29.34 70.46 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 120.349 1.432 . . . . 0.0 107.873 171.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -70.32 -52.22 18.41 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-N 114.452 -1.249 . . . . 0.0 113.17 171.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.576 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.0 pp -62.16 -48.31 80.66 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 117.648 0.724 . . . . 0.0 112.792 -178.03 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.692 ' O ' HG22 ' A' ' 936' ' ' VAL . 56.7 t -60.81 -41.83 90.06 Favored 'Isoleucine or valine' 0 C--O 1.239 0.535 0 CA-C-O 121.777 0.799 . . . . 0.0 109.703 -177.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -53.72 -43.3 68.92 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.7 -1.136 . . . . 0.0 110.322 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -67.89 -31.64 71.57 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -176.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.692 HG22 ' O ' ' A' ' 933' ' ' VAL . 2.9 m -61.59 -56.95 14.45 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.271 0 C-N-CA 121.004 -0.278 . . . . 0.0 111.048 -174.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.434 ' N ' HG23 ' A' ' 936' ' ' VAL . 7.1 pt -78.52 -40.32 24.3 Favored 'Isoleucine or valine' 0 C--O 1.25 1.118 0 CA-C-O 121.12 0.486 . . . . 0.0 111.257 -178.478 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -65.55 -49.21 69.75 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.696 -171.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 26.2 mmt -71.92 -26.18 62.2 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.6 -179.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 940' ' ' SER . . . . . . . . . . . . . 5.2 m . . . . . 0 CA--C 1.515 -0.368 0 CA-C-O 121.218 0.533 . . . . 0.0 111.421 -176.121 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.795 ' CE1' ' HD3' ' A' 1018 ' ' LYS . 39.0 m-85 . . . . . 0 N--CA 1.467 0.385 0 N-CA-C 114.397 1.258 . . . . 0.0 114.397 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 0.835 HG22 ' HE1' ' A' 1002 ' ' MET . 22.3 t -43.66 -48.45 19.72 Favored Pre-proline 0 C--N 1.322 -0.606 0 C-N-CA 122.793 0.437 . . . . 0.0 111.98 174.291 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 0.609 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 13.8 Cg_exo -47.6 -49.26 13.71 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 122.861 2.374 . . . . 0.0 113.995 178.303 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.622 ' HG3' ' O ' ' A' ' 951' ' ' TYR . 4.5 ppp? -76.43 -32.26 58.35 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.212 0.529 . . . . 0.0 110.54 179.297 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.5 ' HA ' HG11 ' A' ' 958' ' ' VAL . 78.5 t -57.42 -35.3 49.0 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.374 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.327 168.156 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.489 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 9.9 tmtt? -65.71 -32.25 73.7 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.626 0.25 . . . . 0.0 111.122 173.489 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -77.99 -45.45 23.74 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.831 0.348 . . . . 0.0 110.993 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.5 HG11 ' HA ' ' A' ' 955' ' ' VAL . 13.3 p -76.4 -31.95 21.21 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.19 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.069 178.386 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . 0.471 ' O ' ' HG2' ' A' ' 963' ' ' ARG . . . -61.21 -38.39 95.57 Favored Glycine 0 N--CA 1.446 -0.685 0 N-CA-C 110.867 -0.893 . . . . 0.0 110.867 173.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . 0.482 HD12 HH11 ' A' ' 963' ' ' ARG . 15.5 tp -64.26 -42.79 96.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.929 0.395 . . . . 0.0 110.506 175.285 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -73.28 -34.61 65.87 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.087 0.47 . . . . 0.0 111.936 -176.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.835 HD13 HD22 ' A' ' 995' ' ' LEU . 3.6 pp -80.83 -30.34 35.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.83 -179.092 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.482 HH11 HD12 ' A' ' 960' ' ' LEU . 9.8 ptp85 -72.71 -33.8 66.68 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 119.629 -0.828 . . . . 0.0 110.943 170.538 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 964' ' ' THR . . . . . 0.454 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 17.6 m -66.57 -33.52 75.85 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 119.603 -0.839 . . . . 0.0 108.974 176.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.483 ' O ' HG23 ' A' ' 969' ' ' VAL . 17.2 tp -60.84 -49.45 77.44 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.558 0.694 . . . . 0.0 109.612 170.306 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.558 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.4 tt -55.26 -45.34 76.1 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 114.459 -1.246 . . . . 0.0 109.735 -178.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -66.42 -42.01 88.39 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.007 -0.997 . . . . 0.0 112.131 178.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.568 HG22 ' HB3' ' A' ' 924' ' ' LYS . 0.8 OUTLIER -61.85 -34.91 76.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 119.193 0.906 . . . . 0.0 110.817 175.838 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.962 HG13 HG22 ' A' ' 984' ' ' ILE . 52.7 t -73.38 -42.03 57.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.916 175.54 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.947 ' HB2' HE22 ' A' ' 988' ' ' GLN . 31.4 t70 -69.9 -40.02 75.86 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 122.111 0.957 . . . . 0.0 109.228 -175.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.604 ' O ' HG22 ' A' ' 975' ' ' VAL . 9.1 tp10 -66.69 -31.89 72.84 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.63 -1.168 . . . . 0.0 109.483 177.036 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.652 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 27.3 m -68.76 -17.35 64.02 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.256 174.681 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.733 ' HB2' HG23 ' A' ' 984' ' ' ILE . 9.0 tt -64.39 -51.94 57.07 Favored Pre-proline 0 C--O 1.226 -0.134 0 C-N-CA 120.451 -0.499 . . . . 0.0 109.969 -178.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.732 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 6.3 Cg_exo -80.99 -4.0 12.5 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 121.515 1.477 . . . . 0.0 113.262 171.571 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.652 ' HB ' ' HA ' ' A' ' 972' ' ' SER . 24.6 t . . . . . 0 C--N 1.329 -0.294 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.204 172.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.773 ' HG1' ' HA ' ' A' 1043 ' ' ARG . 20.6 m . . . . . 0 CA--C 1.532 0.255 0 CA-C-O 121.382 0.611 . . . . 0.0 110.308 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.613 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 11.6 m170 -50.88 -39.71 54.63 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 115.061 -0.972 . . . . 0.0 111.722 177.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . 0.422 ' HE ' ' HB3' ' A' ' 982' ' ' ARG . 5.6 ptp180 -83.41 -20.71 33.67 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.629 -0.428 . . . . 0.0 112.116 -173.03 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.589 ' HG2' ' HB1' ' A' 1042 ' ' ALA . 1.3 mp0 -71.44 -34.7 70.51 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-O 121.614 0.721 . . . . 0.0 109.275 167.58 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.962 HG22 HG13 ' A' ' 969' ' ' VAL . 58.1 mt -72.24 -30.52 35.84 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-N 114.662 -1.154 . . . . 0.0 108.895 179.282 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . 0.613 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 35.5 mt-10 -65.41 -52.46 53.22 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.569 174.199 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 51.9 tpp -70.83 -42.52 70.09 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.913 -171.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.634 ' HB3' ' HB3' ' A' 1035 ' ' LEU . . . -74.21 -50.69 18.09 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.45 -172.263 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.947 HE22 ' HB2' ' A' ' 970' ' ' ASP . 2.7 pt20 -65.48 -22.2 66.71 Favored 'General case' 0 C--O 1.226 -0.151 0 CA-C-O 121.617 0.723 . . . . 0.0 109.204 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . 0.726 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 9.0 ttmm -73.47 -44.42 58.01 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 114.786 -1.097 . . . . 0.0 112.018 171.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.674 ' HB3' HD23 ' A' 1035 ' ' LEU . 15.6 tp -57.39 -58.36 8.62 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 119.569 -0.852 . . . . 0.0 111.705 -179.173 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.514 ' HB3' HD22 ' A' 1035 ' ' LEU . 3.2 pp -57.86 -29.62 65.15 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.38 0.609 . . . . 0.0 110.358 177.82 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . 0.726 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 44.9 t-20 -55.55 -55.91 26.41 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.637 -1.165 . . . . 0.0 110.986 175.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 46.2 m -73.01 -32.98 65.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.997 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . 0.713 ' C ' HD23 ' A' ' 998' ' ' LEU . 2.6 m-20 -55.08 -62.5 1.62 Allowed 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.903 174.412 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.835 HD22 HD13 ' A' ' 962' ' ' LEU . 18.0 tp -48.2 -30.06 4.32 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 123.291 0.37 . . . . 0.0 111.165 175.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -69.74 -37.87 76.63 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 119.556 -0.858 . . . . 0.0 111.764 178.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -78.26 -39.55 39.81 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.523 0.677 . . . . 0.0 109.937 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 1.038 HD21 ' HG ' ' A' 1028 ' ' LEU . 0.0 OUTLIER -58.18 -34.18 70.05 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.086 179.746 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.807 HG21 ' HE3' ' A' 1002 ' ' MET . 44.1 mt -67.1 -37.74 79.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 CA-C-N 115.11 -0.95 . . . . 0.0 111.78 172.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.56 -34.77 74.64 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.365 0.602 . . . . 0.0 111.668 179.159 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.715 ' HD2' ' OE1' ' A' 1020 ' ' GLN . 42.8 mmtm -82.61 -41.34 19.63 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.418 0.628 . . . . 0.0 110.904 -175.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.835 ' HE1' HG22 ' A' ' 952' ' ' VAL . 0.0 OUTLIER -61.25 -25.95 67.43 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 122.248 1.023 . . . . 0.0 108.642 175.326 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.594 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 26.8 tptt -71.83 -54.07 11.29 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 113.913 -1.494 . . . . 0.0 110.458 -167.338 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.796 ' HB3' HD21 ' A' 1013 ' ' LEU . 8.7 mp -73.65 -13.48 61.0 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.671 -179.424 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1005 ' ' ALA . . . . . 0.738 ' HB3' ' HB3' ' A' 1017 ' ' TYR . . . -68.97 -44.98 71.82 Favored 'General case' 0 C--N 1.319 -0.747 0 C-N-CA 119.533 -0.867 . . . . 0.0 109.983 178.087 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.861 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 1.0 OUTLIER -74.44 -28.57 61.11 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 121.891 -0.506 . . . . 0.0 111.265 173.406 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.933 ' HA ' HE21 ' A' 1007 ' ' GLN . 0.0 OUTLIER -50.16 -57.54 7.51 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.277 0.56 . . . . 0.0 110.25 173.995 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 1.035 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 24.2 m-85 -107.16 35.06 3.17 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.984 175.355 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 1.012 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 11.2 p -45.39 -29.11 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.494 0 O-C-N 123.536 0.522 . . . . 0.0 110.954 174.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1010 ' ' MET . . . . . 0.407 ' N ' HG11 ' A' 1009 ' ' VAL . 25.8 ttp -40.47 -45.78 2.31 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.52 -1.218 . . . . 0.0 111.599 178.745 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1011 ' ' THR . . . . . 0.403 ' HG1' ' C ' ' A' 1010 ' ' MET . 28.1 m -161.53 -82.37 0.04 OUTLIER 'General case' 0 C--O 1.245 0.853 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 176.367 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 11.2 p -55.75 -71.64 0.08 Allowed 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.067 -0.97 . . . . 0.0 113.115 -164.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1013 ' ' LEU . . . . . 1.035 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 6.5 mp -51.84 -38.0 54.18 Favored 'General case' 0 CA--C 1.506 -0.736 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -178.207 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 1.012 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -55.19 -53.54 54.76 Favored 'General case' 0 N--CA 1.442 -0.837 0 O-C-N 123.423 0.452 . . . . 0.0 111.599 -168.264 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A 1015 ' ' GLN . . . . . 0.465 HE21 ' HB3' ' A' 1015 ' ' GLN . 1.3 pt20 -73.45 -36.55 65.91 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.569 -175.677 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1016 ' ' GLU . . . . . 0.445 ' HG2' ' NE2' ' A' 1020 ' ' GLN . 36.5 tt0 -68.27 -57.63 5.67 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.566 178.775 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.741 ' CE1' ' HG ' ' A' 1013 ' ' LEU . 7.3 m-85 -62.03 -33.15 73.82 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 113.696 0.999 . . . . 0.0 113.696 -176.324 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.795 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 35.0 tptt -80.24 -32.12 38.43 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.582 -176.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1019 ' ' LYS . . . . . 0.45 ' HA ' ' HD2' ' A' 1019 ' ' LYS . 0.2 OUTLIER -74.59 -35.37 63.0 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 176.347 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A 1020 ' ' GLN . . . . . 0.715 ' OE1' ' HD2' ' A' 1001 ' ' LYS . 77.5 mt-30 -56.59 -41.16 76.52 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.718 158.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.536 ' HB3' ' HD2' ' A' 1018 ' ' LYS . 1.5 tmt? -65.99 -51.8 55.12 Favored 'General case' 0 C--O 1.219 -0.544 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -172.468 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.84 -18.5 53.91 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 119.676 -0.81 . . . . 0.0 110.394 -172.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 34.6 m -84.17 -27.02 28.36 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 175.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.732 ' HB2' ' CD1' ' A' ' 998' ' ' LEU . . . -81.36 -28.14 34.59 Favored 'General case' 0 C--O 1.212 -0.904 0 CA-C-N 115.454 -0.793 . . . . 0.0 109.596 172.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.556 ' HA ' ' HB2' ' A' 1028 ' ' LEU . . . -83.38 -19.6 35.76 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 169.399 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.522 ' O ' HG21 ' A' 1030 ' ' VAL . 32.7 t-80 -75.12 -21.75 58.65 Favored 'General case' 0 C--O 1.213 -0.863 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 161.522 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1027 ' ' ALA . . . . . 0.665 ' HB1' ' O ' ' A' 1024 ' ' ALA . . . -74.32 -39.46 62.84 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.33 0.652 . . . . 0.0 110.098 166.464 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 1.038 ' HG ' HD21 ' A' ' 998' ' ' LEU . 23.0 mt -55.92 -49.59 73.03 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 164.037 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1029 ' ' ALA . . . . . 0.509 ' CB ' HG22 ' A' ' 933' ' ' VAL . . . -60.21 -38.79 84.4 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 112.64 0.607 . . . . 0.0 112.64 177.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.522 HG21 ' O ' ' A' 1026 ' ' HIS . 11.3 t -75.89 -51.46 20.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.358 0.599 . . . . 0.0 110.995 -175.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.581 ' O ' HD21 ' A' 1035 ' ' LEU . 6.6 m-20 -75.39 -33.59 61.02 Favored 'General case' 0 C--O 1.212 -0.907 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.149 -176.384 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.424 ' HB1' HD23 ' A' ' 965' ' ' LEU . . . -70.88 -24.99 62.6 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.559 -0.456 . . . . 0.0 109.938 174.333 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.489 ' HB3' ' O ' ' A' 1030 ' ' VAL . 50.6 tttm -63.38 -52.2 62.64 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 167.4 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.48 ' O ' HG21 ' A' 1038 ' ' VAL . 52.5 t30 -63.51 -50.12 70.84 Favored 'General case' 0 C--O 1.209 -1.038 0 CA-C-N 114.599 -1.182 . . . . 0.0 111.48 -177.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.674 HD23 ' HB3' ' A' ' 990' ' ' LEU . 0.0 OUTLIER -59.29 -42.07 90.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 119.395 -0.336 . . . . 0.0 110.498 -178.067 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.658 ' HB2' ' CG2' ' A' ' 925' ' ' VAL . 3.2 pp -69.69 -41.26 75.66 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 117.549 -1.66 . . . . 0.0 109.295 179.712 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 14.1 t70 -56.3 -40.0 73.64 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 114.37 -1.287 . . . . 0.0 109.786 175.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.52 ' HB ' ' O ' ' A' 1035 ' ' LEU . 6.6 t -53.47 -48.34 58.0 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.091 0 CA-C-N 113.822 -1.536 . . . . 0.0 111.053 174.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.633 ' HA ' ' HB2' ' A' 1042 ' ' ALA . 2.0 mp -74.27 -33.96 35.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 118.792 0.723 . . . . 0.0 111.044 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.43 ' O ' ' HG3' ' A' 1043 ' ' ARG . 0.5 OUTLIER -62.06 -49.87 74.23 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.21 0.529 . . . . 0.0 110.084 174.353 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -63.7 -40.71 97.47 Favored 'General case' 0 C--O 1.213 -0.862 0 C-N-CA 120.334 -0.546 . . . . 0.0 109.612 172.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.633 ' HB2' ' HA ' ' A' 1039 ' ' ILE . . . -53.3 -52.83 57.85 Favored 'General case' 0 CA--C 1.494 -1.205 0 C-N-CA 123.619 0.768 . . . . 0.0 112.115 -175.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.773 ' HA ' ' HG1' ' A' ' 980' ' ' THR . 0.1 OUTLIER -61.93 -44.12 97.42 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.034 -174.83 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.61 ' N ' ' HD3' ' A' 1043 ' ' ARG . 3.7 tt . . . . . 0 N--CA 1.445 -0.707 0 CA-C-O 121.484 0.659 . . . . 0.0 110.291 -175.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . . . . . . . . . 2.0 tppp? . . . . . 0 CA--C 1.535 0.368 0 CA-C-O 120.766 0.317 . . . . 0.0 111.38 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.711 HG22 HD23 ' A' 1036 ' ' LEU . 26.9 m -64.15 -29.34 47.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.316 0.579 . . . . 0.0 111.092 176.043 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -70.51 -32.93 70.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.441 -178.628 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . 0.777 ' HA ' ' HB ' ' A' ' 930' ' ' THR . 10.8 pt-20 -76.91 -24.22 52.47 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 118.951 -1.1 . . . . 0.0 111.004 176.059 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -69.14 -31.08 69.5 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 172.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.66 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 43.7 t -80.45 -30.76 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.516 173.174 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.777 ' HB ' ' HA ' ' A' ' 927' ' ' GLU . 6.2 m -56.09 -43.32 77.94 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 166.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -69.54 -52.9 18.91 Favored Glycine 0 CA--C 1.531 1.074 0 CA-C-N 114.744 -1.116 . . . . 0.0 113.941 175.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.66 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.9 pp -65.78 -45.88 80.83 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 117.508 0.654 . . . . 0.0 112.763 -174.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 56.0 t -66.05 -36.43 77.45 Favored 'Isoleucine or valine' 0 C--O 1.239 0.509 0 CA-C-O 121.21 0.529 . . . . 0.0 110.636 -177.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.5 ' O ' ' HB3' ' A' ' 938' ' ' GLU . 60.9 tttt -63.79 -31.88 73.2 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.574 179.15 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.612 ' O ' ' HB2' ' A' ' 939' ' ' MET . . . -66.27 -40.88 90.43 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 121.946 -0.472 . . . . 0.0 110.724 175.124 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.801 HG23 ' HB2' ' A' 1025 ' ' ALA . 54.1 t -50.38 -76.73 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.342 -177.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.423 HG13 ' N ' ' A' ' 938' ' ' GLU . 25.0 pt -80.35 -45.29 22.15 Favored 'Isoleucine or valine' 0 C--O 1.244 0.776 0 CA-C-O 121.191 0.52 . . . . 0.0 112.188 -173.539 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.5 ' HB3' ' O ' ' A' ' 934' ' ' LYS . 31.7 tt0 -67.92 -47.36 68.97 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-O 121.267 0.556 . . . . 0.0 109.665 -169.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.678 ' SD ' ' HE1' ' A' ' 954' ' ' MET . 63.6 mtt -74.46 -23.94 58.97 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.814 178.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.649 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 29.1 p . . . . . 0 N--CA 1.471 0.576 0 CA-C-O 121.578 0.704 . . . . 0.0 110.512 -176.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.996 ' HB3' ' HG2' ' A' 1002 ' ' MET . 24.9 m-85 . . . . . 0 C--O 1.22 -0.495 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 0.686 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 64.4 t -60.54 -53.14 67.46 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 110.466 -0.198 . . . . 0.0 110.466 175.398 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 0.686 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 17.3 Cg_exo -48.55 -34.5 26.61 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 122.315 2.01 . . . . 0.0 113.03 167.169 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.678 ' HE1' ' SD ' ' A' ' 939' ' ' MET . 34.3 tpp -73.26 -31.99 64.42 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.145 177.049 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.621 HG23 ' HE2' ' A' 1002 ' ' MET . 89.0 t -52.33 -39.53 28.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 169.62 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.516 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 8.0 tttt -67.31 -37.36 83.21 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.692 174.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -78.68 -46.82 18.24 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.992 0.368 . . . . 0.0 111.992 -173.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.552 HG12 HD23 ' A' ' 998' ' ' LEU . 12.5 p -86.63 -24.87 6.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 -178.206 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -65.25 -27.13 72.05 Favored Glycine 0 N--CA 1.445 -0.754 0 N-CA-C 110.24 -1.144 . . . . 0.0 110.24 171.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . 0.543 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 10.3 tt -76.92 -35.14 57.54 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.253 -0.473 . . . . 0.0 109.957 175.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -71.17 -42.09 69.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.306 -175.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.846 HD12 HD23 ' A' ' 991' ' ' LEU . 0.5 OUTLIER -67.41 -42.83 82.62 Favored 'General case' 0 C--O 1.217 -0.628 0 CA-C-O 118.853 -0.594 . . . . 0.0 111.056 170.757 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.543 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 29.2 ptt180 -64.87 -31.55 72.84 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 119.912 1.233 . . . . 0.0 110.381 -179.067 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 34.2 m -68.79 -33.99 74.79 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.495 HD23 HD22 ' A' 1035 ' ' LEU . 22.0 tp -70.92 -36.27 72.6 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.581 -1.19 . . . . 0.0 109.556 176.027 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.587 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.5 tt -71.77 -39.5 69.92 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 114.828 -1.078 . . . . 0.0 108.399 -175.312 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -74.05 -28.05 61.22 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 114.986 -1.006 . . . . 0.0 112.155 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.496 ' OG1' HG12 ' A' ' 925' ' ' VAL . 5.2 p -74.46 -41.05 61.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 118.475 0.579 . . . . 0.0 110.164 175.324 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.878 HG12 HG23 ' A' ' 984' ' ' ILE . 60.8 t -68.73 -36.48 74.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.564 172.251 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.736 ' HB2' HE22 ' A' ' 988' ' ' GLN . 24.1 t70 -70.87 -37.37 73.07 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.626 0.727 . . . . 0.0 109.175 179.652 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.607 ' O ' HG22 ' A' ' 975' ' ' VAL . 14.0 tp10 -65.88 -32.85 74.6 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.418 176.434 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 69.8 m -69.04 -17.59 63.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.055 175.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.705 ' HB2' HG21 ' A' ' 984' ' ' ILE . 9.2 tt -67.68 -51.42 30.79 Favored Pre-proline 0 CA--C 1.538 0.505 0 CA-C-O 119.543 -0.265 . . . . 0.0 110.43 -178.184 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.445 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 90.2 Cg_endo -82.9 2.07 8.72 Favored 'Trans proline' 0 C--N 1.356 0.932 0 C-N-CA 121.359 1.373 . . . . 0.0 112.955 170.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.607 HG22 ' O ' ' A' ' 971' ' ' GLU . 26.0 t . . . . . 0 C--N 1.33 -0.248 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 166.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 980' ' ' THR . . . . . . . . . . . . . 89.7 m . . . . . 0 C--O 1.232 0.179 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.556 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 0.3 OUTLIER -58.12 -33.43 69.14 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 114.152 -1.386 . . . . 0.0 111.669 -179.861 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -84.25 -21.02 31.28 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 120.29 -0.564 . . . . 0.0 112.404 -176.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.491 ' HG3' HG11 ' A' 1038 ' ' VAL . 0.3 OUTLIER -73.14 -33.62 65.62 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 168.382 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.878 HG23 HG12 ' A' ' 969' ' ' VAL . 52.6 mt -68.66 -31.99 53.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.213 176.812 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . 0.556 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 46.2 mt-10 -62.69 -53.48 53.8 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.348 0.594 . . . . 0.0 109.751 175.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 89.8 mtp -69.84 -43.45 71.9 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.557 -171.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 1.017 ' HB3' ' HB2' ' A' 1035 ' ' LEU . . . -67.78 -51.03 53.64 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.062 -0.972 . . . . 0.0 112.636 -171.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.736 HE22 ' HB2' ' A' ' 970' ' ' ASP . 3.7 pt20 -63.52 -28.39 69.92 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 119.815 -0.754 . . . . 0.0 111.232 -179.33 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . 0.725 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 90.9 mttt -70.04 -40.95 74.84 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.59 0.709 . . . . 0.0 111.492 172.46 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.603 HD22 ' HB3' ' A' 1035 ' ' LEU . 14.2 tp -49.6 -60.81 2.53 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 114.799 -1.092 . . . . 0.0 113.013 -176.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.846 HD23 HD12 ' A' ' 962' ' ' LEU . 5.1 tt -69.14 -27.45 65.57 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.239 0.542 . . . . 0.0 109.547 -179.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . 0.725 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 33.1 t-20 -51.08 -50.67 58.27 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.355 177.371 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 14.6 m -76.85 -33.32 57.9 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -65.31 -40.82 94.28 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 120.499 -0.481 . . . . 0.0 111.872 177.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.57 ' HA ' ' HB3' ' A' ' 998' ' ' LEU . 6.3 tt -71.28 -14.33 62.18 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 174.16 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -76.51 -26.27 55.09 Favored 'General case' 0 C--N 1.315 -0.893 0 C-N-CA 119.633 -0.827 . . . . 0.0 110.023 167.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.64 ' O ' ' HG2' ' A' 1001 ' ' LYS . 5.4 mm-40 -74.4 -43.75 54.98 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 173.223 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.788 HD13 ' HE1' ' A' 1021 ' ' MET . 0.1 OUTLIER -55.08 -46.45 75.44 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.162 -0.926 . . . . 0.0 111.205 -178.657 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.535 ' HA ' ' HE1' ' A' 1002 ' ' MET . 95.1 mt -64.97 -42.66 95.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.666 -176.292 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -60.82 -41.62 96.08 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.174 0.511 . . . . 0.0 111.829 -178.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.857 ' HB3' ' HG3' ' A' 1020 ' ' GLN . 59.8 mmtt -73.86 -42.86 60.19 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 122.63 1.205 . . . . 0.0 108.457 -176.168 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.996 ' HG2' ' HB3' ' A' ' 951' ' ' TYR . 31.6 ttp -62.09 -28.57 69.71 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 113.101 -1.863 . . . . 0.0 109.307 179.499 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 8.7 tptm -69.43 -52.66 24.74 Favored 'General case' 0 N--CA 1.439 -0.999 0 CA-C-N 114.17 -1.377 . . . . 0.0 110.726 -169.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.603 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 93.1 mt -74.7 -13.24 60.59 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.443 -179.103 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1005 ' ' ALA . . . . . 0.527 ' HB2' ' CB ' ' A' 1017 ' ' TYR . . . -66.72 -46.95 73.86 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 119.585 -0.846 . . . . 0.0 109.797 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.946 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 3.5 pp0? -70.61 -31.41 68.37 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 118.942 -0.551 . . . . 0.0 112.145 171.003 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.564 ' HG3' HD21 ' A' 1004 ' ' LEU . 18.2 mm-40 -48.76 -51.1 30.83 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.149 0.499 . . . . 0.0 111.287 178.321 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.88 ' HB2' ' HG ' ' A' 1013 ' ' LEU . 89.2 m-85 -121.87 43.13 2.93 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 120.279 -0.569 . . . . 0.0 109.861 172.033 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 0.961 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 7.7 p -51.71 -19.9 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.515 -0.4 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.81 172.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 87.6 mmm -32.09 -53.61 0.29 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.055 -1.43 . . . . 0.0 111.065 170.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1011 ' ' THR . . . . . . . . . . . . . 23.9 m -161.66 -80.77 0.04 OUTLIER 'General case' 0 C--O 1.246 0.878 0 CA-C-O 121.188 0.518 . . . . 0.0 112.265 176.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 3.2 p -55.51 -65.45 0.59 Allowed 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.256 -0.883 . . . . 0.0 113.224 -167.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1013 ' ' LEU . . . . . 0.88 ' HG ' ' HB2' ' A' 1008 ' ' TYR . 1.9 mm? -44.81 -45.38 10.06 Favored 'General case' 0 CA--C 1.508 -0.649 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 178.155 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 0.961 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -59.58 -48.13 82.87 Favored 'General case' 0 N--CA 1.442 -0.843 0 C-N-CA 119.985 -0.686 . . . . 0.0 110.941 -164.984 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -70.44 -40.42 73.77 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.639 -174.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -73.89 -41.04 62.72 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.286 0.565 . . . . 0.0 111.558 -177.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.737 ' CE1' HD11 ' A' 1013 ' ' LEU . 19.2 m-85 -81.1 -28.97 34.98 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 122.019 0.914 . . . . 0.0 112.442 -170.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.652 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 38.0 tptt -78.71 -28.4 45.08 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 113.933 -1.485 . . . . 0.0 110.29 178.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -71.86 -56.86 4.97 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.398 176.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1020 ' ' GLN . . . . . 0.857 ' HG3' ' HB3' ' A' 1001 ' ' LYS . 10.3 pt20 -53.69 -26.21 21.72 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 119.708 -0.187 . . . . 0.0 110.799 166.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.788 ' HE1' HD13 ' A' ' 998' ' ' LEU . 2.1 tmt? -66.51 -51.75 53.3 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 118.207 0.458 . . . . 0.0 110.62 173.705 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1022 ' ' LEU . . . . . 0.761 ' HA ' ' HB1' ' A' 1025 ' ' ALA . 0.2 OUTLIER -88.63 -1.76 58.24 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 119.205 -0.998 . . . . 0.0 109.84 -175.234 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A 1023 ' ' THR . . . . . 0.424 ' HB ' ' HA ' ' A' 1020 ' ' GLN . 33.1 m -87.1 -39.15 15.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.447 171.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.527 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -76.92 -21.24 55.16 Favored 'General case' 0 C--O 1.222 -0.356 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 170.636 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.801 ' HB2' HG23 ' A' ' 936' ' ' VAL . . . -84.52 -25.44 28.79 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.169 169.624 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.599 ' O ' HG22 ' A' 1030 ' ' VAL . 4.1 t60 -74.17 -26.82 60.52 Favored 'General case' 0 C--O 1.217 -0.639 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 167.045 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1027 ' ' ALA . . . . . 0.489 ' HB2' ' O ' ' A' 1024 ' ' ALA . . . -68.01 -42.46 80.67 Favored 'General case' 0 C--N 1.321 -0.654 0 C-N-CA 123.454 0.701 . . . . 0.0 110.327 164.318 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.626 HD11 HD21 ' A' ' 998' ' ' LEU . 20.3 mt -57.08 -46.61 82.39 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 170.463 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -58.07 -41.75 84.04 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 111.711 0.263 . . . . 0.0 111.711 173.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.599 HG22 ' O ' ' A' 1026 ' ' HIS . 19.3 t -67.8 -51.79 46.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 121.276 0.56 . . . . 0.0 110.952 -175.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.495 ' OD1' HD23 ' A' ' 990' ' ' LEU . 12.9 m-20 -76.64 -28.9 56.21 Favored 'General case' 0 C--O 1.217 -0.611 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.882 -175.833 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.569 ' HB2' HG21 ' A' ' 929' ' ' VAL . . . -59.38 -38.29 80.14 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 168.729 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 65.2 tttp -65.45 -47.42 76.2 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.748 0.785 . . . . 0.0 109.621 172.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.453 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 38.2 t30 -68.13 -52.38 35.5 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 114.319 -1.31 . . . . 0.0 112.202 -172.076 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 1.017 ' HB2' ' HB3' ' A' ' 987' ' ' ALA . 3.8 pp -60.67 -37.05 80.27 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 -176.166 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.711 HD23 HG22 ' A' ' 925' ' ' VAL . 0.3 OUTLIER -68.17 -46.38 70.9 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 117.521 -1.672 . . . . 0.0 109.638 176.077 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 19.1 t70 -49.66 -39.15 35.28 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 122.238 1.018 . . . . 0.0 110.299 176.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.491 HG11 ' HG3' ' A' ' 983' ' ' GLU . 19.0 t -58.35 -45.25 89.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 113.665 -1.607 . . . . 0.0 112.38 175.716 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.637 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 2.0 mp -78.32 -31.59 16.23 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 CA-C-N 118.599 0.636 . . . . 0.0 110.722 177.504 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -58.42 -40.58 82.9 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-O 120.945 0.403 . . . . 0.0 110.377 172.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -76.12 -37.94 57.48 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.642 0.258 . . . . 0.0 110.689 172.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.637 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -54.48 -46.36 73.37 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.908 -179.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.627 ' HG2' ' O ' ' A' 1039 ' ' ILE . 11.5 ptm180 -71.97 -42.53 66.41 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.205 -176.662 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.407 ' O ' HD23 ' A' 1044 ' ' LEU . 3.3 tt . . . . . 0 C--N 1.332 -0.182 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 177.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp . . . . . 0 N--CA 1.455 -0.224 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.513 HG22 ' HB2' ' A' 1036 ' ' LEU . 28.6 m -55.19 -41.41 60.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-N 117.959 0.345 . . . . 0.0 111.312 -179.695 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . 0.601 ' HA ' ' HB ' ' A' ' 929' ' ' VAL . 0.2 OUTLIER -79.26 -20.25 48.57 Favored 'General case' 0 CA--C 1.504 -0.801 0 O-C-N 122.105 -0.372 . . . . 0.0 111.003 179.583 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.73 -24.07 45.08 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 118.09 -1.444 . . . . 0.0 112.541 171.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -70.9 -26.78 63.37 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 167.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.636 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 53.7 t -74.99 -32.22 26.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 114.223 -1.353 . . . . 0.0 110.419 174.67 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.507 ' O ' ' HB2' ' A' ' 934' ' ' LYS . 9.7 m -59.82 -42.99 94.75 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 119.032 0.833 . . . . 0.0 108.986 170.584 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -69.58 -52.46 20.85 Favored Glycine 0 CA--C 1.528 0.86 0 CA-C-N 115.242 -0.89 . . . . 0.0 113.557 178.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.636 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.9 pp -65.73 -49.39 68.61 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -176.097 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.547 HG21 ' HA ' ' A' 1029 ' ' ALA . 54.0 t -66.86 -40.85 86.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-O 120.872 0.368 . . . . 0.0 111.186 -173.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.651 ' O ' ' HG2' ' A' ' 938' ' ' GLU . 0.1 OUTLIER -58.3 -47.08 84.81 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.206 179.984 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -57.13 -43.19 82.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.19 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.835 HG22 ' HB1' ' A' 1025 ' ' ALA . 70.9 t -43.53 -68.32 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.892 177.731 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 13.7 pt -71.11 -49.69 47.18 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 N-CA-C 112.802 0.668 . . . . 0.0 112.802 -176.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.651 ' HG2' ' O ' ' A' ' 934' ' ' LYS . 11.6 pt-20 -73.06 -34.93 66.57 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 119.779 -0.768 . . . . 0.0 111.295 -169.142 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.426 ' HE2' ' HG3' ' A' ' 957' ' ' GLU . 62.5 mtt -74.33 -36.74 63.68 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 118.388 -1.325 . . . . 0.0 109.356 177.537 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.647 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 44.8 t . . . . . 0 CA--C 1.516 -0.355 0 CA-C-N 114.609 -1.178 . . . . 0.0 113.082 -168.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.569 ' HB3' ' CG ' ' A' 1002 ' ' MET . 0.3 OUTLIER . . . . . 0 C--O 1.22 -0.453 0 CA-C-O 120.89 0.376 . . . . 0.0 109.989 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 0.631 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 59.0 t -53.7 -48.23 94.02 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.867 170.762 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 0.631 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 81.7 Cg_exo -53.07 -34.16 66.72 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 121.917 1.744 . . . . 0.0 112.499 172.547 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.496 ' O ' HG11 ' A' ' 958' ' ' VAL . 6.9 tpt -76.19 -31.43 58.46 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.065 177.641 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.833 HG23 ' HE3' ' A' 1002 ' ' MET . 75.4 t -53.39 -44.05 53.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 173.666 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 6.1 tmtt? -67.81 -34.01 75.91 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.828 -1.078 . . . . 0.0 112.055 175.009 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . 0.495 ' HB2' ' HA ' ' A' ' 954' ' ' MET . 25.3 mm-40 -77.63 -46.87 20.76 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -175.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.496 HG11 ' O ' ' A' ' 954' ' ' MET . 12.0 p -80.17 -31.86 13.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -59.35 -40.1 95.58 Favored Glycine 0 N--CA 1.444 -0.767 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 175.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . 0.517 HD11 ' HD3' ' A' ' 963' ' ' ARG . 23.7 tp -67.1 -33.6 75.83 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.66 -0.27 . . . . 0.0 111.112 176.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -80.38 -59.33 2.74 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.829 0.347 . . . . 0.0 110.696 -176.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.973 HD11 HD21 ' A' ' 995' ' ' LEU . 3.3 pp -50.76 -35.27 30.8 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.547 -0.751 . . . . 0.0 112.512 172.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.534 ' N ' HD13 ' A' ' 962' ' ' LEU . 12.2 ptm180 -71.67 -38.77 70.6 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 119.958 1.254 . . . . 0.0 110.825 174.24 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 41.7 m -62.89 -34.42 77.35 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 176.188 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.893 HD23 HD22 ' A' ' 991' ' ' LEU . 26.3 tp -66.84 -45.31 78.65 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 114.845 -1.071 . . . . 0.0 111.021 176.044 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.619 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.4 tt -66.98 -36.14 81.53 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 -176.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . 0.4 ' O ' ' HB2' ' A' ' 971' ' ' GLU . . . -72.66 -34.44 67.25 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 115.168 -0.923 . . . . 0.0 112.15 178.336 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 1.9 p -67.71 -37.63 82.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 119.031 0.832 . . . . 0.0 109.9 174.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.581 HG12 HG23 ' A' ' 984' ' ' ILE . 84.6 t -69.29 -40.6 80.43 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.535 172.518 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.547 ' HB2' HE22 ' A' ' 988' ' ' GLN . 18.9 t70 -68.17 -39.67 82.51 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.876 0.846 . . . . 0.0 109.216 -178.26 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.598 ' O ' HG22 ' A' ' 975' ' ' VAL . 6.8 tp10 -61.78 -36.56 81.44 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.553 -1.203 . . . . 0.0 109.135 176.082 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.451 ' HB2' ' O ' ' A' ' 969' ' ' VAL . 71.5 m -65.66 -19.56 65.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.361 176.23 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.635 ' HA ' HD13 ' A' ' 984' ' ' ILE . 51.7 tp -66.75 -52.31 34.29 Favored Pre-proline 0 CA--C 1.53 0.187 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.539 -174.145 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.603 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 95.7 Cg_endo -85.37 2.65 7.67 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 121.055 1.17 . . . . 0.0 112.996 172.148 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.598 HG22 ' O ' ' A' ' 971' ' ' GLU . 33.8 t . . . . . 0 C--N 1.328 -0.326 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 166.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.493 HG22 ' HB3' ' A' 1042 ' ' ALA . 65.4 m . . . . . 0 C--O 1.227 -0.094 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -55.19 -35.87 65.3 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 113.772 -1.558 . . . . 0.0 111.264 176.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . 0.594 ' HA ' ' HG2' ' A' ' 985' ' ' GLU . 1.5 ptp180 -82.99 -19.79 36.36 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.408 -0.517 . . . . 0.0 111.124 -178.276 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.513 ' HG3' HG13 ' A' 1038 ' ' VAL . 1.2 mp0 -77.17 -33.64 56.5 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 119.69 -0.804 . . . . 0.0 109.126 171.178 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.696 ' HA ' HD13 ' A' 1039 ' ' ILE . 67.9 mt -71.87 -34.78 52.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 CA-C-N 114.952 -1.022 . . . . 0.0 109.909 179.34 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . 0.594 ' HG2' ' HA ' ' A' ' 982' ' ' ARG . 10.7 pt-20 -70.21 -44.96 67.56 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.697 0.76 . . . . 0.0 109.563 -179.252 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 986' ' ' MET . . . . . 0.524 ' HA ' ' HD3' ' A' ' 989' ' ' LYS . 66.3 mtt -73.63 -42.92 60.79 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 114.786 -1.097 . . . . 0.0 111.715 -172.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.842 ' HB3' ' HB2' ' A' 1035 ' ' LEU . . . -68.24 -51.37 46.03 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.809 -173.824 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.619 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 3.5 pt20 -61.44 -24.32 66.47 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 120.497 -0.481 . . . . 0.0 110.754 177.727 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . 0.655 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 0.0 OUTLIER -76.12 -38.86 56.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.011 0.434 . . . . 0.0 111.181 173.842 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 12.3 tp -53.24 -59.74 4.18 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.692 -0.686 . . . . 0.0 112.107 178.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.893 HD22 HD23 ' A' ' 965' ' ' LEU . 9.9 tp -57.82 -38.5 75.72 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-O 121.529 0.68 . . . . 0.0 109.711 177.682 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . 0.655 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 42.4 t-20 -49.34 -51.32 35.26 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 113.895 -1.502 . . . . 0.0 111.549 -176.396 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 993' ' ' SER . . . . . 0.439 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 28.7 t -78.17 -31.53 49.68 Favored 'General case' 0 C--N 1.319 -0.717 0 C-N-CA 120.163 -0.615 . . . . 0.0 111.969 179.267 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . 0.405 ' O ' ' HB2' ' A' ' 997' ' ' GLU . 0.1 OUTLIER -71.32 -34.6 70.72 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 119.146 -1.021 . . . . 0.0 111.76 -179.925 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.973 HD21 HD11 ' A' ' 962' ' ' LEU . 3.0 pp -71.71 -16.95 62.25 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 171.22 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -78.59 -27.0 45.58 Favored 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 119.981 -0.688 . . . . 0.0 109.898 167.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' ' 993' ' ' SER . 5.0 mm-40 -72.15 -45.29 61.09 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 173.012 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.81 HD12 ' HB2' ' A' 1025 ' ' ALA . 0.1 OUTLIER -56.17 -48.03 77.12 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.941 -176.074 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.586 ' O ' ' HB2' ' A' 1003 ' ' LYS . 91.6 mt -66.75 -40.59 86.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.265 -175.329 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 16.7 m-80 -62.04 -40.15 94.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.344 0.592 . . . . 0.0 111.709 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.842 ' HD3' ' HG2' ' A' 1020 ' ' GLN . 86.6 mttt -79.84 -40.84 27.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 122.097 0.951 . . . . 0.0 109.288 -175.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.833 ' HE3' HG23 ' A' ' 955' ' ' VAL . 22.5 ttp -61.06 -26.38 67.6 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.232 -1.349 . . . . 0.0 109.637 175.18 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.586 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 11.5 tptp -74.12 -54.96 6.69 Favored 'General case' 0 N--CA 1.438 -1.037 0 CA-C-N 114.894 -1.048 . . . . 0.0 111.551 -171.43 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.74 ' HA ' ' HB2' ' A' 1007 ' ' GLN . 7.6 mp -68.05 -13.73 62.43 Favored 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 120.305 -0.558 . . . . 0.0 110.73 179.389 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1005 ' ' ALA . . . . . 0.826 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -69.86 -42.2 73.84 Favored 'General case' 0 C--O 1.213 -0.841 0 C-N-CA 119.768 -0.773 . . . . 0.0 109.326 176.075 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.965 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -77.35 -34.57 55.09 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 119.063 -0.494 . . . . 0.0 111.754 171.224 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.74 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 14.7 mm100 -46.14 -49.01 17.26 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.399 0.618 . . . . 0.0 110.637 175.107 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.542 ' HB2' HD23 ' A' 1013 ' ' LEU . 60.0 m-85 -126.99 46.28 2.54 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.602 0.715 . . . . 0.0 110.584 172.738 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 1.117 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 10.7 p -54.05 -18.53 2.45 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.352 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.219 170.255 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 84.5 mtp -49.32 -38.17 26.82 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 113.796 -1.547 . . . . 0.0 111.731 174.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1011 ' ' THR . . . . . 0.406 ' O ' ' HB3' ' A' 1014 ' ' GLN . 0.0 OUTLIER -162.55 -102.82 0.02 OUTLIER 'General case' 0 C--O 1.245 0.862 0 N-CA-C 114.976 1.473 . . . . 0.0 114.976 179.729 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 19.7 m -57.7 -60.52 3.56 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.906 -164.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1013 ' ' LEU . . . . . 0.707 ' HG ' ' CE2' ' A' 1017 ' ' TYR . 3.1 mp -45.85 -43.09 13.21 Favored 'General case' 0 CA--C 1.506 -0.734 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 177.08 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 1.117 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.99 -50.21 69.57 Favored 'General case' 0 N--CA 1.443 -0.822 0 O-C-N 123.752 0.658 . . . . 0.0 111.879 -168.972 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A 1015 ' ' GLN . . . . . 0.679 ' O ' ' HB3' ' A' 1019 ' ' LYS . 12.8 mm100 -70.26 -41.62 73.25 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.433 -174.383 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1016 ' ' GLU . . . . . 0.447 ' O ' ' HD3' ' A' 1019 ' ' LYS . 30.2 tt0 -69.3 -55.04 11.65 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.338 0.59 . . . . 0.0 110.833 178.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.826 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 9.9 m-85 -60.08 -38.8 83.98 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -176.602 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.561 ' HA ' ' HB3' ' A' 1021 ' ' MET . 23.5 tptm -81.21 -30.45 34.26 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.539 -178.406 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1019 ' ' LYS . . . . . 0.679 ' HB3' ' O ' ' A' 1015 ' ' GLN . 0.1 OUTLIER -73.34 -39.04 65.53 Favored 'General case' 0 C--O 1.222 -0.36 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 175.17 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A 1020 ' ' GLN . . . . . 0.842 ' HG2' ' HD3' ' A' 1001 ' ' LYS . 10.3 tt0 -63.66 -32.41 73.88 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.424 165.24 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.561 ' HB3' ' HA ' ' A' 1018 ' ' LYS . 2.0 tmt? -64.25 -51.12 65.19 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 177.538 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1022 ' ' LEU . . . . . 0.614 ' HB3' ' HG ' ' A' ' 940' ' ' SER . 0.0 OUTLIER -81.82 -6.82 59.4 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 119.343 -0.943 . . . . 0.0 109.919 -175.005 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 62.8 m -87.33 -36.75 17.66 Favored 'General case' 0 C--O 1.223 -0.313 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 173.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.507 ' O ' ' HB2' ' A' 1027 ' ' ALA . . . -79.08 -22.72 44.88 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 172.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.835 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -86.14 -22.44 27.05 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.113 169.612 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.58 ' O ' HG23 ' A' 1030 ' ' VAL . 83.7 t60 -76.43 -25.0 53.99 Favored 'General case' 0 C--O 1.214 -0.792 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 165.319 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1027 ' ' ALA . . . . . 0.507 ' HB2' ' O ' ' A' 1024 ' ' ALA . . . -69.14 -41.09 77.77 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 123.783 0.833 . . . . 0.0 109.959 163.332 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.67 ' CD1' HD22 ' A' ' 998' ' ' LEU . 18.0 mt -60.44 -45.58 93.14 Favored 'General case' 0 C--N 1.314 -0.95 0 C-N-CA 119.933 -0.707 . . . . 0.0 109.259 170.072 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1029 ' ' ALA . . . . . 0.547 ' HA ' HG21 ' A' ' 933' ' ' VAL . . . -57.55 -42.91 83.93 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.41 0.148 . . . . 0.0 111.274 173.41 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.58 HG23 ' O ' ' A' 1026 ' ' HIS . 12.3 t -67.4 -52.16 44.84 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 CA-C-O 121.652 0.739 . . . . 0.0 110.648 -177.781 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.453 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 38.8 m-20 -77.34 -29.39 53.44 Favored 'General case' 0 C--O 1.216 -0.681 0 CA-C-N 114.742 -1.117 . . . . 0.0 112.207 -174.51 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.97 ' HA ' HD22 ' A' 1035 ' ' LEU . . . -71.82 -29.9 64.92 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 170.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.411 ' O ' ' HG ' ' A' 1036 ' ' LEU . 87.9 tttt -65.68 -49.36 68.86 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.823 0.821 . . . . 0.0 109.18 168.304 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.49 ' O ' ' HB3' ' A' 1037 ' ' ASP . 10.6 t30 -68.74 -44.3 74.08 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 114.383 -1.28 . . . . 0.0 112.8 -174.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.97 HD22 ' HA ' ' A' 1032 ' ' ALA . 0.2 OUTLIER -64.52 -37.63 88.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 118.039 0.382 . . . . 0.0 110.099 -176.75 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.649 ' H ' HD23 ' A' 1035 ' ' LEU . 4.0 pp -72.03 -41.57 67.37 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 117.25 -1.78 . . . . 0.0 108.888 178.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.49 ' HB3' ' O ' ' A' 1034 ' ' ASN . 7.6 t70 -49.85 -46.23 51.18 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 114.272 -1.331 . . . . 0.0 110.117 172.479 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.513 HG13 ' HG3' ' A' ' 983' ' ' GLU . 15.5 t -54.51 -47.28 71.42 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.643 0 CA-C-N 114.004 -1.453 . . . . 0.0 111.822 174.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.696 HD13 ' HA ' ' A' ' 984' ' ' ILE . 1.4 mp -77.77 -35.68 21.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 118.775 0.716 . . . . 0.0 112.076 179.338 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.746 ' HA ' ' HE ' ' A' 1043 ' ' ARG . 1.9 m-20 -59.23 -45.9 89.92 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-O 120.73 0.3 . . . . 0.0 110.832 173.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1041 ' ' GLN . . . . . 0.405 ' HB3' ' O ' ' A' 1037 ' ' ASP . 0.0 OUTLIER -77.73 -26.33 49.91 Favored 'General case' 0 N--CA 1.432 -1.353 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 176.294 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.579 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.29 -48.45 71.24 Favored 'General case' 0 CA--C 1.505 -0.773 0 C-N-CA 122.997 0.519 . . . . 0.0 111.804 175.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.746 ' HE ' ' HA ' ' A' 1040 ' ' ASP . 3.2 ptt180 -70.61 -40.5 73.15 Favored 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 120.432 -0.507 . . . . 0.0 109.75 -177.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 12.3 tp . . . . . 0 C--O 1.221 -0.432 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.104 173.608 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.464 ' HA ' ' HG2' ' A' ' 927' ' ' GLU . 12.2 mmtp . . . . . 0 N--CA 1.456 -0.169 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.609 HG21 HD23 ' A' 1036 ' ' LEU . 33.9 m -62.22 -29.86 47.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 176.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.02 -32.95 57.42 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 118.854 -0.594 . . . . 0.0 111.651 176.535 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . 0.931 ' HA ' ' HB ' ' A' ' 930' ' ' THR . 4.1 pt-20 -75.64 -25.59 56.98 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.833 1.197 . . . . 0.0 111.268 176.808 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.594 ' OD1' ' HB ' ' A' ' 964' ' ' THR . 69.8 m-80 -75.63 -26.89 58.15 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 119.338 0.972 . . . . 0.0 110.582 173.013 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.698 HG22 ' HB2' ' A' 1032 ' ' ALA . 98.4 t -75.15 -30.1 22.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 167.189 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.931 ' HB ' ' HA ' ' A' ' 927' ' ' GLU . 0.9 OUTLIER -63.26 -42.85 99.2 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 169.907 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -72.56 -54.02 7.97 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 120.667 -0.778 . . . . 0.0 113.585 176.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.641 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.8 pp -62.33 -48.47 79.67 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -176.577 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 79.7 t -67.28 -39.89 83.82 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 CA-C-O 121.103 0.477 . . . . 0.0 110.913 -175.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.62 ' HB2' ' O ' ' A' ' 930' ' ' THR . 0.2 OUTLIER -62.07 -35.38 78.47 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.683 179.036 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -64.16 -42.18 96.86 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.832 176.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.697 HG21 ' HB1' ' A' 1025 ' ' ALA . 49.6 t -49.76 -85.01 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 C-N-CA 123.36 0.664 . . . . 0.0 112.218 -179.114 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.448 ' O ' ' HB2' ' A' ' 940' ' ' SER . 15.8 pt -61.61 -42.47 94.24 Favored 'Isoleucine or valine' 0 C--O 1.248 1.005 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -173.03 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.505 ' HB3' ' O ' ' A' ' 934' ' ' LYS . 23.9 tp10 -61.5 -53.2 59.61 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.271 -172.504 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 78.4 mtp -71.3 -26.55 62.91 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.36 -177.076 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.448 ' HB2' ' O ' ' A' ' 937' ' ' ILE . 6.9 m . . . . . 0 CA--C 1.514 -0.441 0 O-C-N 124.238 0.961 . . . . 0.0 112.122 -172.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 1.105 ' HA ' ' HB3' ' A' ' 954' ' ' MET . 0.4 OUTLIER . . . . . 0 C--O 1.216 -0.67 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 0.666 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 56.8 t -64.42 -52.41 53.49 Favored Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 166.332 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 0.666 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 25.6 Cg_exo -50.01 -37.81 47.88 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 121.845 1.696 . . . . 0.0 112.474 162.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 1.105 ' HB3' ' HA ' ' A' ' 951' ' ' TYR . 3.6 tpt -64.96 -32.73 74.59 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 122.764 0.426 . . . . 0.0 110.825 174.359 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.609 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 87.9 t -53.75 -41.65 48.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 169.336 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.506 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 8.9 tmtt? -67.78 -32.04 72.35 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.482 176.071 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -78.0 -48.06 17.07 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.967 0.413 . . . . 0.0 111.597 -175.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.541 ' O ' ' HG ' ' A' ' 962' ' ' LEU . 12.5 p -84.99 -35.52 10.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.279 -178.453 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -62.26 -41.25 99.73 Favored Glycine 0 N--CA 1.448 -0.546 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 179.182 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . 0.557 ' O ' ' HG3' ' A' ' 963' ' ' ARG . 24.9 tp -71.75 -31.2 66.41 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.667 -0.123 . . . . 0.0 110.667 178.039 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -73.7 -60.83 2.07 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.968 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 1.049 HD13 HD23 ' A' ' 995' ' ' LEU . 4.0 pp -50.64 -35.35 30.11 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 172.039 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.597 ' N ' HD12 ' A' ' 962' ' ' LEU . 0.0 OUTLIER -71.09 -36.21 72.11 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 120.173 1.351 . . . . 0.0 111.022 175.2 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 964' ' ' THR . . . . . 0.594 ' HB ' ' OD1' ' A' ' 928' ' ' ASN . 17.6 m -71.56 -27.0 62.86 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.281 -0.567 . . . . 0.0 109.498 177.563 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.627 HD22 HD23 ' A' ' 991' ' ' LEU . 36.8 tp -65.65 -45.55 82.54 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-O 122.103 0.954 . . . . 0.0 109.566 169.303 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.709 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 9.2 tt -65.54 -37.25 86.19 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 114.484 -1.235 . . . . 0.0 108.664 -176.084 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . 0.58 ' O ' ' HB2' ' A' ' 971' ' ' GLU . . . -75.53 -29.47 59.44 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.492 179.277 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 1.1 p -72.03 -36.48 69.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 118.497 0.59 . . . . 0.0 110.029 174.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.696 HG23 HD23 ' A' 1035 ' ' LEU . 96.9 t -72.43 -39.25 62.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.311 171.677 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.899 ' HB2' HE22 ' A' ' 988' ' ' GLN . 26.1 t70 -65.9 -38.15 87.98 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 122.19 0.995 . . . . 0.0 108.435 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.676 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 4.9 tp10 -63.56 -37.0 85.67 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.045 -1.434 . . . . 0.0 109.496 176.376 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.46 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 24.1 m -63.26 -17.97 63.07 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.559 175.596 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.782 ' HA ' HD12 ' A' ' 984' ' ' ILE . 8.4 tt -68.88 -52.62 16.73 Favored Pre-proline 0 CA--C 1.535 0.372 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.265 -177.199 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.733 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 1.8 Cg_endo -87.8 -14.3 3.65 Favored 'Trans proline' 0 C--N 1.358 1.036 0 C-N-CA 121.667 1.578 . . . . 0.0 113.676 174.409 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.493 HG21 ' O ' ' A' ' 971' ' ' GLU . 13.7 t . . . . . 0 C--O 1.233 0.2 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 173.035 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.676 ' HG1' ' HA ' ' A' 1043 ' ' ARG . 16.1 m . . . . . 0 CA--C 1.538 0.5 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -50.27 -36.26 30.62 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 -171.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . 0.58 ' HA ' ' HG2' ' A' ' 985' ' ' GLU . 7.0 ptp180 -83.2 -22.36 33.19 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 118.986 -1.085 . . . . 0.0 112.142 -168.74 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.519 ' OE2' HG12 ' A' 1038 ' ' VAL . 2.0 mt-10 -80.03 -35.74 36.81 Favored 'General case' 0 CA--C 1.501 -0.931 0 C-N-CA 119.39 -0.924 . . . . 0.0 109.734 171.095 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.782 HD12 ' HA ' ' A' ' 973' ' ' LEU . 48.7 mt -64.97 -37.44 80.25 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-N 114.795 -1.093 . . . . 0.0 108.927 178.863 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . 0.58 ' HG2' ' HA ' ' A' ' 982' ' ' ARG . 11.3 pt-20 -74.09 -38.52 63.85 Favored 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 118.317 -1.353 . . . . 0.0 110.362 -177.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 986' ' ' MET . . . . . 0.644 ' O ' ' HB3' ' A' ' 989' ' ' LYS . 26.3 ttt -72.22 -37.28 69.24 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.889 -173.746 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.996 ' HB2' ' HB2' ' A' 1035 ' ' LEU . . . -76.34 -49.74 16.08 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.878 -1.056 . . . . 0.0 111.879 -172.528 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.899 HE22 ' HB2' ' A' ' 970' ' ' ASP . 4.7 pt20 -59.73 -26.15 65.41 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.559 0.695 . . . . 0.0 109.629 173.378 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . 0.79 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 7.8 tmtm? -71.11 -39.73 71.9 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.586 -1.188 . . . . 0.0 111.287 172.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 18.2 tp -55.97 -58.36 8.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.569 176.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.627 HD23 HD22 ' A' ' 965' ' ' LEU . 13.0 tp -55.19 -36.07 65.5 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.557 0.694 . . . . 0.0 109.804 177.068 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . 0.79 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 25.4 t-20 -48.86 -52.04 26.43 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 113.751 -1.568 . . . . 0.0 112.119 -177.106 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 32.1 t -74.39 -35.83 63.49 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.33 -36.69 77.2 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 119.246 -0.982 . . . . 0.0 111.829 -178.358 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 1.049 HD23 HD13 ' A' ' 962' ' ' LEU . 3.2 pp -70.45 -23.47 62.72 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 122.808 0.443 . . . . 0.0 110.416 172.294 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -73.44 -28.1 61.78 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 119.527 -0.869 . . . . 0.0 109.978 170.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.757 ' O ' ' HG2' ' A' 1001 ' ' LYS . 17.0 mt-10 -75.25 -41.72 56.74 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 172.091 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.703 ' HB3' ' HA ' ' A' ' 995' ' ' LEU . 0.4 OUTLIER -54.78 -46.76 74.47 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.968 -175.611 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.502 ' HA ' ' HE3' ' A' 1002 ' ' MET . 71.5 mt -66.84 -43.28 89.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.199 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 10.3 m-80 -58.5 -44.89 89.61 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.453 0.644 . . . . 0.0 112.34 -178.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.757 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 28.5 mmtp -74.7 -40.38 61.38 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 122.29 1.043 . . . . 0.0 108.381 -171.624 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.546 ' HG2' ' CG ' ' A' ' 951' ' ' TYR . 16.2 ttp -57.03 -43.89 82.36 Favored 'General case' 0 N--CA 1.428 -1.531 0 CA-C-N 113.894 -1.503 . . . . 0.0 108.419 176.841 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.491 ' C ' ' HH ' ' A' ' 951' ' ' TYR . 1.5 tptm -64.0 -33.0 74.75 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 114.141 -1.391 . . . . 0.0 112.313 -168.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.777 HD12 ' HG3' ' A' 1007 ' ' GLN . 4.2 mm? -84.06 -14.87 49.39 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.007 -0.677 . . . . 0.0 110.948 177.273 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1005 ' ' ALA . . . . . 0.615 ' HB2' ' HA ' ' A' 1014 ' ' GLN . . . -63.45 -50.81 68.26 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 119.391 -0.924 . . . . 0.0 110.55 -177.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 1.014 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 2.2 pp0? -76.99 -24.66 52.23 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 118.979 0.809 . . . . 0.0 110.936 177.328 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.777 ' HG3' HD12 ' A' 1004 ' ' LEU . 18.4 mm-40 -41.75 -40.08 1.91 Allowed 'General case' 0 C--N 1.344 0.336 0 CA-C-O 121.363 0.601 . . . . 0.0 109.795 169.737 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.915 ' HD2' HD22 ' A' 1013 ' ' LEU . 82.7 m-85 -132.1 45.1 2.81 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.631 166.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 1.043 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 7.3 p -49.48 -22.96 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 CA-C-O 121.251 0.548 . . . . 0.0 109.987 171.469 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1010 ' ' MET . . . . . 0.431 ' C ' ' HG1' ' A' 1011 ' ' THR . 21.6 mmt -42.7 -45.83 4.86 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.938 174.043 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1011 ' ' THR . . . . . 0.431 ' HG1' ' C ' ' A' 1010 ' ' MET . 15.9 m -162.23 -84.24 0.03 OUTLIER 'General case' 0 C--O 1.248 0.987 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 176.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1012 ' ' SER . . . . . 0.435 ' O ' ' HG2' ' A' 1015 ' ' GLN . 15.6 m -55.27 -73.41 0.05 Allowed 'General case' 0 C--O 1.234 0.256 0 CA-C-N 114.807 -1.088 . . . . 0.0 112.844 -164.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1013 ' ' LEU . . . . . 0.915 HD22 ' HD2' ' A' 1008 ' ' TYR . 8.7 mp -47.72 -42.85 26.22 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -177.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 1.043 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -55.8 -45.73 78.16 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.206 -0.598 . . . . 0.0 111.083 -169.403 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A 1015 ' ' GLN . . . . . 0.457 ' O ' ' HD3' ' A' 1019 ' ' LYS . 11.0 pt20 -75.57 -41.04 55.76 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.153 -176.287 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -72.39 -56.33 5.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.328 0.585 . . . . 0.0 110.834 -178.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.691 ' CE2' ' HG ' ' A' 1013 ' ' LEU . 8.7 m-85 -58.03 -39.01 77.32 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.097 -0.956 . . . . 0.0 113.241 -178.12 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.742 ' HG3' ' HE2' ' A' 1021 ' ' MET . 8.4 ttpp -82.17 -24.59 34.91 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.844 -176.557 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1019 ' ' LYS . . . . . 0.457 ' HD3' ' O ' ' A' 1015 ' ' GLN . 4.0 mptp? -71.57 -46.12 60.28 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 171.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -56.19 -31.93 63.9 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 114.867 -1.061 . . . . 0.0 110.986 164.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.742 ' HE2' ' HG3' ' A' 1018 ' ' LYS . 18.2 tmm? -69.21 -53.69 18.66 Favored 'General case' 0 CA--C 1.509 -0.611 0 O-C-N 122.16 -0.337 . . . . 0.0 110.793 176.076 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1022 ' ' LEU . . . . . 0.449 HD22 ' HA ' ' A' 1019 ' ' LYS . 0.3 OUTLIER -80.29 -8.55 59.52 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 119.478 -0.889 . . . . 0.0 109.78 -171.229 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 85.3 m -88.83 -31.43 18.32 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.725 172.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.473 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -79.42 -24.73 42.32 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-O 121.419 0.628 . . . . 0.0 109.444 171.489 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.697 ' HB1' HG21 ' A' ' 936' ' ' VAL . . . -86.44 -24.74 25.55 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.222 170.59 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.54 ' O ' HG21 ' A' 1030 ' ' VAL . 47.0 t-80 -74.6 -26.73 60.1 Favored 'General case' 0 C--O 1.214 -0.765 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 164.533 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1027 ' ' ALA . . . . . 0.464 ' HB2' ' O ' ' A' 1024 ' ' ALA . . . -68.97 -40.72 78.67 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 123.664 0.785 . . . . 0.0 110.118 163.576 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.657 HD22 ' N ' ' A' ' 995' ' ' LEU . 22.6 mt -59.81 -44.69 93.86 Favored 'General case' 0 C--N 1.315 -0.898 0 C-N-CA 119.996 -0.682 . . . . 0.0 109.456 169.638 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -58.46 -43.25 88.8 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.755 0.312 . . . . 0.0 111.383 173.09 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.54 HG21 ' O ' ' A' 1026 ' ' HIS . 13.2 t -67.79 -50.55 59.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.168 0.509 . . . . 0.0 110.747 -177.113 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.557 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 47.0 m-20 -75.32 -28.93 59.85 Favored 'General case' 0 C--O 1.214 -0.804 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.551 -175.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.795 ' HA ' HD11 ' A' 1035 ' ' LEU . . . -64.35 -39.58 94.16 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 168.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.404 ' HE2' ' HB3' ' A' 1033 ' ' LYS . 13.4 ttpt -63.1 -43.94 97.07 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 122.092 0.948 . . . . 0.0 109.25 171.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.557 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 51.2 t30 -72.93 -52.56 14.15 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-N 113.975 -1.466 . . . . 0.0 112.465 -171.47 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.996 ' HB2' ' HB2' ' A' ' 987' ' ' ALA . 0.0 OUTLIER -64.32 -34.95 79.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 119.468 -0.301 . . . . 0.0 110.759 -173.284 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.727 ' H ' HD12 ' A' 1035 ' ' LEU . 4.6 pp -72.97 -36.47 67.11 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 116.88 -1.928 . . . . 0.0 109.673 177.252 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.536 ' HB3' ' O ' ' A' 1034 ' ' ASN . 20.5 t70 -55.24 -43.54 74.68 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 122.336 1.065 . . . . 0.0 110.087 172.637 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.53 ' HB ' ' O ' ' A' 1035 ' ' LEU . 15.2 t -51.95 -58.18 2.69 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.512 0 CA-C-N 113.302 -1.772 . . . . 0.0 111.019 172.854 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.713 HG12 HG12 ' A' ' 984' ' ' ILE . 2.5 mp -67.52 -23.87 30.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 118.188 0.449 . . . . 0.0 111.604 179.371 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 1.5 t0 -62.3 -48.98 77.48 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.694 0.759 . . . . 0.0 110.285 171.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -72.58 -36.31 68.13 Favored 'General case' 0 C--N 1.31 -1.136 0 O-C-N 122.021 -0.424 . . . . 0.0 109.951 176.183 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.654 ' HB1' ' HA ' ' A' 1039 ' ' ILE . . . -53.02 -48.93 67.18 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 123.462 0.705 . . . . 0.0 112.499 -179.544 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.676 ' HA ' ' HG1' ' A' ' 980' ' ' THR . 9.7 ptp180 -61.07 -51.8 67.62 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.353 179.444 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 3.2 tm? . . . . . 0 N--CA 1.464 0.246 0 CA-C-O 121.213 0.53 . . . . 0.0 109.836 179.612 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . . . . . . . . . 15.0 tptp . . . . . 0 N--CA 1.466 0.347 0 N-CA-C 111.779 0.289 . . . . 0.0 111.779 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.624 ' CG2' ' HB3' ' A' 1036 ' ' LEU . 1.5 p -61.11 -31.83 51.09 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 CA-C-O 121.295 0.569 . . . . 0.0 110.894 174.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -36.64 82.04 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 123.591 0.756 . . . . 0.0 111.882 178.031 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -75.04 -23.41 58.13 Favored 'General case' 0 C--N 1.313 -1.001 0 C-N-CA 118.374 -1.33 . . . . 0.0 110.195 -179.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.445 ' O ' ' HB2' ' A' ' 961' ' ' ALA . 1.6 m120 -69.21 -31.11 69.48 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 173.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.668 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 46.6 t -81.13 -28.87 10.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 114.79 -1.095 . . . . 0.0 110.154 174.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 930' ' ' THR . . . . . . . . . . . . . 22.3 m -55.61 -43.12 75.79 Favored 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 165.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -71.03 -53.13 11.26 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-N 115.318 -0.855 . . . . 0.0 114.087 178.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.668 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.4 pp -62.22 -47.92 82.29 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 117.513 0.657 . . . . 0.0 112.694 -176.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 75.9 t -65.32 -36.12 76.95 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 CA-C-O 121.083 0.468 . . . . 0.0 110.862 -176.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.535 ' HD2' ' C ' ' A' ' 934' ' ' LYS . 0.1 OUTLIER -55.35 -45.39 76.46 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.822 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 939' ' ' MET . . . -63.26 -34.15 77.06 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.625 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.756 HG22 ' HB2' ' A' 1025 ' ' ALA . 59.0 t -54.03 -76.03 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 CA-C-O 121.11 0.481 . . . . 0.0 112.166 -179.391 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 21.0 pt -68.7 -38.63 79.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -175.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -66.45 -52.22 48.61 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.613 0.72 . . . . 0.0 110.288 -175.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.407 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 23.2 mmt -69.66 -24.35 63.6 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 119.596 -0.842 . . . . 0.0 109.231 -179.048 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.516 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 5.7 p . . . . . 0 C--N 1.343 0.284 0 CA-C-O 121.187 0.518 . . . . 0.0 110.022 -175.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.595 ' CZ ' ' HD3' ' A' 1018 ' ' LYS . 27.4 m-85 . . . . . 0 N--CA 1.469 0.479 0 N-CA-C 116.222 1.934 . . . . 0.0 116.222 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 0.598 ' O ' ' HB ' ' A' ' 955' ' ' VAL . 43.2 t -49.76 -45.56 79.68 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 118.667 0.667 . . . . 0.0 112.041 174.601 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 0.605 ' O ' ' HB3' ' A' ' 956' ' ' LYS . 36.3 Cg_exo -50.01 -44.55 36.91 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 122.089 1.859 . . . . 0.0 112.899 174.162 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.546 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 4.4 ptp -75.32 -29.75 60.12 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 178.158 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.598 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 99.2 t -54.67 -36.5 36.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.145 168.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.605 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 23.2 ttpt -59.07 -43.44 91.77 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.886 171.636 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . 0.503 ' HG2' ' HA ' ' A' ' 954' ' ' MET . 14.6 pt-20 -79.63 -43.41 22.9 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 119.75 -0.78 . . . . 0.0 112.087 -178.133 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.521 HG23 ' HA ' ' A' ' 955' ' ' VAL . 16.7 m -76.52 -33.04 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-O 120.689 0.281 . . . . 0.0 110.904 -179.042 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -68.88 -35.77 80.23 Favored Glycine 0 N--CA 1.436 -1.33 0 N-CA-C 110.474 -1.05 . . . . 0.0 110.474 175.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . 0.594 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 16.5 tp -65.73 -38.33 88.86 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 172.712 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . 0.445 ' HB2' ' O ' ' A' ' 928' ' ' ASN . . . -68.45 -58.46 4.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.647 -0.251 . . . . 0.0 110.757 -177.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.558 HD23 HD23 ' A' ' 995' ' ' LEU . 0.1 OUTLIER -43.54 -49.91 7.32 Favored 'General case' 0 C--O 1.215 -0.748 0 CA-C-O 118.596 -0.716 . . . . 0.0 112.698 167.591 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.594 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 6.4 ptp180 -68.43 -29.0 67.56 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 120.303 1.41 . . . . 0.0 110.805 -179.163 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 964' ' ' THR . . . . . 0.408 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 43.7 m -68.24 -37.99 81.37 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 174.572 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.615 HD12 HD22 ' A' 1035 ' ' LEU . 0.0 OUTLIER -66.28 -40.01 89.79 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.17 174.423 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.407 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.4 tt -67.91 -41.45 82.64 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 114.727 -1.124 . . . . 0.0 108.307 -175.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . 0.565 ' O ' ' HB2' ' A' ' 971' ' ' GLU . . . -72.59 -38.77 67.75 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-N 114.966 -1.015 . . . . 0.0 112.021 -179.508 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 9.8 p -61.92 -40.98 97.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 118.657 0.662 . . . . 0.0 110.3 177.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.966 HG12 HG23 ' A' ' 984' ' ' ILE . 67.7 t -73.94 -38.54 49.99 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.712 174.493 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.863 ' HB2' HE22 ' A' ' 988' ' ' GLN . 12.1 t70 -67.75 -44.38 77.66 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.805 0.812 . . . . 0.0 109.585 -177.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.591 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 0.6 OUTLIER -63.83 -32.5 74.04 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 114.667 -1.152 . . . . 0.0 109.26 177.536 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.629 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 39.8 m -65.3 -18.02 64.98 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.53 175.397 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.761 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 9.7 tt -69.62 -52.65 13.77 Favored Pre-proline 0 CA--C 1.532 0.262 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.087 -179.171 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.761 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 3.0 Cg_exo -80.36 -2.12 11.77 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.627 1.551 . . . . 0.0 113.116 172.54 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.629 ' HB ' ' HA ' ' A' ' 972' ' ' SER . 15.0 t . . . . . 0 C--N 1.329 -0.321 0 N-CA-C 110.094 -0.336 . . . . 0.0 110.094 173.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 980' ' ' THR . . . . . . . . . . . . . 40.9 p . . . . . 0 CA--C 1.52 -0.184 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.708 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 0.3 OUTLIER -55.56 -34.34 64.65 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.345 -178.65 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . 0.444 HH11 ' HD3' ' A' ' 982' ' ' ARG . 9.5 ptp180 -84.48 -19.21 33.71 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.477 -178.479 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.624 ' HG2' ' HB1' ' A' 1042 ' ' ALA . 0.5 OUTLIER -73.98 -38.85 64.04 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 172.586 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.966 HG23 HG12 ' A' ' 969' ' ' VAL . 65.6 mt -72.01 -29.51 33.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 114.225 -1.352 . . . . 0.0 109.206 179.387 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . 0.708 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 26.6 mt-10 -65.0 -51.63 60.63 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.402 0.62 . . . . 0.0 110.444 174.162 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 25.5 ttt -70.23 -43.28 70.95 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.311 -170.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.986 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -74.54 -50.85 16.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.066 -0.97 . . . . 0.0 112.827 -171.236 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.863 HE22 ' HB2' ' A' ' 970' ' ' ASP . 3.2 pt20 -65.29 -23.04 66.93 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 119.817 -0.753 . . . . 0.0 109.94 179.432 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . 0.773 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 6.8 tttp -74.31 -40.67 62.07 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.327 171.816 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.412 ' HB3' ' O ' ' A' ' 987' ' ' ALA . 27.5 tp -52.19 -59.79 3.97 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.208 178.675 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.636 ' HB2' ' CD2' ' A' 1035 ' ' LEU . 0.3 OUTLIER -66.04 -28.91 69.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.519 0.676 . . . . 0.0 109.789 179.059 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . 0.773 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 23.7 t-20 -52.05 -56.39 14.65 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.436 -1.257 . . . . 0.0 111.485 179.752 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 34.1 t -77.84 -33.99 52.07 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 111.776 0.288 . . . . 0.0 111.776 -178.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . 0.421 ' O ' ' HB3' ' A' ' 997' ' ' GLU . 0.6 OUTLIER -66.99 -36.34 81.95 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 120.176 -0.61 . . . . 0.0 112.354 -179.823 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.61 HD12 HD12 ' A' 1028 ' ' LEU . 8.4 tt -73.7 -17.45 61.13 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 173.041 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -75.29 -26.46 58.76 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 119.77 -0.772 . . . . 0.0 109.77 167.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.421 ' HB3' ' O ' ' A' ' 994' ' ' ASP . 3.8 tp10 -74.51 -40.63 61.67 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 173.14 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.94 HD13 ' HB3' ' A' 1025 ' ' ALA . 2.2 tp -55.91 -46.98 78.25 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.039 0.447 . . . . 0.0 110.747 178.058 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.77 ' HA ' ' SD ' ' A' 1002 ' ' MET . 80.1 mt -68.57 -38.5 79.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.881 -171.093 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -60.59 -46.86 88.65 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.442 0.639 . . . . 0.0 111.254 -177.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.536 ' O ' ' HB3' ' A' 1017 ' ' TYR . 89.7 mttt -84.62 -31.8 24.06 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.962 -173.165 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.77 ' SD ' ' HA ' ' A' ' 999' ' ' ILE . 13.1 ptm -64.29 -27.81 69.29 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 122.099 0.952 . . . . 0.0 108.512 173.47 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.614 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 9.4 tptp -67.26 -54.01 24.73 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 114.145 -1.389 . . . . 0.0 110.352 -171.255 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.622 ' HG ' ' NE2' ' A' 1007 ' ' GLN . 9.1 mp -71.14 -13.8 62.07 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.388 -178.68 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1005 ' ' ALA . . . . . 0.601 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -69.26 -55.15 11.37 Favored 'General case' 0 C--O 1.217 -0.638 0 C-N-CA 119.888 -0.725 . . . . 0.0 110.289 179.554 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.95 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 0.8 OUTLIER -63.88 -24.91 67.93 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 118.871 -0.585 . . . . 0.0 112.467 171.787 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.622 ' NE2' ' HG ' ' A' 1004 ' ' LEU . 19.3 mt-30 -51.98 -50.22 61.73 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.625 0.726 . . . . 0.0 110.07 175.528 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.724 ' HB2' ' HG ' ' A' 1013 ' ' LEU . 76.5 m-85 -124.99 49.74 1.83 Allowed 'General case' 0 N--CA 1.442 -0.835 0 CA-C-O 121.588 0.709 . . . . 0.0 109.617 172.361 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 1.001 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 9.3 p -55.41 -19.27 5.29 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.282 0 CA-C-N 114.157 -1.383 . . . . 0.0 109.678 170.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 65.0 mtt -40.01 -51.31 2.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.55 -1.204 . . . . 0.0 110.655 171.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1011 ' ' THR . . . . . . . . . . . . . 41.6 m -162.54 -75.66 0.05 OUTLIER 'General case' 0 C--O 1.239 0.52 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 175.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 13.1 p -55.93 -79.9 0.02 OUTLIER 'General case' 0 C--O 1.248 0.986 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -163.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1013 ' ' LEU . . . . . 0.724 ' HG ' ' HB2' ' A' 1008 ' ' TYR . 13.0 mt -48.19 -42.62 30.39 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.453 -175.82 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 1.001 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.1 OUTLIER -52.66 -59.15 4.82 Favored 'General case' 0 N--CA 1.437 -1.113 0 O-C-N 123.989 0.806 . . . . 0.0 110.477 -165.73 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A 1015 ' ' GLN . . . . . 0.507 ' O ' ' HD3' ' A' 1019 ' ' LYS . 27.7 mt-30 -65.92 -38.21 88.07 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.651 -169.201 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -70.03 -44.94 68.22 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.468 0.652 . . . . 0.0 110.574 178.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.601 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 13.4 m-85 -71.94 -30.76 65.65 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.758 -176.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.595 ' HD3' ' CZ ' ' A' ' 951' ' ' TYR . 23.4 tptm -78.86 -33.99 45.4 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 114.172 -1.376 . . . . 0.0 109.951 -176.001 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1019 ' ' LYS . . . . . 0.507 ' HD3' ' O ' ' A' 1015 ' ' GLN . 4.6 mptp? -71.1 -44.65 65.21 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 175.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -57.8 -33.01 68.12 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.72 165.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.735 ' HE3' HD11 ' A' ' 998' ' ' LEU . 1.9 tmt? -65.85 -51.5 58.31 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 110.294 -0.262 . . . . 0.0 110.294 179.21 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1022 ' ' LEU . . . . . 0.482 ' HA ' ' HB1' ' A' 1025 ' ' ALA . 0.0 OUTLIER -81.15 -9.69 59.76 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 119.423 -0.911 . . . . 0.0 109.869 -175.713 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 72.7 m -81.97 -41.11 21.22 Favored 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 173.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.495 ' O ' ' HB1' ' A' 1027 ' ' ALA . . . -78.51 -22.13 47.84 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-O 121.139 0.495 . . . . 0.0 109.843 174.733 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.94 ' HB3' HD13 ' A' ' 998' ' ' LEU . . . -85.57 -23.57 27.57 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.216 170.441 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.508 ' O ' HG23 ' A' 1030 ' ' VAL . 22.2 t-80 -76.04 -25.92 56.09 Favored 'General case' 0 C--O 1.214 -0.779 0 C-N-CA 120.164 -0.614 . . . . 0.0 109.422 164.154 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1027 ' ' ALA . . . . . 0.495 ' HB1' ' O ' ' A' 1024 ' ' ALA . . . -66.5 -40.15 89.07 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 162.552 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.61 HD12 HD12 ' A' ' 995' ' ' LEU . 16.6 mt -60.17 -49.16 78.73 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 170.629 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -57.11 -41.02 78.18 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 175.29 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' 1026 ' ' HIS . 10.6 t -71.88 -51.55 30.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.44 0.638 . . . . 0.0 110.794 -176.17 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1031 ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -77.11 -30.12 55.11 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.907 -174.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.512 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -70.7 -32.83 70.2 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 172.342 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 52.5 tttm -62.81 -45.69 91.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.768 0.794 . . . . 0.0 109.37 169.062 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.496 ' O ' ' HB3' ' A' 1037 ' ' ASP . 53.7 t30 -68.14 -50.32 55.35 Favored 'General case' 0 C--O 1.218 -0.595 0 CA-C-N 114.369 -1.287 . . . . 0.0 111.738 -176.408 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.986 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 1.9 pp -62.52 -40.84 98.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 119.084 -0.484 . . . . 0.0 111.047 -171.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.624 ' HB3' ' CG2' ' A' ' 925' ' ' VAL . 3.9 pp -66.26 -42.34 88.63 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 117.66 -1.616 . . . . 0.0 109.587 177.656 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.496 ' HB3' ' O ' ' A' 1034 ' ' ASN . 23.6 t70 -54.47 -38.36 66.29 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-N 113.982 -1.463 . . . . 0.0 110.128 175.663 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.502 ' O ' ' HB1' ' A' 1042 ' ' ALA . 27.3 t -63.93 -36.5 76.95 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.614 0 CA-C-N 114.453 -1.249 . . . . 0.0 112.366 177.078 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.614 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 1.7 mp -86.56 -32.37 6.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 119.04 0.836 . . . . 0.0 111.094 177.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.518 ' O ' ' HG3' ' A' 1043 ' ' ARG . 4.0 m-20 -62.9 -41.27 99.38 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 169.599 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1041 ' ' GLN . . . . . 0.413 ' HB2' ' O ' ' A' 1037 ' ' ASP . 12.0 mt-30 -68.2 -39.25 82.5 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.056 170.204 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.624 ' HB1' ' HG2' ' A' ' 983' ' ' GLU . . . -55.41 -48.75 73.91 Favored 'General case' 0 CA--C 1.49 -1.339 0 C-N-CA 123.066 0.546 . . . . 0.0 110.782 -176.742 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.641 ' HD3' ' N ' ' A' 1044 ' ' LEU . 0.0 OUTLIER -65.01 -34.97 79.7 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.402 -174.08 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.641 ' N ' ' HD3' ' A' 1043 ' ' ARG . 3.1 tm? . . . . . 0 N--CA 1.45 -0.466 0 CA-C-O 121.567 0.698 . . . . 0.0 110.123 179.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.486 ' N ' ' HD3' ' A' ' 924' ' ' LYS . 16.4 mmtp . . . . . 0 C--O 1.223 -0.29 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.623 HG22 HD22 ' A' 1036 ' ' LEU . 20.7 m -57.87 -29.12 34.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.709 0.766 . . . . 0.0 110.352 -179.73 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . 0.43 ' O ' HG23 ' A' ' 930' ' ' THR . 14.3 m-85 -72.94 -39.78 65.93 Favored 'General case' 0 CA--C 1.483 -1.603 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.582 175.503 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . 0.529 ' HA ' ' OG1' ' A' ' 930' ' ' THR . 9.3 pt-20 -74.38 -22.29 59.26 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 117.749 -1.58 . . . . 0.0 109.982 -176.406 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -75.05 -32.04 61.43 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.038 -0.726 . . . . 0.0 109.038 172.095 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.675 HG21 ' HB2' ' A' 1032 ' ' ALA . 85.4 t -81.13 -29.79 11.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.244 175.536 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.529 ' OG1' ' HA ' ' A' ' 927' ' ' GLU . 66.5 p -68.82 -29.28 67.58 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 169.351 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -70.19 -53.26 14.6 Favored Glycine 0 CA--C 1.529 0.958 0 CA-C-N 115.113 -0.949 . . . . 0.0 113.14 172.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.646 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.6 pp -65.28 -49.32 70.0 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -178.453 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.431 HG23 ' HA ' ' A' 1029 ' ' ALA . 88.6 t -64.27 -41.18 91.58 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-O 121.069 0.461 . . . . 0.0 110.238 -176.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . . . . . . . . . 1.4 ttpt -54.73 -39.92 68.74 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.133 -0.939 . . . . 0.0 109.958 177.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . 0.423 ' HB1' HG13 ' A' ' 958' ' ' VAL . . . -66.72 -39.95 88.21 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.613 0.227 . . . . 0.0 111.613 -178.541 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.693 HG23 ' HB3' ' A' 1025 ' ' ALA . 59.7 t -47.46 -68.32 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 O-C-N 123.81 0.694 . . . . 0.0 111.3 179.506 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 26.5 pt -65.45 -37.29 79.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.905 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -58.89 -56.55 20.81 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.57 0.7 . . . . 0.0 110.747 -172.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 13.3 mmt -76.52 -25.82 54.56 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.52 -0.763 . . . . 0.0 110.394 -177.076 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.545 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 76.9 p . . . . . 0 CA--C 1.516 -0.34 0 CA-C-O 121.447 0.642 . . . . 0.0 110.995 -169.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.968 ' HB3' ' HG3' ' A' 1002 ' ' MET . 22.9 m-85 . . . . . 0 N--CA 1.47 0.567 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 0.644 ' O ' ' HB ' ' A' ' 955' ' ' VAL . 61.4 t -43.87 -46.12 19.63 Favored Pre-proline 0 C--N 1.32 -0.709 0 C-N-CA 122.868 0.467 . . . . 0.0 111.65 172.297 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 0.535 ' HA ' ' HD3' ' A' ' 956' ' ' LYS . 14.1 Cg_exo -45.5 -51.07 8.47 Favored 'Trans proline' 0 CA--C 1.544 0.987 0 C-N-CA 122.434 2.089 . . . . 0.0 113.59 173.591 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.451 ' HE2' HG12 ' A' ' 958' ' ' VAL . 6.8 ptm -69.56 -30.96 68.87 Favored 'General case' 0 N--CA 1.463 0.199 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 177.615 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.644 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 73.5 t -54.13 -36.68 32.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.778 171.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.535 ' HD3' ' HA ' ' A' ' 953' ' ' PRO . 2.4 mptp? -59.22 -41.63 89.09 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 119.097 -0.477 . . . . 0.0 111.371 171.179 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -77.54 -39.6 45.41 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 118.929 -1.108 . . . . 0.0 111.378 -177.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.64 HG21 ' HA ' ' A' ' 955' ' ' VAL . 24.3 m -73.97 -35.33 41.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 O-C-N 122.208 -0.308 . . . . 0.0 111.2 179.716 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -66.07 -34.96 89.87 Favored Glycine 0 N--CA 1.44 -1.082 0 N-CA-C 110.672 -0.971 . . . . 0.0 110.672 177.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . 0.526 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 9.4 tt -71.29 -33.11 69.43 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.127 -0.537 . . . . 0.0 109.803 176.007 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -73.83 -37.8 64.74 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.513 -176.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.862 HD12 HD22 ' A' ' 991' ' ' LEU . 0.2 OUTLIER -66.5 -49.38 66.76 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-O 119.303 -0.38 . . . . 0.0 110.638 171.792 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.526 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 12.7 ptm180 -64.24 -30.29 71.35 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 118.856 0.753 . . . . 0.0 111.042 -177.416 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 38.7 m -69.14 -33.89 74.15 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 176.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.459 ' CD1' ' HB ' ' A' ' 925' ' ' VAL . 31.9 tp -71.34 -39.87 71.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 122.053 0.93 . . . . 0.0 109.669 175.176 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.508 ' HG ' HE21 ' A' ' 988' ' ' GLN . 10.4 tt -63.18 -43.94 96.82 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 114.505 -1.225 . . . . 0.0 108.812 -177.251 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -70.19 -38.61 75.38 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 114.787 -1.097 . . . . 0.0 111.977 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 3.2 p -65.46 -44.17 88.03 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.544 177.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.848 HG13 HG23 ' A' ' 984' ' ' ILE . 61.2 t -68.35 -36.41 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.246 175.134 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.811 ' HB2' HE22 ' A' ' 988' ' ' GLN . 8.1 t70 -69.38 -41.96 75.8 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 122.24 1.019 . . . . 0.0 109.031 -179.547 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.619 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 39.1 tt0 -73.24 -22.31 60.44 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 114.482 -1.236 . . . . 0.0 109.476 -179.324 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.711 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 58.7 m -72.9 -15.97 61.57 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.925 172.324 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.744 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 8.1 tt -64.08 -50.65 67.8 Favored Pre-proline 0 C--N 1.329 -0.302 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 175.717 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.744 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 13.2 Cg_exo -72.34 -11.85 27.01 Favored 'Trans proline' 0 C--N 1.355 0.916 0 C-N-CA 121.705 1.603 . . . . 0.0 113.396 169.766 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.711 ' HB ' ' HA ' ' A' ' 972' ' ' SER . 45.9 t . . . . . 0 C--N 1.328 -0.366 0 O-C-N 122.034 -0.416 . . . . 0.0 110.269 174.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 980' ' ' THR . . . . . . . . . . . . . 88.4 m . . . . . 0 CA--C 1.535 0.397 0 CA-C-O 121.104 0.478 . . . . 0.0 110.369 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.469 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 14.1 p80 -50.36 -57.37 8.09 Favored 'General case' 0 C--O 1.219 -0.517 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 -176.118 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 5.5 ptp180 -56.23 -22.65 30.9 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 113.974 1.101 . . . . 0.0 113.974 -176.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.515 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 2.6 mp0 -77.08 -38.21 52.92 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 119.11 0.868 . . . . 0.0 109.97 174.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.848 HG23 HG13 ' A' ' 969' ' ' VAL . 32.7 mt -71.11 -30.68 41.91 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.935 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.096 177.408 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . 0.469 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 42.7 mt-10 -66.88 -51.77 51.45 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.437 177.511 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 986' ' ' MET . . . . . 0.417 ' O ' ' HB3' ' A' ' 989' ' ' LYS . 68.5 mtt -70.79 -42.08 70.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 114.64 -1.163 . . . . 0.0 111.468 -175.387 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 1.048 ' HB2' ' HB2' ' A' 1035 ' ' LEU . . . -69.4 -51.64 34.61 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.457 -0.792 . . . . 0.0 112.225 -170.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.811 HE22 ' HB2' ' A' ' 970' ' ' ASP . 3.7 pt20 -62.87 -21.82 66.26 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.375 177.661 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . 0.766 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 12.0 ttmt -70.29 -42.36 72.14 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.565 171.34 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 2.6 mp -55.35 -53.9 50.42 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.862 HD22 HD12 ' A' ' 962' ' ' LEU . 2.3 tt -67.88 -25.7 65.65 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 178.5 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . 0.766 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 25.3 t-20 -53.17 -56.74 14.0 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.29 178.532 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 3.8 p -79.14 -34.07 43.61 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -177.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.07 -41.99 97.13 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.335 -0.546 . . . . 0.0 111.407 178.301 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.622 ' N ' HD22 ' A' 1028 ' ' LEU . 2.3 tm? -64.03 -23.88 67.5 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 122.576 0.35 . . . . 0.0 110.184 173.16 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -70.91 -32.74 69.77 Favored 'General case' 0 C--N 1.313 -0.994 0 C-N-CA 119.274 -0.971 . . . . 0.0 110.835 169.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.511 ' O ' ' HG2' ' A' 1001 ' ' LYS . 74.1 mm-40 -76.29 -38.09 56.59 Favored 'General case' 0 CA--C 1.512 -0.505 0 O-C-N 121.858 -0.526 . . . . 0.0 110.1 177.279 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.628 HD23 ' SD ' ' A' 1021 ' ' MET . 1.1 tm? -56.24 -47.13 79.09 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.339 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.606 ' O ' ' HB2' ' A' 1003 ' ' LYS . 72.7 mt -65.71 -31.82 55.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.728 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -62.67 -38.82 91.85 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.872 0.368 . . . . 0.0 111.676 176.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.511 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 54.8 mmtt -77.5 -43.02 33.51 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 122.529 1.157 . . . . 0.0 108.46 -177.519 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.968 ' HG3' ' HB3' ' A' ' 951' ' ' TYR . 12.0 tpp -57.8 -29.96 65.32 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 113.482 -1.69 . . . . 0.0 109.2 177.532 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.606 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 15.7 tptt -73.28 -55.11 6.86 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 114.162 -1.381 . . . . 0.0 111.037 -167.155 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.839 ' HB3' HD23 ' A' 1013 ' ' LEU . 3.9 mm? -71.4 -13.66 61.92 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.32 -178.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1005 ' ' ALA . . . . . 0.707 ' HB1' ' HB3' ' A' 1017 ' ' TYR . . . -69.86 -45.22 68.23 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 119.366 -0.933 . . . . 0.0 109.477 179.705 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.942 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 3.4 pp0? -75.75 -26.73 57.67 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 120.071 -0.652 . . . . 0.0 111.718 172.362 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.666 ' HG3' HD11 ' A' 1004 ' ' LEU . 21.9 mm-40 -52.0 -54.61 27.79 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.152 0.501 . . . . 0.0 110.581 174.271 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.768 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 72.1 m-85 -114.98 41.15 2.46 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.229 -0.588 . . . . 0.0 109.96 173.573 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 1.064 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 14.7 p -49.41 -22.16 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.603 172.389 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 20.6 mmt -30.96 -57.13 0.22 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.202 173.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1011 ' ' THR . . . . . . . . . . . . . 97.9 m -164.98 -72.32 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 O-C-N 123.122 0.263 . . . . 0.0 111.646 173.034 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 32.5 t -50.8 -74.92 0.03 OUTLIER 'General case' 0 C--O 1.24 0.595 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.8 -169.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1013 ' ' LEU . . . . . 0.839 HD23 ' HB3' ' A' 1004 ' ' LEU . 7.6 mp -50.46 -39.08 46.89 Favored 'General case' 0 CA--C 1.504 -0.812 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -178.235 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 1.064 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.62 -49.25 70.94 Favored 'General case' 0 N--CA 1.442 -0.838 0 O-C-N 123.505 0.503 . . . . 0.0 111.465 -168.186 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A 1015 ' ' GLN . . . . . 0.426 ' O ' ' HD3' ' A' 1019 ' ' LYS . 12.1 pt20 -74.67 -38.8 62.33 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.607 -176.466 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 53.5 tt0 -66.75 -53.75 30.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.583 0.706 . . . . 0.0 110.592 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.707 ' HB3' ' HB1' ' A' 1005 ' ' ALA . 5.9 m-85 -65.67 -34.32 77.94 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.73 -1.123 . . . . 0.0 113.651 -174.177 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.524 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 51.4 tptt -80.32 -29.19 38.06 Favored 'General case' 0 N--CA 1.461 0.102 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.199 -177.7 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1019 ' ' LYS . . . . . 0.426 ' HD3' ' O ' ' A' 1015 ' ' GLN . 3.4 mptp? -72.52 -50.73 23.77 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 173.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -54.4 -31.84 55.87 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.086 166.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.628 ' SD ' HD23 ' A' ' 998' ' ' LEU . 10.9 tmm? -65.51 -52.32 53.53 Favored 'General case' 0 C--O 1.217 -0.651 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 174.092 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1022 ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' 1022 ' ' LEU . 0.0 OUTLIER -74.08 -12.17 60.53 Favored 'General case' 0 C--O 1.218 -0.591 0 C-N-CA 119.258 -0.977 . . . . 0.0 109.806 -176.762 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 92.5 m -82.21 -41.86 19.74 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.205 175.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.547 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.12 -22.04 49.44 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-O 120.972 0.415 . . . . 0.0 109.937 174.134 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.693 ' HB3' HG23 ' A' ' 936' ' ' VAL . . . -84.7 -22.05 29.91 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.929 169.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.507 ' O ' HG22 ' A' 1030 ' ' VAL . 47.6 t60 -76.55 -25.62 54.26 Favored 'General case' 0 C--O 1.213 -0.854 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 164.587 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1027 ' ' ALA . . . . . 0.438 ' HB2' ' O ' ' A' 1024 ' ' ALA . . . -69.52 -41.4 76.07 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 122.746 0.419 . . . . 0.0 110.168 163.59 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.622 HD22 ' N ' ' A' ' 995' ' ' LEU . 21.0 mt -60.33 -46.56 89.46 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 170.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1029 ' ' ALA . . . . . 0.431 ' HA ' HG23 ' A' ' 933' ' ' VAL . . . -57.57 -43.04 84.22 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 123.192 0.308 . . . . 0.0 111.456 173.306 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.507 HG22 ' O ' ' A' 1026 ' ' HIS . 4.9 t -66.55 -50.74 64.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-O 120.916 0.389 . . . . 0.0 110.47 -176.663 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.663 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 14.0 m-20 -75.02 -29.1 60.72 Favored 'General case' 0 C--O 1.212 -0.871 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.212 -176.475 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.675 ' HB2' HG21 ' A' ' 929' ' ' VAL . . . -58.97 -45.82 89.58 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 168.438 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 56.1 tttm -65.29 -41.98 93.57 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.768 0.794 . . . . 0.0 109.877 175.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.663 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 38.9 t30 -70.5 -53.76 14.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.002 -1.454 . . . . 0.0 112.09 -172.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 1.048 ' HB2' ' HB2' ' A' ' 987' ' ' ALA . 2.5 pp -62.79 -38.57 91.19 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 119.332 -0.366 . . . . 0.0 110.599 -174.878 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.623 HD22 HG22 ' A' ' 925' ' ' VAL . 4.3 pp -71.43 -36.4 71.27 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 116.933 -1.907 . . . . 0.0 109.734 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.602 ' N ' HD13 ' A' 1036 ' ' LEU . 11.5 t70 -57.92 -39.76 78.77 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.749 174.291 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.518 ' HB ' ' O ' ' A' 1035 ' ' LEU . 13.1 t -55.86 -33.49 34.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 114.124 -1.398 . . . . 0.0 111.578 173.807 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.592 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 1.9 mp -86.44 -33.94 7.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 117.944 0.338 . . . . 0.0 111.486 175.19 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.466 ' O ' ' HG3' ' A' 1043 ' ' ARG . 1.0 OUTLIER -53.18 -49.45 66.64 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 166.424 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -69.2 -39.92 78.35 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.371 -0.832 . . . . 0.0 111.205 175.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.592 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -54.63 -49.28 70.89 Favored 'General case' 0 CA--C 1.497 -1.081 0 C-N-CA 122.932 0.493 . . . . 0.0 111.782 -175.637 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.558 ' HD3' ' N ' ' A' 1044 ' ' LEU . 0.0 OUTLIER -63.68 -38.52 91.42 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.818 -178.319 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.558 ' N ' ' HD3' ' A' 1043 ' ' ARG . 56.4 tp . . . . . 0 N--CA 1.448 -0.527 0 CA-C-O 121.768 0.794 . . . . 0.0 109.566 178.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.77 ' HB3' HG22 ' A' ' 968' ' ' THR . 16.8 tppt? . . . . . 0 C--O 1.225 -0.222 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.533 ' O ' HG21 ' A' ' 929' ' ' VAL . 29.0 m -61.7 -29.8 46.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-O 121.079 0.466 . . . . 0.0 110.304 177.291 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -78.2 -26.28 47.46 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 176.356 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -76.02 -25.7 55.95 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.035 174.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.566 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 5.1 m120 -77.29 -29.84 53.94 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 121.663 0.744 . . . . 0.0 109.032 173.712 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.664 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 81.8 t -76.68 -29.48 18.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.329 174.642 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 930' ' ' THR . . . . . 0.426 ' O ' ' HB3' ' A' ' 934' ' ' LYS . 36.1 m -60.49 -39.98 89.64 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 170.217 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -72.32 -53.25 9.11 Favored Glycine 0 CA--C 1.524 0.629 0 CA-C-N 115.103 -0.953 . . . . 0.0 113.708 178.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.664 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.8 pp -65.05 -47.61 76.76 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -175.667 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . 0.41 HG21 ' CB ' ' A' 1029 ' ' ALA . 73.6 t -63.25 -42.9 98.12 Favored 'Isoleucine or valine' 0 C--O 1.24 0.582 0 CA-C-O 121.407 0.622 . . . . 0.0 110.52 -177.797 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.748 ' O ' ' HB2' ' A' ' 938' ' ' GLU . 16.0 ttpt -60.51 -40.22 90.62 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.655 178.449 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -58.59 -46.59 86.63 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.499 -0.48 . . . . 0.0 111.083 175.174 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.838 HG21 ' HB3' ' A' 1025 ' ' ALA . 57.8 t -45.05 -83.65 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 123.274 0.63 . . . . 0.0 112.386 -179.075 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 19.4 pt -64.6 -43.41 96.73 Favored 'Isoleucine or valine' 0 C--O 1.248 0.997 0 N-CA-C 112.316 0.488 . . . . 0.0 112.316 -173.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.748 ' HB2' ' O ' ' A' ' 934' ' ' LYS . 6.2 mm-40 -67.84 -51.29 50.17 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.855 -169.576 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 939' ' ' MET . . . . . 0.493 ' HB3' ' CE ' ' A' ' 954' ' ' MET . 30.8 ttm -72.78 -27.81 62.22 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 120.093 -0.643 . . . . 0.0 109.686 -175.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 940' ' ' SER . . . . . . . . . . . . . 2.8 m . . . . . 0 C--N 1.346 0.441 0 O-C-N 123.97 0.793 . . . . 0.0 112.501 -174.057 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.889 ' HB3' ' HG3' ' A' 1002 ' ' MET . 20.6 m-30 . . . . . 0 N--CA 1.479 1.022 0 N-CA-C 115.789 1.774 . . . . 0.0 115.789 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 0.498 ' HA ' ' HB ' ' A' ' 955' ' ' VAL . 45.4 t -54.79 -40.6 84.9 Favored Pre-proline 0 C--N 1.32 -0.688 0 O-C-N 122.076 -0.39 . . . . 0.0 111.019 168.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 0.69 ' HA ' ' HD2' ' A' ' 956' ' ' LYS . 8.2 Cg_exo -44.57 -51.32 7.25 Favored 'Trans proline' 0 C--N 1.357 0.985 0 C-N-CA 122.468 2.112 . . . . 0.0 112.836 170.927 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.799 ' HG2' ' HE1' ' A' 1002 ' ' MET . 0.4 OUTLIER -62.66 -41.76 99.24 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.884 172.144 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.498 ' HB ' ' HA ' ' A' ' 952' ' ' VAL . 54.9 t -52.4 -36.88 22.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.886 176.342 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . 0.69 ' HD2' ' HA ' ' A' ' 953' ' ' PRO . 59.6 mttt -66.12 -41.89 89.92 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 111.599 0.222 . . . . 0.0 111.599 173.15 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -77.32 -44.82 28.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.754 0.311 . . . . 0.0 111.356 -172.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.539 ' O ' ' HG ' ' A' ' 962' ' ' LEU . 14.4 p -75.1 -34.47 31.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 176.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -64.44 -43.72 96.32 Favored Glycine 0 N--CA 1.448 -0.56 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 177.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . 0.562 HD13 ' HD2' ' A' ' 963' ' ' ARG . 16.3 tp -63.14 -38.47 91.31 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.925 -0.137 . . . . 0.0 110.678 175.23 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -69.84 -60.02 2.57 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 120.898 0.38 . . . . 0.0 111.012 -177.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.859 HD13 HD23 ' A' ' 995' ' ' LEU . 4.1 pp -56.54 -29.66 62.19 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 173.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.562 ' HD2' HD13 ' A' ' 960' ' ' LEU . 9.9 ptp180 -73.77 -36.39 65.08 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 120.195 1.361 . . . . 0.0 110.637 172.027 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 32.2 m -62.72 -33.52 75.29 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 174.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.566 ' HA ' ' OD1' ' A' ' 928' ' ' ASN . 25.8 tp -61.65 -54.35 44.0 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.487 174.132 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.759 ' HG ' ' NE2' ' A' ' 988' ' ' GLN . 8.0 tt -54.95 -41.04 70.6 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.185 -1.37 . . . . 0.0 109.38 178.826 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -68.8 -35.07 76.57 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.034 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.77 HG22 ' HB3' ' A' ' 924' ' ' LYS . 23.2 m -73.17 -39.21 65.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 118.809 0.731 . . . . 0.0 110.675 177.305 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.738 HG11 HG22 ' A' ' 984' ' ' ILE . 27.1 t -67.31 -36.67 77.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 CA-C-O 120.726 0.298 . . . . 0.0 110.519 173.255 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -68.63 -42.37 78.14 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 179.217 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.657 ' O ' HG23 ' A' ' 975' ' ' VAL . 31.7 tp10 -68.34 -24.8 64.86 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 113.857 -1.52 . . . . 0.0 109.69 179.738 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 58.8 m -73.54 -17.59 61.19 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.366 177.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.682 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 35.0 tp -67.72 -52.81 24.25 Favored Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 119.741 -0.783 . . . . 0.0 110.284 172.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.682 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 19.2 Cg_exo -70.14 -11.31 30.1 Favored 'Trans proline' 0 C--N 1.358 1.041 0 C-N-CA 121.404 1.403 . . . . 0.0 113.502 172.905 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.657 HG23 ' O ' ' A' ' 971' ' ' GLU . 38.8 t . . . . . 0 N--CA 1.466 0.356 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 173.228 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.657 ' OG1' ' HB3' ' A' 1042 ' ' ALA . 6.0 t . . . . . 0 N--CA 1.455 -0.18 0 N-CA-C 110.856 -0.053 . . . . 0.0 110.856 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.495 ' O ' ' HG2' ' A' ' 985' ' ' GLU . 1.9 p80 -49.69 -49.14 48.82 Favored 'General case' 0 C--O 1.208 -1.101 0 O-C-N 123.224 0.327 . . . . 0.0 110.984 -177.675 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . 0.404 ' HA ' ' HB2' ' A' ' 985' ' ' GLU . 0.1 OUTLIER -52.65 -21.42 3.95 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 179.426 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.607 ' HG2' ' HB1' ' A' 1042 ' ' ALA . 0.3 OUTLIER -80.08 -49.53 11.63 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 118.747 0.703 . . . . 0.0 111.45 171.071 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.738 HG22 HG11 ' A' ' 969' ' ' VAL . 2.9 mp -63.52 -30.94 51.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 178.174 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 981' ' ' HIS . 70.4 mm-40 -58.9 -46.17 88.52 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.083 175.718 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 24.6 mmt -73.13 -42.74 62.56 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.205 -176.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 0.847 ' HB2' ' HB2' ' A' 1035 ' ' LEU . . . -65.65 -49.32 69.09 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 114.713 -1.131 . . . . 0.0 111.971 -176.384 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.768 ' O ' ' HB2' ' A' ' 992' ' ' ASN . 12.8 mm100 -56.02 -40.81 73.98 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.035 177.533 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . 0.602 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 0.0 OUTLIER -72.35 -39.2 68.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.297 -178.784 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.594 HD22 ' HB3' ' A' 1035 ' ' LEU . 26.7 tp -55.0 -59.12 5.18 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.921 179.702 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.612 ' HB3' ' CD2' ' A' 1035 ' ' LEU . 3.2 pp -63.08 -31.62 72.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.868 0.842 . . . . 0.0 109.741 179.007 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . 0.768 ' HB2' ' O ' ' A' ' 988' ' ' GLN . 20.6 t-20 -53.58 -57.33 11.13 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 113.564 -1.653 . . . . 0.0 112.747 -174.589 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 25.0 m -79.71 -25.34 41.2 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 -177.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -72.58 -38.03 68.01 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 119.346 -0.941 . . . . 0.0 111.404 177.714 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.859 HD23 HD13 ' A' ' 962' ' ' LEU . 0.5 OUTLIER -66.91 -24.25 66.07 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.132 171.033 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -78.19 -26.3 47.52 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 119.47 -0.892 . . . . 0.0 109.708 172.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . 0.513 ' O ' ' HG2' ' A' 1001 ' ' LYS . 6.8 tp10 -74.41 -42.69 58.79 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 173.636 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.753 HD22 HD13 ' A' 1028 ' ' LEU . 0.0 OUTLIER -56.99 -47.25 81.27 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.649 -178.89 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.638 ' O ' ' HB2' ' A' 1003 ' ' LYS . 82.6 mt -66.64 -39.26 83.38 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.332 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.246 -174.532 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 21.2 m-80 -62.18 -36.75 82.84 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.072 0.463 . . . . 0.0 111.633 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.513 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 72.3 mmtt -78.28 -40.61 36.41 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 122.133 0.968 . . . . 0.0 109.422 -177.42 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.889 ' HG3' ' HB3' ' A' ' 951' ' ' TYR . 5.0 tpt -63.86 -27.32 69.08 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.28 -1.327 . . . . 0.0 109.049 178.168 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.638 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 12.4 tptp -73.28 -53.09 11.71 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.031 -1.44 . . . . 0.0 110.506 -167.4 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.6 ' HA ' ' HB2' ' A' 1007 ' ' GLN . 7.2 mp -77.4 -12.03 59.91 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.142 179.545 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1005 ' ' ALA . . . . . 0.695 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -67.56 -40.74 84.93 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 119.526 -0.87 . . . . 0.0 109.526 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.761 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.3 pp0? -75.04 -32.72 61.63 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 119.115 -0.469 . . . . 0.0 111.69 169.56 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.6 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 10.6 mm-40 -46.37 -49.51 17.76 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.04 0.447 . . . . 0.0 110.588 175.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.87 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 49.7 m-85 -126.86 48.3 2.2 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 119.844 -0.743 . . . . 0.0 110.542 171.246 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 0.926 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 11.9 p -50.94 -21.54 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.593 167.711 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1010 ' ' MET . . . . . 0.416 ' N ' HG11 ' A' 1009 ' ' VAL . 87.8 mtp -37.9 -49.35 1.22 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.161 -1.382 . . . . 0.0 111.574 172.509 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1011 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -171.76 -81.8 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 177.338 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 2.5 m -49.89 -71.46 0.06 Allowed 'General case' 0 C--O 1.246 0.911 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.829 -168.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1013 ' ' LEU . . . . . 0.87 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 4.8 mp -46.56 -42.82 16.45 Favored 'General case' 0 CA--C 1.498 -1.047 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 179.539 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 0.926 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.82 -58.01 9.26 Favored 'General case' 0 N--CA 1.438 -1.048 0 C-N-CA 119.827 -0.749 . . . . 0.0 110.769 -166.833 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A 1015 ' ' GLN . . . . . 0.628 ' O ' ' HB3' ' A' 1019 ' ' LYS . 40.3 mt-30 -67.83 -34.79 77.42 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.02 -169.452 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1016 ' ' GLU . . . . . 0.454 ' OE2' ' HE3' ' A' 1019 ' ' LYS . 18.4 tp10 -73.96 -41.64 61.68 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.307 -0.557 . . . . 0.0 111.142 177.517 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.695 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 6.1 m-85 -75.14 -34.4 61.64 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.93 0.871 . . . . 0.0 111.834 -173.927 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.507 ' HB2' ' NE2' ' A' 1014 ' ' GLN . 13.7 tptm -79.79 -40.86 27.7 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 113.414 -1.721 . . . . 0.0 110.825 -175.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1019 ' ' LYS . . . . . 0.628 ' HB3' ' O ' ' A' 1015 ' ' GLN . 0.0 OUTLIER -71.38 -35.19 71.0 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -179.58 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A 1020 ' ' GLN . . . . . 0.597 ' N ' ' HD3' ' A' 1019 ' ' LYS . 9.4 tt0 -69.99 -30.25 67.53 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.098 -1.41 . . . . 0.0 110.49 167.328 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.757 ' HG3' ' SD ' ' A' 1002 ' ' MET . 14.8 tmm? -69.02 -54.03 17.32 Favored 'General case' 0 CA--C 1.507 -0.702 0 C-N-CA 120.977 -0.289 . . . . 0.0 111.034 -179.616 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1022 ' ' LEU . . . . . 0.628 ' HA ' ' HB2' ' A' 1025 ' ' ALA . 0.2 OUTLIER -83.63 -2.72 56.72 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 119.485 -0.886 . . . . 0.0 109.462 -172.43 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 46.1 m -86.11 -34.09 20.73 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 168.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.526 ' O ' ' HB2' ' A' 1027 ' ' ALA . . . -79.09 -22.6 45.0 Favored 'General case' 0 C--O 1.221 -0.425 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 173.015 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.838 ' HB3' HG21 ' A' ' 936' ' ' VAL . . . -85.9 -26.56 25.52 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.005 169.567 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.51 ' O ' HG22 ' A' 1030 ' ' VAL . 12.9 t60 -70.86 -30.7 67.17 Favored 'General case' 0 C--O 1.215 -0.762 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 165.234 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1027 ' ' ALA . . . . . 0.526 ' HB2' ' O ' ' A' 1024 ' ' ALA . . . -64.91 -42.46 94.71 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 123.975 0.91 . . . . 0.0 110.755 163.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.753 HD13 HD22 ' A' ' 998' ' ' LEU . 30.2 mt -58.13 -46.69 85.18 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 119.923 -0.711 . . . . 0.0 109.472 171.507 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1029 ' ' ALA . . . . . 0.41 ' CB ' HG21 ' A' ' 933' ' ' VAL . . . -59.09 -43.51 91.83 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 173.565 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.566 ' O ' ' HB3' ' A' 1033 ' ' LYS . 12.2 t -68.01 -51.23 51.4 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.211 0 CA-C-O 121.675 0.75 . . . . 0.0 110.863 -176.54 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1031 ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -76.76 -29.5 56.14 Favored 'General case' 0 C--O 1.214 -0.814 0 CA-C-N 115.056 -0.974 . . . . 0.0 112.158 -175.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.595 ' HA ' ' CD2' ' A' 1035 ' ' LEU . . . -71.28 -27.67 63.59 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.509 -0.476 . . . . 0.0 109.741 171.413 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.566 ' HB3' ' O ' ' A' 1030 ' ' VAL . 84.9 tttt -65.54 -45.92 81.57 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 122.091 0.948 . . . . 0.0 109.22 168.287 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.597 ' O ' ' HB3' ' A' 1037 ' ' ASP . 56.4 t30 -70.87 -46.61 62.32 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 113.967 -1.469 . . . . 0.0 112.599 -176.026 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 0.847 ' HB2' ' HB2' ' A' ' 987' ' ' ALA . 4.0 pp -63.9 -36.38 83.76 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 122.156 -0.34 . . . . 0.0 110.627 -177.128 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.458 HD12 ' N ' ' A' 1037 ' ' ASP . 4.7 pp -72.36 -35.87 68.62 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 117.282 -1.767 . . . . 0.0 109.745 178.173 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.661 ' HA ' ' OD2' ' A' 1040 ' ' ASP . 19.3 t70 -54.88 -30.93 59.18 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 122.999 1.38 . . . . 0.0 110.585 168.716 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.514 ' HB ' ' O ' ' A' 1035 ' ' LEU . 14.3 t -73.57 -36.96 48.94 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.54 177.479 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.708 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 2.0 mp -79.31 -26.05 12.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 C-N-CA 121.123 -0.231 . . . . 0.0 111.573 172.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1040 ' ' ASP . . . . . 0.661 ' OD2' ' HA ' ' A' 1037 ' ' ASP . 0.2 OUTLIER -59.93 -44.69 94.19 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 171.48 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A 1041 ' ' GLN . . . . . 0.408 ' N ' ' OD1' ' A' 1040 ' ' ASP . 12.4 mt-30 -76.55 -31.22 57.45 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.718 174.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.708 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -56.29 -55.97 26.84 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 120.973 0.416 . . . . 0.0 111.818 -179.275 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.585 ' HG2' ' O ' ' A' 1039 ' ' ILE . 11.8 ptm180 -65.73 -34.52 78.38 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.535 -176.045 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 49.5 tp . . . . . 0 C--O 1.216 -0.707 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.772 171.705 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 924' ' ' LYS . . . . . 0.488 ' HB3' HG21 ' A' ' 968' ' ' THR . 31.0 mmtp . . . . . 0 N--CA 1.468 0.468 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 925' ' ' VAL . . . . . 0.583 ' O ' HG22 ' A' ' 929' ' ' VAL . 35.0 m -56.94 -34.95 45.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.116 0.484 . . . . 0.0 110.641 177.355 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 926' ' ' TYR . . . . . 0.492 ' CZ ' ' HG3' ' A' ' 927' ' ' GLU . 0.1 OUTLIER -74.08 -37.28 64.25 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.405 174.952 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 927' ' ' GLU . . . . . 0.492 ' HG3' ' CZ ' ' A' ' 926' ' ' TYR 0.257 1.9 tt0 -78.38 -23.78 46.65 Favored 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 118.399 -1.32 . . . . 0.0 113.758 -177.334 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 928' ' ' ASN . . . . . 0.441 ' ND2' HG22 ' A' ' 964' ' ' THR . 87.1 m-20 -72.2 -27.77 62.77 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.22 0.533 . . . . 0.0 110.097 169.504 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 929' ' ' VAL . . . . . 0.643 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 98.7 t -77.0 -29.38 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.953 171.776 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 930' ' ' THR . . . . . . . . . . . . . 25.7 m -61.48 -40.38 94.33 Favored 'General case' 0 C--N 1.311 -1.088 0 C-N-CA 119.507 -0.877 . . . . 0.0 108.898 171.121 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -71.57 -53.05 10.53 Favored Glycine 0 CA--C 1.527 0.786 0 CA-C-N 115.172 -0.922 . . . . 0.0 113.689 176.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 932' ' ' LEU . . . . . 0.643 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.8 pp -61.73 -46.67 88.65 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.94 0.718 . . . . 0.0 112.94 -176.19 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 73.5 t -68.99 -39.24 79.49 Favored 'Isoleucine or valine' 0 C--O 1.241 0.605 0 CA-C-O 121.154 0.502 . . . . 0.0 110.906 -176.039 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 934' ' ' LYS . . . . . 0.47 ' O ' ' HB2' ' A' ' 938' ' ' GLU . 5.2 tppp? -55.63 -44.11 76.8 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.679 -178.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -60.13 -45.19 93.86 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.462 177.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 936' ' ' VAL . . . . . 0.641 ' O ' ' HB2' ' A' ' 940' ' ' SER . 85.4 t -45.17 -74.32 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 123.6 0.76 . . . . 0.0 112.879 -176.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 937' ' ' ILE . . . . . 0.514 HG22 HD13 ' A' 1022 ' ' LEU . 14.5 pt -77.32 -42.53 30.76 Favored 'Isoleucine or valine' 0 C--O 1.245 0.849 0 CA-C-N 115.927 -0.579 . . . . 0.0 112.546 -174.171 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 938' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' A' ' 934' ' ' LYS . 35.4 mm-40 -66.65 -43.41 84.69 Favored 'General case' 0 C--N 1.316 -0.867 0 C-N-CA 120.53 -0.468 . . . . 0.0 111.105 -173.059 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 11.1 ttp -75.59 -27.28 58.48 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 119.225 -0.99 . . . . 0.0 110.615 176.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 940' ' ' SER . . . . . 0.641 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 32.5 t . . . . . 0 C--O 1.236 0.393 0 O-C-N 123.8 0.687 . . . . 0.0 112.101 -170.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 951' ' ' TYR . . . . . 0.552 ' CD1' ' N ' ' A' ' 951' ' ' TYR . 0.4 OUTLIER . . . . . 0 C--O 1.216 -0.699 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 952' ' ' VAL . . . . . 0.978 HG12 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -59.85 -42.69 92.24 Favored Pre-proline 0 CA--C 1.542 0.665 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.41 172.342 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 953' ' ' PRO . . . . . 0.978 ' HD3' HG12 ' A' ' 952' ' ' VAL . 87.1 Cg_exo -55.21 -38.76 93.43 Favored 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 121.212 1.274 . . . . 0.0 111.735 167.572 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 954' ' ' MET . . . . . 0.446 ' O ' HG21 ' A' ' 958' ' ' VAL . 4.0 ttm -66.38 -30.56 70.97 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.874 176.082 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 955' ' ' VAL . . . . . 0.642 HG22 ' HA ' ' A' ' 952' ' ' VAL . 69.4 t -53.53 -42.99 51.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 174.68 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.41 -36.0 80.4 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.464 175.29 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -78.46 -45.93 20.96 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 111.911 0.338 . . . . 0.0 111.911 -174.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 958' ' ' VAL . . . . . 0.685 ' O ' ' HG ' ' A' ' 962' ' ' LEU . 17.7 m -81.63 -34.7 13.15 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.663 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -60.13 -35.59 88.11 Favored Glycine 0 N--CA 1.437 -1.241 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 178.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 960' ' ' LEU . . . . . 0.524 HD11 ' HD3' ' A' ' 963' ' ' ARG . 19.5 tp -76.77 -36.57 56.94 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-O 120.697 0.284 . . . . 0.0 110.682 176.219 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -72.11 -44.21 63.54 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.097 0.475 . . . . 0.0 111.93 -173.11 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 962' ' ' LEU . . . . . 0.897 HD12 ' HG ' ' A' ' 995' ' ' LEU . 4.6 pp -87.16 -18.09 31.21 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.843 -177.853 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 963' ' ' ARG . . . . . 0.524 ' HD3' HD11 ' A' ' 960' ' ' LEU . 12.0 ptm180 -72.79 -38.01 67.38 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 118.834 -1.147 . . . . 0.0 110.119 165.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 964' ' ' THR . . . . . 0.495 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 23.9 m -65.62 -31.27 72.2 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.171 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 965' ' ' LEU . . . . . 0.686 HD23 ' HG ' ' A' ' 991' ' ' LEU . 17.7 tp -62.6 -50.16 72.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.089 171.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 966' ' ' LEU . . . . . 0.775 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 9.8 tt -64.21 -36.37 83.84 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.08 -0.963 . . . . 0.0 108.489 -174.696 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 967' ' ' ALA . . . . . 0.404 ' HA ' ' HB3' ' A' ' 970' ' ' ASP . . . -71.87 -39.19 69.8 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.925 178.496 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 968' ' ' THR . . . . . 0.488 HG21 ' HB3' ' A' ' 924' ' ' LYS . 2.2 p -61.48 -35.81 78.7 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 118.945 0.793 . . . . 0.0 110.212 174.049 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 969' ' ' VAL . . . . . 0.89 HG12 HG22 ' A' ' 984' ' ' ILE . 49.1 t -74.43 -36.61 42.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.208 174.168 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 970' ' ' ASP . . . . . 0.65 ' HB2' HE22 ' A' ' 988' ' ' GLN . 17.3 t70 -70.13 -42.04 73.14 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 122.04 0.924 . . . . 0.0 109.201 -178.629 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 971' ' ' GLU . . . . . 0.594 ' O ' HG22 ' A' ' 975' ' ' VAL . 7.9 tp10 -67.2 -31.18 71.38 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.258 -1.337 . . . . 0.0 109.904 176.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 972' ' ' SER . . . . . 0.478 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 46.9 m -68.38 -18.04 64.37 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.939 174.642 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 973' ' ' LEU . . . . . 0.887 ' HG ' ' HB2' ' A' ' 981' ' ' HIS . 10.4 tt -66.74 -51.67 38.13 Favored Pre-proline 0 CA--C 1.53 0.194 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 -177.89 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 974' ' ' PRO . . . . . 0.744 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 5.0 Cg_exo -79.61 -4.77 13.75 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 121.388 1.392 . . . . 0.0 113.004 172.322 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 975' ' ' VAL . . . . . 0.594 HG22 ' O ' ' A' ' 971' ' ' GLU . 40.1 t . . . . . 0 C--N 1.329 -0.287 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.125 171.608 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 980' ' ' THR . . . . . 0.547 HG22 ' HB1' ' A' 1042 ' ' ALA . 54.4 m . . . . . 0 CA--C 1.535 0.386 0 CA-C-O 120.661 0.267 . . . . 0.0 111.144 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 981' ' ' HIS . . . . . 0.887 ' HB2' ' HG ' ' A' ' 973' ' ' LEU . 0.3 OUTLIER -69.0 -18.4 64.05 Favored 'General case' 0 C--O 1.218 -0.554 0 O-C-N 121.934 -0.479 . . . . 0.0 112.187 -174.653 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -83.2 -21.65 33.39 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 119.849 -0.74 . . . . 0.0 110.87 177.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 983' ' ' GLU . . . . . 0.46 ' CB ' ' HB3' ' A' 1042 ' ' ALA . 3.0 mp0 -76.15 -33.51 59.38 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 165.046 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 984' ' ' ILE . . . . . 0.89 HG22 HG12 ' A' ' 969' ' ' VAL . 69.6 mt -68.36 -30.39 47.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.569 178.326 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 985' ' ' GLU . . . . . 0.632 ' HG2' ' O ' ' A' ' 981' ' ' HIS . 72.5 mm-40 -62.45 -53.16 58.88 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.269 176.054 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 20.5 ttt -69.82 -39.98 76.16 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.831 -172.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 987' ' ' ALA . . . . . 1.083 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -76.44 -53.41 8.17 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.099 -1.409 . . . . 0.0 112.624 -167.638 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 988' ' ' GLN . . . . . 0.775 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 3.2 pt20 -65.04 -21.77 66.88 Favored 'General case' 0 C--O 1.226 -0.167 0 C-N-CA 120.126 -0.629 . . . . 0.0 109.592 178.464 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 989' ' ' LYS . . . . . 0.59 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 34.0 tttp -73.3 -43.26 61.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.124 -0.944 . . . . 0.0 112.178 173.78 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 990' ' ' LEU . . . . . 0.593 ' O ' ' HB2' ' A' ' 994' ' ' ASP . 16.0 mt -52.54 -53.73 42.22 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.235 174.34 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 991' ' ' LEU . . . . . 0.687 HD12 ' HB2' ' A' ' 962' ' ' LEU . 0.4 OUTLIER -59.82 -39.54 85.41 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 175.946 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 992' ' ' ASN . . . . . 0.59 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 40.9 t-20 -52.88 -57.29 10.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.006 -0.997 . . . . 0.0 111.565 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 26.6 p -80.05 -31.24 39.5 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.211 0.448 . . . . 0.0 112.211 -178.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 994' ' ' ASP . . . . . 0.593 ' HB2' ' O ' ' A' ' 990' ' ' LEU . 0.1 OUTLIER -65.91 -42.07 90.62 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 120.272 -0.571 . . . . 0.0 110.87 178.72 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 995' ' ' LEU . . . . . 0.897 ' HG ' HD12 ' A' ' 962' ' ' LEU . 1.8 tm? -59.42 -32.86 70.57 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.486 0.715 . . . . 0.0 110.691 168.108 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -67.77 -28.34 67.53 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 118.8 -1.16 . . . . 0.0 110.28 174.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -75.26 -43.11 53.22 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 120.638 0.256 . . . . 0.0 110.337 175.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 998' ' ' LEU . . . . . 0.93 HD12 ' HB3' ' A' 1025 ' ' ALA . 8.3 tp -55.8 -47.55 76.94 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.168 0.509 . . . . 0.0 110.998 -179.059 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 999' ' ' ILE . . . . . 0.536 ' O ' ' HB2' ' A' 1003 ' ' LYS . 39.9 mm -68.12 -34.1 64.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 115.296 -0.866 . . . . 0.0 111.738 -172.099 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -63.05 -38.62 91.91 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.179 0.514 . . . . 0.0 111.618 179.095 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1001 ' ' LYS . . . . . 0.521 ' O ' ' HB3' ' A' 1017 ' ' TYR . 14.3 mptt -83.63 -36.74 23.62 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.826 0.822 . . . . 0.0 109.402 -176.121 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1002 ' ' MET . . . . . 0.441 ' HB2' ' HG2' ' A' 1021 ' ' MET . 46.3 ttm -59.87 -30.81 69.24 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 114.349 -1.296 . . . . 0.0 109.684 174.079 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1003 ' ' LYS . . . . . 0.613 ' O ' ' HG3' ' A' 1006 ' ' GLN . 4.6 tptp -74.24 -53.54 9.56 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 114.694 -1.139 . . . . 0.0 111.699 -170.595 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1004 ' ' LEU . . . . . 0.861 HD21 ' HG3' ' A' 1007 ' ' GLN . 86.4 mt -72.48 -13.69 61.49 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.461 -179.459 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1005 ' ' ALA . . . . . 0.618 ' HB3' ' HB3' ' A' 1017 ' ' TYR . . . -70.36 -42.48 71.75 Favored 'General case' 0 C--O 1.216 -0.692 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 177.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1006 ' ' GLN . . . . . 0.893 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 5.1 pp0? -75.86 -31.73 59.42 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 119.034 -0.508 . . . . 0.0 111.938 172.699 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1007 ' ' GLN . . . . . 0.861 ' HG3' HD21 ' A' 1004 ' ' LEU . 13.2 mm100 -48.36 -51.43 26.4 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.265 0.555 . . . . 0.0 110.045 175.491 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1008 ' ' TYR . . . . . 0.733 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 69.6 m-85 -120.74 45.85 2.14 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.368 173.178 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1009 ' ' VAL . . . . . 1.065 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 10.8 p -52.2 -20.54 1.91 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 CA-C-N 114.847 -1.069 . . . . 0.0 110.183 170.14 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1010 ' ' MET . . . . . 0.419 ' O ' ' HB ' ' A' 1011 ' ' THR . 24.3 mmt -38.53 -44.09 0.92 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 113.843 -1.526 . . . . 0.0 111.298 172.69 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1011 ' ' THR . . . . . 0.486 HG21 ' N ' ' A' 1012 ' ' SER . 8.1 t -178.76 -65.16 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 171.619 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1012 ' ' SER . . . . . 0.486 ' N ' HG21 ' A' 1011 ' ' THR . 6.9 m -57.65 -73.85 0.07 Allowed 'General case' 0 C--O 1.242 0.676 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -167.857 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1013 ' ' LEU . . . . . 0.733 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 7.8 mp -49.89 -37.1 29.88 Favored 'General case' 0 CA--C 1.504 -0.821 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.226 178.67 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1014 ' ' GLN . . . . . 1.065 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.88 -48.73 72.62 Favored 'General case' 0 N--CA 1.443 -0.815 0 O-C-N 123.633 0.583 . . . . 0.0 111.472 -167.088 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A 1015 ' ' GLN . . . . . 0.643 ' O ' ' HB3' ' A' 1019 ' ' LYS . 3.7 pt20 -76.27 -36.83 58.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.967 -176.102 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -74.11 -40.57 62.59 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.765 0.793 . . . . 0.0 110.836 -176.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1017 ' ' TYR . . . . . 0.618 ' HB3' ' HB3' ' A' 1005 ' ' ALA . 5.3 m-85 -78.31 -37.92 43.59 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 115.441 -0.799 . . . . 0.0 112.7 -176.706 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1018 ' ' LYS . . . . . 0.591 ' HA ' ' CB ' ' A' 1021 ' ' MET . 35.7 ttpt -81.96 -25.52 34.75 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.733 -175.425 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1019 ' ' LYS . . . . . 0.643 ' HB3' ' O ' ' A' 1015 ' ' GLN . 0.0 OUTLIER -73.33 -32.47 64.59 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 174.883 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A 1020 ' ' GLN . . . . . 0.473 ' N ' ' HD3' ' A' 1019 ' ' LYS . 49.1 mt-30 -68.32 -32.89 73.33 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.652 162.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1021 ' ' MET . . . . . 0.591 ' CB ' ' HA ' ' A' 1018 ' ' LYS . 18.2 tmm? -64.9 -53.55 44.83 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 -179.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1022 ' ' LEU . . . . . 0.514 HD13 HG22 ' A' ' 937' ' ' ILE . 0.2 OUTLIER -78.15 -11.83 59.95 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 119.248 -0.981 . . . . 0.0 109.821 -173.069 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 63.0 m -86.57 -33.95 20.06 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.761 175.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1024 ' ' ALA . . . . . 0.48 ' O ' ' HB1' ' A' 1027 ' ' ALA . . . -79.32 -23.58 43.39 Favored 'General case' 0 C--O 1.221 -0.432 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 172.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1025 ' ' ALA . . . . . 0.93 ' HB3' HD12 ' A' ' 998' ' ' LEU . . . -86.28 -24.74 25.83 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.619 170.215 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1026 ' ' HIS . . . . . 0.529 ' O ' HG22 ' A' 1030 ' ' VAL . 47.0 t60 -73.37 -28.5 62.07 Favored 'General case' 0 C--O 1.217 -0.644 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 164.287 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1027 ' ' ALA . . . . . 0.48 ' HB1' ' O ' ' A' 1024 ' ' ALA . . . -66.19 -40.9 90.76 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 123.586 0.755 . . . . 0.0 110.418 163.419 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1028 ' ' LEU . . . . . 0.746 HD13 HD23 ' A' ' 998' ' ' LEU . 25.4 mt -61.83 -43.72 98.28 Favored 'General case' 0 C--N 1.313 -0.983 0 C-N-CA 119.919 -0.712 . . . . 0.0 109.89 170.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -58.29 -40.85 83.03 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.645 0.26 . . . . 0.0 110.884 171.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1030 ' ' VAL . . . . . 0.529 HG22 ' O ' ' A' 1026 ' ' HIS . 4.7 t -67.27 -52.05 46.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 121.111 0.482 . . . . 0.0 110.742 -176.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1031 ' ' ASP . . . . . 0.613 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 1.4 m-20 -77.43 -27.85 52.36 Favored 'General case' 0 C--O 1.207 -1.144 0 CA-C-N 115.758 -0.656 . . . . 0.0 112.435 -177.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1032 ' ' ALA . . . . . 0.6 ' O ' HD12 ' A' 1036 ' ' LEU . . . -66.76 -32.7 74.16 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 121.769 -0.582 . . . . 0.0 109.438 169.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1033 ' ' LYS . . . . . 0.403 ' HB3' ' O ' ' A' 1030 ' ' VAL . 87.7 tttt -68.51 -39.66 81.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.894 0.854 . . . . 0.0 109.523 170.216 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1034 ' ' ASN . . . . . 0.613 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 36.6 t30 -71.21 -52.69 17.65 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 114.787 -1.097 . . . . 0.0 111.444 -177.267 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1035 ' ' LEU . . . . . 1.083 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 3.7 pp -64.14 -42.2 96.88 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 118.911 -0.566 . . . . 0.0 111.671 -171.29 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1036 ' ' LEU . . . . . 0.687 HD13 ' H ' ' A' 1037 ' ' ASP . 0.0 OUTLIER -71.76 -33.05 68.32 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 116.416 -2.114 . . . . 0.0 109.056 -178.573 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A 1037 ' ' ASP . . . . . 0.687 ' H ' HD13 ' A' 1036 ' ' LEU . 22.0 t70 -57.28 -44.93 84.46 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.073 171.034 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1038 ' ' VAL . . . . . 0.495 HG22 ' O ' ' A' 1034 ' ' ASN . 37.4 t -56.15 -38.29 53.32 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.61 0 CA-C-N 114.193 -1.367 . . . . 0.0 111.812 175.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1039 ' ' ILE . . . . . 0.647 HD12 ' HA ' ' A' ' 984' ' ' ILE . 1.6 mp -80.61 -32.39 13.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 118.451 0.569 . . . . 0.0 111.814 175.332 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.19 -38.57 89.59 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.55 0.691 . . . . 0.0 109.859 170.526 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -76.11 -33.13 59.46 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.779 173.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 1042 ' ' ALA . . . . . 0.57 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -55.89 -55.46 32.36 Favored 'General case' 0 CA--C 1.501 -0.94 0 C-N-CA 123.101 0.56 . . . . 0.0 111.984 178.249 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 1043 ' ' ARG . . . . . 0.706 ' HD3' ' N ' ' A' 1044 ' ' LEU . 0.0 OUTLIER -65.03 -34.61 78.84 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 -176.877 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A 1044 ' ' LEU . . . . . 0.706 ' N ' ' HD3' ' A' 1043 ' ' ARG . 30.8 tp . . . . . 0 N--CA 1.435 -1.176 0 CA-C-N 115.05 -0.977 . . . . 0.0 109.054 177.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.818 0 N-CA-C 112.02 -0.432 . . . . 0.0 112.02 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 909' ' ' SER . . . . . 0.409 ' HA ' ' HD3' ' A' ' 910' ' ' PRO . 9.6 t -103.62 118.49 57.36 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 910' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 909' ' ' SER . 28.0 Cg_endo -90.33 127.79 1.43 Allowed 'Trans proline' 0 N--CA 1.454 -0.851 0 C-N-CA 122.997 2.464 . . . . 0.0 112.421 178.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -143.51 24.31 2.17 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.088 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 8.0 tp -70.84 -29.72 38.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.036 0.446 . . . . 0.0 110.866 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 13.2 p -139.99 147.82 41.0 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.61 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 169.46 -71.26 0.14 Allowed Glycine 0 N--CA 1.448 -0.52 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.9 178.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 121.37 -153.56 16.66 Favored Glycine 0 N--CA 1.445 -0.734 0 C-N-CA 120.939 -0.648 . . . . 0.0 111.867 -178.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . -86.56 60.87 4.47 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.254 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . 135.01 -148.93 19.76 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.978 -0.629 . . . . 0.0 112.529 178.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . 90.62 -168.9 33.59 Favored Glycine 0 N--CA 1.45 -0.431 0 N-CA-C 111.384 -0.687 . . . . 0.0 111.384 -177.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 919' ' ' ILE . . . . . 0.568 ' HB ' ' HB3' ' A' 1040 ' ' ASP . 2.1 pp -95.09 125.98 47.62 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 CA-C-N 117.039 0.42 . . . . 0.0 109.878 175.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.65 ' HB3' HD12 ' A' 1044 ' ' LEU . 60.7 ttp180 -158.72 109.64 2.1 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -176.264 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 921' ' ' SER . . . . . 0.41 ' HG ' ' CG ' ' A' 1040 ' ' ASP . 62.5 p -176.16 -50.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.773 167.354 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 56.74 53.92 7.81 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 122.077 0.941 . . . . 0.0 109.012 -174.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.573 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 18.8 t0 -76.51 -174.41 2.9 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 113.879 -1.51 . . . . 0.0 111.438 -172.267 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.775 ' HB2' HG23 ' A' ' 968' ' ' THR . 33.4 mmtp -52.87 -27.92 20.7 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.711 176.021 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.587 ' O ' HG21 ' A' ' 929' ' ' VAL . 16.6 m -55.38 -31.84 28.15 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.396 0 CA-C-O 121.02 0.438 . . . . 0.0 110.528 175.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.573 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -77.79 -32.76 52.6 Favored 'General case' 0 CA--C 1.501 -0.938 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.585 177.175 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -77.53 -23.94 50.04 Favored 'General case' 0 C--N 1.3 -1.558 0 C-N-CA 118.261 -1.376 . . . . 0.0 112.397 178.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.508 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 2.7 m120 -72.44 -30.19 64.37 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 121.863 0.839 . . . . 0.0 108.848 171.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.587 HG21 ' O ' ' A' ' 925' ' ' VAL . 90.2 t -79.51 -28.45 13.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 114.666 -1.152 . . . . 0.0 110.362 176.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.589 ' O ' ' HD2' ' A' ' 934' ' ' LYS . 53.2 m -57.47 -49.26 76.84 Favored 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 119.561 -0.856 . . . . 0.0 108.786 170.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -64.11 -51.4 53.33 Favored Glycine 0 CA--C 1.525 0.707 0 CA-C-N 115.355 -0.838 . . . . 0.0 113.459 177.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.476 HD22 ' HA ' ' A' ' 929' ' ' VAL . 0.3 OUTLIER -61.91 -49.02 77.85 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 112.751 0.648 . . . . 0.0 112.751 -175.882 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.454 HG21 ' HA ' ' A' 1029 ' ' ALA . 53.0 t -70.17 -38.27 74.26 Favored 'Isoleucine or valine' 0 C--O 1.24 0.576 0 CA-C-O 120.947 0.403 . . . . 0.0 111.446 -174.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.589 ' HD2' ' O ' ' A' ' 930' ' ' THR . 0.2 OUTLIER -58.92 -37.15 76.01 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.492 179.208 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.48 ' HA ' ' SD ' ' A' ' 939' ' ' MET . . . -64.03 -42.01 97.22 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.607 -0.269 . . . . 0.0 111.066 177.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.75 HG21 ' HB3' ' A' 1025 ' ' ALA . 99.3 t -47.55 -69.79 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.065 -178.148 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 26.7 pt -71.95 -39.76 67.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 N-CA-C 112.489 0.551 . . . . 0.0 112.489 -176.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.409 ' O ' ' HG3' ' A' ' 942' ' ' LYS . 41.3 mt-10 -72.52 -52.19 16.76 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 119.722 -0.791 . . . . 0.0 111.37 -173.039 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.522 ' HA ' ' HD2' ' A' ' 942' ' ' LYS . 1.0 OUTLIER -68.59 -24.78 64.63 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.252 -0.579 . . . . 0.0 109.57 -179.065 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.733 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 8.7 p -53.9 -39.47 65.81 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.206 -179.079 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 11.9 m -94.97 -8.76 36.01 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.753 -179.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.522 ' HD2' ' HA ' ' A' ' 939' ' ' MET . 55.0 mttm -81.24 -13.59 58.35 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 175.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.757 HG21 ' HE1' ' A' ' 951' ' ' TYR . 2.0 pp -78.7 -2.59 5.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.117 169.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.73 ' HB3' ' HD3' ' A' ' 945' ' ' PRO . 10.0 tt0 -75.94 -53.74 2.29 Favored Pre-proline 0 CA--C 1.54 0.576 0 O-C-N 122.302 -0.249 . . . . 0.0 111.173 178.498 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.73 ' HD3' ' HB3' ' A' ' 944' ' ' GLN . 36.5 Cg_exo -62.12 -47.61 9.94 Favored 'Trans proline' 0 C--N 1.358 1.07 0 C-N-CA 121.896 1.73 . . . . 0.0 111.571 174.405 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . . . . . . . . . . . -109.38 99.07 35.09 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 176.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.813 ' HB2' ' HD3' ' A' ' 948' ' ' PRO . 54.0 Cg_exo -49.68 -61.49 0.56 Allowed 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 122.932 2.421 . . . . 0.0 113.718 -172.525 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.813 ' HD3' ' HB2' ' A' ' 947' ' ' PRO . 5.6 Cg_endo -88.19 100.56 0.43 Allowed 'Trans proline' 0 N--CA 1.442 -1.547 0 C-N-CA 121.207 1.271 . . . . 0.0 112.298 178.418 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 0.715 ' HB2' HG22 ' A' ' 943' ' ' ILE . 55.4 tt0 -67.94 -13.53 62.24 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 114.471 -1.241 . . . . 0.0 108.699 168.275 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.518 ' HB2' ' O ' ' A' ' 949' ' ' GLU . 47.2 mt-10 72.2 -9.29 1.03 Allowed 'General case' 0 C--N 1.349 0.544 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.567 -165.431 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.934 ' HB3' ' HG2' ' A' 1002 ' ' MET . 22.4 m-85 52.18 -46.78 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.899 1.679 . . . . 0.0 114.774 178.327 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 0.587 ' O ' ' HB ' ' A' ' 955' ' ' VAL . 45.8 t -50.57 -43.13 79.9 Favored Pre-proline 0 C--N 1.322 -0.63 0 C-N-CA 122.861 0.464 . . . . 0.0 111.703 173.43 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 0.628 ' O ' ' HB3' ' A' ' 956' ' ' LYS . 24.3 Cg_exo -49.31 -43.05 39.14 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 122.022 1.815 . . . . 0.0 112.831 172.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.407 ' O ' HG12 ' A' ' 958' ' ' VAL . 21.2 ttt -76.26 -31.09 58.11 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.566 176.287 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.587 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 78.9 t -52.96 -35.77 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 167.741 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.628 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 11.1 tmtt? -66.58 -36.43 82.61 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.119 172.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -76.93 -47.0 22.24 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.908 0.385 . . . . 0.0 111.554 -174.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.598 HG22 HD23 ' A' ' 962' ' ' LEU . 14.1 p -85.4 -33.51 7.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.063 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -60.44 -43.11 99.09 Favored Glycine 0 N--CA 1.447 -0.59 0 N-CA-C 110.8 -0.92 . . . . 0.0 110.8 176.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . 0.427 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 14.7 tp -63.57 -36.76 84.87 Favored 'General case' 0 C--O 1.22 -0.468 0 C-N-CA 122.235 0.214 . . . . 0.0 110.716 176.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -75.72 -38.12 58.83 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.266 0.555 . . . . 0.0 111.046 -174.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.855 HD21 HD13 ' A' ' 995' ' ' LEU . 4.3 pp -87.37 -20.26 26.96 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.613 -178.203 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.427 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 15.3 ptm180 -77.01 -35.93 56.67 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 119.574 -0.85 . . . . 0.0 110.668 165.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 85.8 m -61.5 -36.02 79.34 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 173.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.508 ' HA ' ' OD1' ' A' ' 928' ' ' ASN . 18.5 tp -61.77 -47.85 83.34 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.293 -1.321 . . . . 0.0 110.207 173.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.758 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.4 tt -66.04 -37.85 86.89 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.191 -173.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -71.91 -31.15 66.1 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.901 178.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.775 HG23 ' HB2' ' A' ' 924' ' ' LYS . 23.5 m -71.22 -36.91 72.03 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 119.668 -0.813 . . . . 0.0 109.553 173.371 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.823 HG12 HG23 ' A' ' 984' ' ' ILE . 61.7 t -68.47 -39.78 81.19 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.338 172.458 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.715 ' HB2' HE22 ' A' ' 988' ' ' GLN . 10.3 t70 -67.23 -40.23 86.34 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.85 0.833 . . . . 0.0 108.758 -178.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.657 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 8.1 tp10 -68.28 -29.47 68.26 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 114.561 -1.2 . . . . 0.0 109.726 177.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.685 ' HA ' HG22 ' A' ' 975' ' ' VAL . 70.8 m -69.52 -17.91 63.62 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.879 175.65 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.881 ' HB2' HG21 ' A' ' 984' ' ' ILE . 10.5 tt -68.81 -52.78 16.81 Favored Pre-proline 0 N--CA 1.449 -0.493 0 C-N-CA 120.973 -0.291 . . . . 0.0 110.324 -177.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.657 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 90.4 Cg_endo -90.91 0.75 4.94 Favored 'Trans proline' 0 C--N 1.357 0.991 0 C-N-CA 121.357 1.371 . . . . 0.0 114.72 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.685 HG22 ' HA ' ' A' ' 972' ' ' SER . 27.4 m -84.94 -26.52 6.73 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 O-C-N 121.427 -0.795 . . . . 0.0 111.298 172.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.533 ' HG ' ' HD2' ' A' ' 977' ' ' PRO . 1.1 tp -108.17 160.02 28.52 Favored Pre-proline 0 C--N 1.327 -0.384 0 C-N-CA 120.664 -0.414 . . . . 0.0 111.303 178.343 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . 0.533 ' HD2' ' HG ' ' A' ' 976' ' ' LEU . 72.9 Cg_exo -53.13 167.08 0.8 Allowed 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 123.619 2.879 . . . . 0.0 113.703 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . 0.415 ' HA ' ' CD2' ' A' ' 981' ' ' HIS . . . -53.43 -32.7 50.96 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.032 -0.986 . . . . 0.0 113.436 -170.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.736 ' HB2' ' SD ' ' A' 1046 ' ' MET . 5.1 p -60.0 -53.12 61.52 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.763 HG22 ' HB1' ' A' 1042 ' ' ALA . 25.8 m -59.79 -21.75 61.25 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 122.488 0.315 . . . . 0.0 111.816 -176.49 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.502 ' O ' ' HG2' ' A' ' 985' ' ' GLU . 12.2 m170 -50.56 -40.54 52.39 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -177.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . 0.466 ' HA ' ' CG ' ' A' ' 985' ' ' GLU . 11.1 ptt180 -83.52 -18.75 37.37 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 -171.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.417 ' HG3' ' CG1' ' A' 1038 ' ' VAL . 0.4 OUTLIER -74.3 -34.6 63.57 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 171.7 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.881 HG21 ' HB2' ' A' ' 973' ' ' LEU . 1.8 mp -70.99 -32.75 49.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 176.058 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . 0.502 ' HG2' ' O ' ' A' ' 981' ' ' HIS . 64.5 mm-40 -57.6 -54.19 49.63 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.325 174.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 48.0 ttm -68.47 -45.59 72.03 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.246 -172.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.669 ' HB2' ' HB3' ' A' 1035 ' ' LEU . . . -68.69 -52.2 33.54 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.299 -0.864 . . . . 0.0 112.737 -171.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.758 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 3.3 pt20 -65.13 -26.98 68.42 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 119.759 -0.776 . . . . 0.0 111.446 -177.156 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . 0.827 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 54.9 mtpt -75.15 -42.31 56.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.282 0.563 . . . . 0.0 111.697 175.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.604 HD22 HD13 ' A' 1035 ' ' LEU . 39.3 tp -54.0 -58.19 8.25 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -178.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.899 HD12 ' HA ' ' A' 1028 ' ' LEU . 11.4 tp -68.3 -23.12 64.7 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 120.336 -0.545 . . . . 0.0 110.169 179.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . 0.827 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 25.2 t-20 -51.77 -54.13 32.05 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.82 174.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 6.8 p -76.49 -26.1 54.95 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.355 177.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -64.19 -52.46 58.79 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.323 0.582 . . . . 0.0 110.198 177.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.855 HD13 HD21 ' A' ' 962' ' ' LEU . 0.3 OUTLIER -51.95 -28.36 16.34 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.704 168.598 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -70.29 -35.77 73.93 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 118.789 -1.164 . . . . 0.0 111.291 176.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.525 ' O ' ' HD3' ' A' 1001 ' ' LYS . 3.9 pt-20 -78.06 -29.51 49.25 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 121.134 -0.979 . . . . 0.0 110.912 175.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.833 HD23 HD13 ' A' 1028 ' ' LEU . 0.1 OUTLIER -56.15 -47.08 78.91 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 121.296 0.569 . . . . 0.0 110.062 178.513 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.502 ' O ' ' HB2' ' A' 1003 ' ' LYS . 75.2 mt -70.66 -32.99 51.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 114.927 -1.033 . . . . 0.0 111.522 -174.552 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -65.46 -41.29 93.55 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.995 0.426 . . . . 0.0 111.879 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.53 ' O ' ' HB3' ' A' 1017 ' ' TYR . 0.6 OUTLIER -78.39 -34.56 48.09 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 122.332 1.063 . . . . 0.0 108.742 -178.964 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.934 ' HG2' ' HB3' ' A' ' 951' ' ' TYR . 12.5 ttt -62.57 -27.74 69.39 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 113.977 -1.465 . . . . 0.0 109.046 176.256 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.502 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 2.6 tptp -74.84 -53.05 9.81 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 113.753 -1.567 . . . . 0.0 110.623 -167.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.625 ' HA ' ' HG2' ' A' 1007 ' ' GLN . 7.4 mp -75.15 -12.32 60.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.87 -179.024 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1005 ' ' ALA . . . . . 0.729 ' HB1' ' HB3' ' A' 1017 ' ' TYR . . . -70.28 -50.03 43.67 Favored 'General case' 0 C--O 1.216 -0.698 0 C-N-CA 119.364 -0.934 . . . . 0.0 109.747 177.316 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.938 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.3 pp0? -71.71 -30.64 65.87 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 174.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.625 ' HG2' ' HA ' ' A' 1004 ' ' LEU . 4.7 pt20 -57.87 -48.15 80.65 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 119.989 -0.684 . . . . 0.0 109.703 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.652 ' HB2' HD11 ' A' 1013 ' ' LEU . 14.0 m-30 -115.22 42.01 2.32 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 173.564 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 1.003 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 12.4 p -54.0 -24.56 11.14 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.301 0 CA-C-O 122.319 1.057 . . . . 0.0 109.743 173.259 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 49.3 mtt -55.96 -20.72 17.39 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 113.687 -1.597 . . . . 0.0 111.529 174.294 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1011 ' ' THR . . . . . 0.447 ' HB ' ' H ' ' A' 1012 ' ' SER . 16.9 p -142.87 -153.08 0.44 Allowed 'General case' 0 C--O 1.262 1.713 0 CA-C-O 123.596 1.665 . . . . 0.0 115.276 -172.068 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1012 ' ' SER . . . . . 0.447 ' H ' ' HB ' ' A' 1011 ' ' THR . 26.2 p -55.04 -37.99 67.4 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 113.048 -1.887 . . . . 0.0 112.743 -173.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.746 ' O ' ' HB2' ' A' 1017 ' ' TYR . 6.6 mt -52.9 -40.32 63.44 Favored 'General case' 0 CA--C 1.494 -1.185 0 C-N-CA 120.196 -0.602 . . . . 0.0 110.507 178.14 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 1.003 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.09 -53.7 49.56 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-O 121.699 0.761 . . . . 0.0 109.398 -173.952 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A 1015 ' ' GLN . . . . . 0.503 ' O ' ' HD3' ' A' 1019 ' ' LYS . 0.9 OUTLIER -72.61 -41.14 65.89 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 114.587 -1.188 . . . . 0.0 112.231 -177.273 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -70.64 -55.47 8.69 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 122.818 0.447 . . . . 0.0 112.041 -178.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.746 ' HB2' ' O ' ' A' 1013 ' ' LEU . 7.3 m-85 -62.11 -33.33 74.25 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -177.205 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.634 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 54.3 tptt -78.93 -27.8 43.74 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.492 -177.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1019 ' ' LYS . . . . . 0.503 ' HD3' ' O ' ' A' 1015 ' ' GLN . 4.3 mptp? -71.68 -50.23 32.33 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 172.183 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -52.23 -31.41 32.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.83 165.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.559 ' HG3' ' CB ' ' A' 1002 ' ' MET . 2.3 ttp -67.81 -49.23 63.45 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 178.252 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1022 ' ' LEU . . . . . 0.718 ' HA ' ' HB2' ' A' 1025 ' ' ALA . 0.0 OUTLIER -81.92 -8.58 59.69 Favored 'General case' 0 C--O 1.218 -0.586 0 C-N-CA 118.987 -1.085 . . . . 0.0 109.41 -177.16 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 52.4 m -76.8 -45.74 27.64 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.718 171.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.549 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -74.85 -21.46 59.25 Favored 'General case' 0 C--O 1.213 -0.845 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 173.459 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.75 ' HB3' HG21 ' A' ' 936' ' ' VAL . . . -84.56 -25.94 28.34 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.223 172.428 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.461 ' O ' HG23 ' A' 1030 ' ' VAL . 42.4 t-80 -78.32 -22.71 47.69 Favored 'General case' 0 C--O 1.214 -0.793 0 O-C-N 121.845 -0.534 . . . . 0.0 109.641 167.257 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -69.84 -42.55 73.45 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 123.421 0.688 . . . . 0.0 109.82 162.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.899 ' HA ' HD12 ' A' ' 991' ' ' LEU . 49.7 mt -56.12 -50.05 72.17 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 168.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1029 ' ' ALA . . . . . 0.454 ' HA ' HG21 ' A' ' 933' ' ' VAL . . . -59.6 -43.48 93.7 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 175.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' 1026 ' ' HIS . 3.7 t -66.98 -50.82 60.92 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.305 0 CA-C-O 121.019 0.438 . . . . 0.0 110.564 -176.407 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.569 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 4.0 m-20 -76.36 -29.1 57.06 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.83 -178.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.536 ' HB3' HG23 ' A' ' 929' ' ' VAL . . . -67.22 -27.43 67.23 Favored 'General case' 0 C--N 1.321 -0.645 0 O-C-N 121.426 -0.796 . . . . 0.0 109.749 172.344 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.449 ' C ' ' HD3' ' A' 1033 ' ' LYS . 12.7 tmtt? -70.36 -51.86 26.76 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 167.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.569 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 36.1 t30 -63.37 -56.66 14.55 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 114.838 -1.074 . . . . 0.0 112.569 -174.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.669 ' HB3' ' HB2' ' A' ' 987' ' ' ALA . 0.2 OUTLIER -60.24 -35.85 76.41 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.775 -0.193 . . . . 0.0 110.578 -179.865 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.525 HD22 ' C ' ' A' 1036 ' ' LEU . 0.8 OUTLIER -67.57 -47.27 70.27 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 118.987 -1.085 . . . . 0.0 108.712 179.122 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.504 ' O ' ' HB2' ' A' 1041 ' ' GLN . 13.4 t70 -51.32 -28.35 11.99 Favored 'General case' 0 C--O 1.215 -0.729 0 CA-C-N 113.873 -1.512 . . . . 0.0 109.977 172.258 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.54 ' HB ' ' O ' ' A' 1035 ' ' LEU . 30.1 t -75.19 -29.95 22.36 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.536 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.778 178.404 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.522 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 1.8 mp -85.78 -34.75 8.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 CA-C-N 118.221 0.464 . . . . 0.0 111.577 172.094 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.568 ' HB3' ' HB ' ' A' ' 919' ' ' ILE . 0.9 OUTLIER -59.65 -42.86 93.75 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 167.221 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.504 ' HB2' ' O ' ' A' 1037 ' ' ASP . 1.7 mt-30 -58.53 -54.09 51.02 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.894 168.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.763 ' HB1' HG22 ' A' ' 980' ' ' THR . . . -53.19 -47.12 69.14 Favored 'General case' 0 CA--C 1.499 -1.017 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.735 -170.501 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.567 ' O ' HG12 ' A' 1047 ' ' ILE . 13.8 ptp180 -67.56 -46.69 71.96 Favored 'General case' 0 N--CA 1.432 -1.364 0 C-N-CA 119.91 -0.716 . . . . 0.0 110.668 -172.478 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.65 HD12 ' HB3' ' A' ' 920' ' ' ARG . 36.5 mt -80.49 -32.93 36.88 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 120.233 -0.587 . . . . 0.0 112.069 -178.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1045 ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -68.22 -34.51 76.37 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 122.652 0.381 . . . . 0.0 111.056 -179.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.736 ' SD ' ' HB2' ' A' ' 979' ' ' SER . 24.1 mmt -73.83 -28.62 61.7 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.758 0.313 . . . . 0.0 110.755 176.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.567 HG12 ' O ' ' A' 1043 ' ' ARG . 49.0 mm -75.66 -33.71 27.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 121.23 0.538 . . . . 0.0 110.274 172.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 47.1 m -78.25 -11.43 59.93 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.832 178.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -84.97 151.58 24.11 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.068 -176.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 48.3 t -109.42 -37.94 5.6 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.688 -176.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1051 ' ' ARG . . . . . 0.6 ' CB ' ' HD3' ' A' 1052 ' ' PRO . 0.6 OUTLIER -76.48 -69.37 0.24 Allowed Pre-proline 0 CA--C 1.535 0.39 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.513 -173.75 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A 1052 ' ' PRO . . . . . 0.6 ' HD3' ' CB ' ' A' 1051 ' ' ARG . 66.0 Cg_endo -98.02 129.18 0.25 Allowed 'Trans proline' 0 N--CA 1.447 -1.243 0 C-N-CA 121.685 1.59 . . . . 0.0 112.377 178.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 55.4 t-80 . . . . . 0 C--N 1.324 -0.542 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.009 178.863 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.755 0 N-CA-C 111.987 -0.445 . . . . 0.0 111.987 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 909' ' ' SER . . . . . 0.45 ' HA ' ' HD3' ' A' ' 910' ' ' PRO . 27.5 t -126.95 137.03 29.73 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 179.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 910' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 909' ' ' SER . 12.6 Cg_exo -71.73 -2.42 11.39 Favored 'Trans proline' 0 CA--C 1.531 0.355 0 C-N-CA 123.18 2.586 . . . . 0.0 113.046 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -86.73 61.82 4.32 Favored Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 120.795 -0.716 . . . . 0.0 111.89 179.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 36.0 pt -102.23 -12.55 8.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 -176.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 8.8 p -130.19 -43.79 1.17 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.016 0.436 . . . . 0.0 111.1 -177.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . -174.73 -115.63 0.41 Allowed Glycine 0 N--CA 1.445 -0.716 0 N-CA-C 111.274 -0.73 . . . . 0.0 111.274 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 143.23 94.4 0.2 Allowed Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.434 178.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . -130.85 48.43 0.97 Allowed Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.363 -0.695 . . . . 0.0 111.363 177.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . 115.81 74.45 0.56 Allowed Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 110.76 -0.936 . . . . 0.0 110.76 -175.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -65.52 -17.65 64.71 Favored Glycine 0 N--CA 1.454 -0.133 0 C-N-CA 121.435 -0.412 . . . . 0.0 113.739 -174.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 919' ' ' ILE . . . . . 0.931 HG13 ' HG3' ' A' ' 920' ' ' ARG . 0.0 OUTLIER -77.58 137.98 21.27 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.226 0 CA-C-O 122.212 1.006 . . . . 0.0 111.4 179.436 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.931 ' HG3' HG13 ' A' ' 919' ' ' ILE . 58.4 mtt180 79.65 86.44 0.06 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 112.676 -2.056 . . . . 0.0 111.992 174.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 60.6 p -153.73 -12.45 0.14 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.779 -1.101 . . . . 0.0 111.222 173.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -94.93 -59.68 1.85 Allowed 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.272 -179.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.771 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 28.7 m-20 73.36 -10.53 1.02 Allowed 'General case' 0 C--O 1.213 -0.817 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 169.102 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.692 ' HG3' HG21 ' A' ' 968' ' ' THR . 17.9 tppt? -57.25 -33.68 67.84 Favored 'General case' 0 C--N 1.315 -0.898 0 O-C-N 120.937 -1.102 . . . . 0.0 111.927 -172.563 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.614 ' O ' HG21 ' A' ' 929' ' ' VAL . 12.3 t -65.7 -28.22 43.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.191 0.52 . . . . 0.0 110.691 177.374 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.771 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -75.94 -26.42 56.87 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.398 0.679 . . . . 0.0 111.66 -177.514 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . 0.517 ' O ' HG22 ' A' ' 930' ' ' THR . 7.8 pt-20 -76.74 -24.13 53.01 Favored 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 118.743 -1.183 . . . . 0.0 109.853 172.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.475 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 1.7 m120 -71.33 -30.72 66.54 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 170.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.63 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 68.6 t -80.88 -30.53 11.88 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-N 114.811 -1.086 . . . . 0.0 111.68 177.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.517 HG22 ' O ' ' A' ' 927' ' ' GLU . 3.6 t -66.29 -30.8 71.3 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 120.222 1.374 . . . . 0.0 107.759 170.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -72.53 -52.73 9.6 Favored Glycine 0 CA--C 1.526 0.727 0 CA-C-N 115.35 -0.841 . . . . 0.0 113.239 175.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.63 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.1 pp -66.99 -49.35 65.64 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -177.372 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.586 HG21 ' HA ' ' A' 1029 ' ' ALA . 79.0 t -68.42 -37.18 77.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-O 121.038 0.446 . . . . 0.0 111.151 -174.267 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.439 ' O ' ' HB2' ' A' ' 938' ' ' GLU . 30.2 ttpt -58.26 -46.31 86.24 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.159 179.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -56.17 -36.68 68.61 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.671 176.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.775 HG21 ' HB2' ' A' 1025 ' ' ALA . 85.0 t -52.85 -75.45 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-O 121.12 0.486 . . . . 0.0 112.086 -178.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 30.7 pt -68.01 -41.68 84.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.328 -176.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.439 ' HB2' ' O ' ' A' ' 934' ' ' LYS . 9.2 mm-40 -64.49 -49.63 70.6 Favored 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.908 -174.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.548 ' HB3' ' OE1' ' A' ' 949' ' ' GLU . 25.0 mmt -74.53 -24.94 59.03 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.336 -179.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.59 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 24.8 p -52.87 -38.64 61.85 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.384 0.611 . . . . 0.0 111.078 -174.094 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 44.6 m -107.34 -18.09 13.96 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 114.932 -1.031 . . . . 0.0 112.453 -176.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -82.81 -7.68 59.64 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 119.554 -0.858 . . . . 0.0 110.292 -177.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.819 HD11 ' HG2' ' A' 1018 ' ' LYS . 41.0 pt -62.37 -26.49 40.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.331 165.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.66 ' HB3' ' HD3' ' A' ' 945' ' ' PRO . 6.5 tp-100 -65.2 -57.72 14.49 Favored Pre-proline 0 CA--C 1.54 0.561 0 N-CA-C 112.378 0.511 . . . . 0.0 112.378 -172.251 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.66 ' HD3' ' HB3' ' A' ' 944' ' ' GLN . 85.1 Cg_endo -85.17 16.26 2.02 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 121.882 1.721 . . . . 0.0 113.179 -178.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.61 ' HB1' ' HD2' ' A' ' 947' ' ' PRO . . . -135.58 170.17 11.79 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 116.614 -0.267 . . . . 0.0 110.546 -176.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.61 ' HD2' ' HB1' ' A' ' 946' ' ' ALA . 38.1 Cg_endo -67.99 170.0 15.24 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.099 1.866 . . . . 0.0 111.1 171.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.562 ' HA ' HG22 ' A' 1009 ' ' VAL . 4.3 Cg_exo -41.72 133.66 3.81 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.414 2.743 . . . . 0.0 112.957 -179.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 0.625 ' HB2' HG23 ' A' ' 943' ' ' ILE . 26.8 tt0 -59.64 -22.9 62.52 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.063 176.505 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.828 ' HB3' ' HG2' ' A' ' 953' ' ' PRO . 12.5 mm-40 55.22 66.64 1.17 Allowed 'General case' 0 N--CA 1.438 -1.033 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 -165.14 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.774 ' HB3' ' HB2' ' A' 1002 ' ' MET . 35.3 m-85 -53.58 -31.22 45.93 Favored 'General case' 0 C--O 1.21 -0.974 0 CA-C-N 113.545 -1.661 . . . . 0.0 111.912 179.25 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 0.645 ' HA ' HG21 ' A' ' 955' ' ' VAL . 0.1 OUTLIER -63.07 -52.88 59.55 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.859 174.097 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 0.828 ' HG2' ' HB3' ' A' ' 950' ' ' GLU . 0.5 OUTLIER -46.26 -43.68 20.93 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 121.936 1.757 . . . . 0.0 113.309 161.322 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.702 ' HB3' ' HA ' ' A' ' 951' ' ' TYR . 27.3 tpp -60.83 -33.49 73.12 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.794 0.33 . . . . 0.0 110.859 176.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.645 HG21 ' HA ' ' A' ' 952' ' ' VAL . 60.0 t -51.84 -40.1 26.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.249 -0.432 . . . . 0.0 109.946 172.6 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.515 ' HD3' ' HA ' ' A' ' 953' ' ' PRO . 3.2 mptp? -66.59 -36.73 83.33 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.735 0.302 . . . . 0.0 110.862 175.688 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -79.85 -45.45 18.66 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.186 -0.461 . . . . 0.0 112.125 -172.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.419 HG12 ' O ' ' A' ' 954' ' ' MET . 11.8 p -84.26 -26.34 7.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -65.02 -30.77 78.86 Favored Glycine 0 N--CA 1.442 -0.944 0 N-CA-C 110.03 -1.228 . . . . 0.0 110.03 169.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . 0.596 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 19.5 tp -71.08 -38.59 72.43 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.305 -0.448 . . . . 0.0 110.097 176.029 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.501 ' HB1' ' HB3' ' A' ' 932' ' ' LEU . . . -72.46 -39.7 67.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.905 0.383 . . . . 0.0 111.109 -174.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.404 HD23 HD21 ' A' ' 995' ' ' LEU . 0.0 OUTLIER -70.18 -40.53 74.61 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-O 119.095 -0.478 . . . . 0.0 110.873 173.346 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.596 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 4.6 ptp180 -67.03 -31.38 71.86 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 118.735 -1.186 . . . . 0.0 110.306 178.391 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 964' ' ' THR . . . . . 0.494 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 40.5 m -68.62 -40.96 80.13 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.127 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.624 HD21 HD13 ' A' ' 991' ' ' LEU . 0.1 OUTLIER -63.76 -39.58 94.63 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 114.062 -1.426 . . . . 0.0 110.92 175.535 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.609 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.2 tt -76.17 -35.08 59.32 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 -172.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . 0.41 ' O ' ' HB2' ' A' ' 971' ' ' GLU . . . -72.08 -31.07 65.74 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.393 178.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.692 HG21 ' HG3' ' A' ' 924' ' ' LYS . 13.6 p -70.6 -41.58 72.12 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 118.347 0.521 . . . . 0.0 110.301 174.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 1.0 HG13 HG21 ' A' ' 984' ' ' ILE . 61.2 t -68.52 -38.19 78.82 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.991 172.494 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.547 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 16.5 t70 -68.06 -39.54 82.97 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.965 0.888 . . . . 0.0 108.88 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.644 ' O ' HG23 ' A' ' 975' ' ' VAL . 37.5 tt0 -65.74 -32.92 74.73 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.272 -1.331 . . . . 0.0 109.672 177.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.45 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 71.9 m -66.97 -17.81 65.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.979 175.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.746 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 8.5 tt -68.57 -52.39 19.64 Favored Pre-proline 0 CA--C 1.534 0.33 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 -178.314 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.746 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 5.7 Cg_exo -81.89 0.62 9.74 Favored 'Trans proline' 0 C--N 1.354 0.857 0 C-N-CA 121.478 1.452 . . . . 0.0 112.908 173.033 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.644 HG23 ' O ' ' A' ' 971' ' ' GLU . 17.5 t -73.44 -52.09 22.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 170.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . . . . . . . . . 32.1 tp -134.12 95.37 16.9 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-O 120.993 0.425 . . . . 0.0 110.38 178.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_exo -72.98 -173.72 1.32 Allowed 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 123.329 2.686 . . . . 0.0 112.067 178.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . 70.28 103.99 0.06 Allowed 'General case' 0 N--CA 1.463 0.19 0 O-C-N 123.761 0.663 . . . . 0.0 111.035 -178.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.681 ' O ' ' HG2' ' A' ' 982' ' ' ARG . 44.4 m 69.17 -59.7 0.47 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.246 -0.888 . . . . 0.0 113.334 178.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.484 ' HG1' ' HA ' ' A' 1043 ' ' ARG . 1.9 m -52.75 -29.25 26.06 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 -171.21 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.711 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 19.2 p80 -50.2 -32.04 15.38 Favored 'General case' 0 C--O 1.214 -0.782 0 C-N-CA 121.135 -0.226 . . . . 0.0 111.54 174.39 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . 0.681 ' HG2' ' O ' ' A' ' 979' ' ' SER . 9.4 ptm180 -82.81 -20.51 35.58 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 121.147 -0.221 . . . . 0.0 111.069 -173.683 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.01 -34.47 57.41 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 169.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 1.0 HG21 HG13 ' A' ' 969' ' ' VAL . 69.0 mt -70.05 -32.82 52.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 114.913 -1.039 . . . . 0.0 109.441 177.339 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . 0.711 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 42.0 mt-10 -66.01 -51.62 56.68 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.312 177.477 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 18.2 mmt -71.58 -41.73 68.64 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.909 -172.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.984 ' HB3' ' HB2' ' A' 1035 ' ' LEU . . . -75.56 -51.54 12.67 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.357 -0.838 . . . . 0.0 113.25 -171.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.694 ' O ' ' HB2' ' A' ' 992' ' ' ASN . 2.3 pt20 -62.42 -28.35 69.73 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 119.649 -0.82 . . . . 0.0 109.703 179.046 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . 0.712 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 21.0 tttm -69.48 -40.82 76.84 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.323 -0.853 . . . . 0.0 112.204 170.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.442 ' HB3' ' O ' ' A' ' 987' ' ' ALA . 17.2 tp -50.5 -60.36 3.09 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.47 -0.786 . . . . 0.0 113.032 -176.438 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.712 HD23 HD12 ' A' 1035 ' ' LEU . 1.5 pt? -76.55 -20.42 56.88 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-O 121.508 0.671 . . . . 0.0 109.826 -178.305 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . 0.712 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 50.3 t-20 -50.9 -53.97 28.07 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 114.424 -1.262 . . . . 0.0 110.876 175.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 3.7 m -73.75 -34.75 64.86 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 120.792 -0.363 . . . . 0.0 111.741 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . 0.417 ' O ' ' HB2' ' A' ' 997' ' ' GLU . 0.3 OUTLIER -66.91 -32.93 74.51 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 119.829 -0.748 . . . . 0.0 111.904 178.272 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.64 ' HA ' ' HB3' ' A' ' 998' ' ' LEU . 3.3 tt -69.6 -20.89 63.62 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 122.222 0.209 . . . . 0.0 110.697 170.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -75.76 -26.33 57.31 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 119.671 -0.811 . . . . 0.0 109.665 170.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.602 ' O ' ' HG2' ' A' 1001 ' ' LYS . 56.0 mm-40 -71.33 -46.23 61.09 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 171.43 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.745 HD23 HD11 ' A' 1028 ' ' LEU . 0.0 OUTLIER -55.38 -45.76 76.57 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.713 -177.404 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.569 ' HA ' ' HG2' ' A' 1002 ' ' MET . 85.6 mt -65.08 -37.74 80.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.356 -175.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 26.6 m-80 -61.33 -40.32 93.8 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.176 0.512 . . . . 0.0 111.457 177.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.602 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 51.1 mmtt -76.38 -45.23 32.76 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.942 0.877 . . . . 0.0 108.998 -171.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.774 ' HB2' ' HB3' ' A' ' 951' ' ' TYR . 14.5 ptp -62.25 -30.5 71.16 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.88 -1.054 . . . . 0.0 109.026 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.56 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 6.0 tptm -64.55 -53.02 54.41 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.35 -167.376 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.709 ' HB3' HD12 ' A' 1013 ' ' LEU . 7.2 mp -75.34 -13.82 60.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.876 -178.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1005 ' ' ALA . . . . . 0.62 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -67.95 -43.7 78.48 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.099 -178.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.936 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -77.13 -23.82 51.71 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.349 -0.541 . . . . 0.0 111.485 174.373 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A 1007 ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -52.89 -47.72 67.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.361 0.601 . . . . 0.0 110.638 174.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.626 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 74.6 m-85 -121.5 38.72 4.02 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.988 174.519 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 1.044 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 11.9 p -48.61 -23.07 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.665 173.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 1.4 mpt? -37.38 -49.92 1.02 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.108 0.88 . . . . 0.0 111.328 173.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 71.4 m -163.56 -77.95 0.04 OUTLIER 'General case' 0 C--O 1.243 0.744 0 CA-C-O 121.125 0.488 . . . . 0.0 111.92 175.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1012 ' ' SER . . . . . 0.454 ' O ' ' HG2' ' A' 1015 ' ' GLN . 6.3 m -50.55 -76.43 0.02 OUTLIER 'General case' 0 C--O 1.241 0.624 0 CA-C-N 115.278 -0.874 . . . . 0.0 113.297 -166.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.709 HD12 ' HB3' ' A' 1004 ' ' LEU . 2.8 mt -46.91 -42.57 17.84 Favored 'General case' 0 CA--C 1.501 -0.917 0 N-CA-C 113.569 0.951 . . . . 0.0 113.569 -178.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 1.044 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -55.68 -43.85 76.78 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.905 -166.907 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A 1015 ' ' GLN . . . . . 0.454 ' HG2' ' O ' ' A' 1012 ' ' SER . 24.3 pt20 -75.73 -40.79 54.99 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.814 -175.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -69.97 -53.63 16.93 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.487 0.66 . . . . 0.0 110.54 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.685 ' CE2' HD21 ' A' 1013 ' ' LEU . 7.8 m-85 -63.86 -35.77 81.73 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.865 -1.061 . . . . 0.0 113.263 -173.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.819 ' HG2' HD11 ' A' ' 943' ' ' ILE . 21.4 tptm -80.63 -28.0 37.08 Favored 'General case' 0 N--CA 1.458 -0.066 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.292 -177.424 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1019 ' ' LYS . . . . . 0.412 ' O ' HD22 ' A' 1022 ' ' LEU . 11.9 mptt -73.38 -51.55 16.95 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 175.585 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -50.79 -34.99 29.7 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.265 163.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.587 ' HG3' ' HB3' ' A' 1002 ' ' MET . 1.7 tmt? -65.34 -50.72 64.53 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 110.28 -0.266 . . . . 0.0 110.28 175.551 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1022 ' ' LEU . . . . . 0.66 ' HA ' ' HB1' ' A' 1025 ' ' ALA . 0.0 OUTLIER -77.5 -6.58 54.09 Favored 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 119.328 -0.949 . . . . 0.0 109.788 -175.712 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 86.5 m -80.05 -44.44 20.08 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 173.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.487 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.29 -20.76 50.9 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-O 121.309 0.576 . . . . 0.0 109.543 175.281 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.775 ' HB2' HG21 ' A' ' 936' ' ' VAL . . . -84.17 -25.19 29.76 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.17 170.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.578 ' O ' HG21 ' A' 1030 ' ' VAL . 16.1 t-80 -76.05 -26.47 56.6 Favored 'General case' 0 C--O 1.215 -0.737 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 165.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1027 ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -66.03 -43.34 87.84 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 122.962 0.505 . . . . 0.0 110.297 162.274 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.745 HD11 HD23 ' A' ' 998' ' ' LEU . 17.0 mt -59.37 -46.1 89.6 Favored 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 120.399 -0.52 . . . . 0.0 109.615 171.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1029 ' ' ALA . . . . . 0.611 ' O ' ' HB2' ' A' 1033 ' ' LYS . . . -57.45 -40.18 77.89 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.128 173.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.578 HG21 ' O ' ' A' 1026 ' ' HIS . 12.2 t -69.77 -51.45 40.71 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 CA-C-O 121.407 0.622 . . . . 0.0 110.644 -177.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.432 ' O ' ' HB3' ' A' 1035 ' ' LEU . 71.4 m-20 -75.11 -30.82 60.97 Favored 'General case' 0 C--O 1.221 -0.444 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.535 -173.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.815 ' HA ' HD23 ' A' 1035 ' ' LEU . . . -72.99 -35.46 66.87 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.841 0.353 . . . . 0.0 110.129 173.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.611 ' HB2' ' O ' ' A' 1029 ' ' ALA . 53.2 tttt -63.68 -46.24 86.44 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.944 0.878 . . . . 0.0 108.988 172.484 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.429 ' O ' HG22 ' A' 1038 ' ' VAL . 12.6 t30 -68.93 -51.84 35.58 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 113.996 -1.456 . . . . 0.0 112.485 -177.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.984 ' HB2' ' HB3' ' A' ' 987' ' ' ALA . 0.2 OUTLIER -59.24 -40.85 87.23 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 117.782 0.265 . . . . 0.0 111.139 -171.713 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.544 ' H ' HD21 ' A' 1035 ' ' LEU . 1.5 tm? -68.13 -47.56 67.79 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 118.574 -1.251 . . . . 0.0 109.289 -178.04 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 14.8 t70 -47.16 -45.92 23.1 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.363 171.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.447 ' HB ' ' O ' ' A' 1035 ' ' LEU . 22.4 t -56.18 -42.52 73.41 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.633 0 CA-C-N 113.912 -1.495 . . . . 0.0 112.818 177.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.554 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 1.6 mp -81.26 -31.77 11.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 119.304 0.956 . . . . 0.0 111.288 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.578 ' C ' ' HB ' ' A' ' 919' ' ' ILE . 3.0 m-20 -59.38 -41.25 88.92 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 167.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -71.94 -37.57 69.97 Favored 'General case' 0 C--O 1.215 -0.737 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.578 173.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.554 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -53.29 -55.56 23.63 Favored 'General case' 0 CA--C 1.499 -0.988 0 C-N-CA 123.468 0.707 . . . . 0.0 111.566 -179.241 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.484 ' HA ' ' HG1' ' A' ' 980' ' ' THR . 0.0 OUTLIER -63.45 -37.36 86.98 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.34 -175.56 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.403 ' H ' ' HG3' ' A' 1043 ' ' ARG . 2.8 tm? -66.83 -48.89 67.51 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.164 178.03 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1045 ' ' LYS . . . . . . . . . . . . . 45.8 mtpt -57.11 -44.51 83.3 Favored 'General case' 0 C--O 1.213 -0.836 0 C-N-CA 124.072 0.949 . . . . 0.0 112.838 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.461 ' HG3' ' O ' ' A' 1043 ' ' ARG . 1.5 ptm -64.39 -26.37 68.43 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 119.142 -1.023 . . . . 0.0 111.638 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 51.5 mm -84.93 -52.03 12.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.793 0.33 . . . . 0.0 110.898 174.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 23.2 t -63.87 -42.06 97.61 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.553 -177.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 11.8 mm-40 -97.48 160.86 14.07 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.966 -171.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -123.43 -12.42 7.76 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.71 175.393 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1051 ' ' ARG . . . . . 0.67 ' H ' ' HD2' ' A' 1052 ' ' PRO . 38.7 mtm180 -131.26 -54.7 0.03 OUTLIER Pre-proline 0 CA--C 1.536 0.42 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1052 ' ' PRO . . . . . 0.67 ' HD2' ' H ' ' A' 1051 ' ' ARG . 50.4 Cg_endo -69.71 45.99 0.47 Allowed 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 122.955 2.437 . . . . 0.0 114.614 -178.228 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.324 -0.538 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 170.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.792 0 N-CA-C 112.033 -0.427 . . . . 0.0 112.033 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 30.4 t -66.96 -51.24 38.49 Favored Pre-proline 0 CA--C 1.536 0.41 0 CA-C-O 119.672 -0.204 . . . . 0.0 110.858 179.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -69.05 69.9 1.23 Allowed 'Trans proline' 0 C--N 1.359 1.098 0 C-N-CA 121.781 1.654 . . . . 0.0 111.066 171.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . 179.09 -20.14 0.04 OUTLIER Glycine 0 N--CA 1.447 -0.58 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -176.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 61.9 mt -101.47 102.68 13.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 172.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 11.3 m -112.3 130.79 55.83 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.086 -174.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . -100.79 65.19 0.54 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 121.069 -0.586 . . . . 0.0 111.897 177.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 75.5 -147.55 35.83 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.97 -0.633 . . . . 0.0 112.151 -178.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 916' ' ' GLY . . . . . 0.453 ' HA2' HD13 ' A' ' 919' ' ' ILE . . . -78.12 93.53 1.2 Allowed Glycine 0 N--CA 1.445 -0.722 0 C-N-CA 120.978 -0.63 . . . . 0.0 111.798 178.086 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . -63.78 -69.53 1.3 Allowed Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 121.051 -0.595 . . . . 0.0 112.833 -177.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -131.85 31.86 2.99 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.343 -0.932 . . . . 0.0 113.182 -177.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 919' ' ' ILE . . . . . 0.849 HG13 ' HA ' ' A' 1041 ' ' GLN . 2.4 mp -59.95 81.98 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 C-N-CA 123.042 0.537 . . . . 0.0 110.438 174.467 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.49 ' HB2' ' O ' ' A' ' 919' ' ' ILE . 15.0 tpp180 175.54 102.6 0.01 OUTLIER 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.455 170.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 49.4 m -137.97 116.46 12.04 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 168.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -58.1 161.67 3.96 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.825 0.822 . . . . 0.0 111.569 -167.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.682 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 10.9 t70 -174.48 136.01 0.44 Allowed 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 114.322 -1.308 . . . . 0.0 113.83 -165.386 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.596 ' HD2' ' N ' ' A' ' 924' ' ' LYS . 0.0 OUTLIER -49.83 -14.33 0.13 Allowed 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.127 -0.942 . . . . 0.0 113.398 177.076 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.789 ' HA ' ' ND2' ' A' ' 928' ' ' ASN . 4.2 p -59.84 -34.53 56.18 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 CA-C-N 119.708 1.14 . . . . 0.0 110.942 167.019 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.682 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 2.4 p90 -77.23 -28.13 53.6 Favored 'General case' 0 CA--C 1.506 -0.737 0 O-C-N 121.601 -0.687 . . . . 0.0 109.394 174.458 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.85 -24.88 48.45 Favored 'General case' 0 C--N 1.307 -1.282 0 C-N-CA 118.698 -1.201 . . . . 0.0 113.962 178.243 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.789 ' ND2' ' HA ' ' A' ' 925' ' ' VAL . 13.0 p30 -72.21 -27.66 62.69 Favored 'General case' 0 C--N 1.317 -0.807 0 C-N-CA 118.661 -1.216 . . . . 0.0 108.992 166.06 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.778 HG22 ' HB1' ' A' 1032 ' ' ALA . 71.6 t -76.61 -30.7 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.137 179.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 930' ' ' THR . . . . . . . . . . . . . 26.8 m -61.2 -42.9 99.4 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 172.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -67.12 -52.72 30.38 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-N 114.61 -1.177 . . . . 0.0 113.808 176.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.657 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.4 pp -64.67 -49.47 70.85 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -174.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.525 ' O ' ' HB ' ' A' ' 936' ' ' VAL . 54.3 t -64.2 -37.84 80.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-O 121.311 0.576 . . . . 0.0 110.663 -176.146 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . . . . . . . . . 19.2 ttpp -59.87 -51.42 69.8 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.08 178.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -51.81 -39.69 59.17 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 111.672 0.249 . . . . 0.0 111.672 178.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.899 HG21 ' HB1' ' A' 1025 ' ' ALA . 92.0 t -46.73 -76.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 O-C-N 123.747 0.654 . . . . 0.0 111.852 177.256 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.434 HG13 ' N ' ' A' ' 938' ' ' GLU . 26.9 pt -68.66 -40.7 82.05 Favored 'Isoleucine or valine' 0 C--O 1.244 0.788 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -176.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.628 ' O ' ' HD3' ' A' ' 942' ' ' LYS . 30.8 tt0 -61.47 -52.86 62.77 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.117 -171.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.494 ' HA ' HG12 ' A' ' 943' ' ' ILE . 85.7 mtp -76.23 -26.93 56.55 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 119.782 -0.767 . . . . 0.0 110.721 -178.226 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.614 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 28.5 t -52.95 -45.75 67.85 Favored 'General case' 0 CA--C 1.52 -0.21 0 O-C-N 123.925 0.766 . . . . 0.0 112.502 -170.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 8.3 t -121.37 -18.31 7.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.191 -0.913 . . . . 0.0 112.24 -170.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.628 ' HD3' ' O ' ' A' ' 938' ' ' GLU . 0.5 OUTLIER -84.05 -44.95 13.58 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 118.793 -1.163 . . . . 0.0 110.376 -179.904 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.494 HG12 ' HA ' ' A' ' 939' ' ' MET . 26.0 mm -74.26 -21.31 17.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.255 179.703 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.483 ' HB3' ' HD3' ' A' ' 945' ' ' PRO . 20.1 tt0 -60.9 -47.75 94.71 Favored Pre-proline 0 CA--C 1.544 0.743 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 -173.214 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.483 ' HD3' ' HB3' ' A' ' 944' ' ' GLN . 18.2 Cg_exo -69.63 57.23 1.4 Allowed 'Trans proline' 0 C--N 1.358 1.028 0 C-N-CA 122.65 2.233 . . . . 0.0 113.028 179.026 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.621 ' HB2' ' HD2' ' A' ' 947' ' ' PRO . . . -169.99 -176.4 0.4 Allowed Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 -178.498 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.621 ' HD2' ' HB2' ' A' ' 946' ' ' ALA . 87.3 Cg_exo -50.66 161.16 1.4 Allowed 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 121.817 1.678 . . . . 0.0 111.287 168.114 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.584 ' HA ' HG22 ' A' 1009 ' ' VAL . 4.3 Cg_exo -34.73 131.14 0.2 Allowed 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 124.11 3.206 . . . . 0.0 113.677 -174.16 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 0.73 ' H ' ' HE1' ' A' ' 951' ' ' TYR . 29.6 mt-10 -66.67 29.03 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 114.815 -1.084 . . . . 0.0 112.782 -176.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.663 ' HB2' ' HG2' ' A' ' 953' ' ' PRO . 9.3 pt-20 33.53 66.15 0.24 Allowed 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 122.108 0.956 . . . . 0.0 110.559 -169.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.859 ' CD1' ' HB3' ' A' 1006 ' ' GLN . 0.8 OUTLIER -63.94 -49.02 74.22 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.238 -1.346 . . . . 0.0 110.509 -169.411 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 0.77 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 26.6 t -59.5 -54.13 59.04 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.963 174.16 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 0.77 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 34.7 Cg_exo -49.01 -41.51 40.03 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 122.059 1.839 . . . . 0.0 112.628 171.535 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 954' ' ' MET . . . . . . . . . . . . . 27.0 ttt -64.36 -38.25 90.38 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.376 175.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.729 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 35.1 t -52.25 -47.44 45.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.378 169.397 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -64.21 -29.89 70.98 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.27 177.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -78.26 -46.07 21.23 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 121.151 0.5 . . . . 0.0 111.012 -174.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . . . . . . . . . 14.8 p -81.66 -26.48 9.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.482 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -67.05 -34.49 86.9 Favored Glycine 0 N--CA 1.447 -0.59 0 N-CA-C 110.493 -1.043 . . . . 0.0 110.493 171.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . 0.545 HD12 ' HD2' ' A' ' 963' ' ' ARG . 20.2 tp -63.88 -30.39 71.48 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.288 -0.456 . . . . 0.0 110.213 175.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.572 ' HB3' ' HB3' ' A' ' 932' ' ' LEU . . . -76.41 -56.86 4.25 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.105 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.583 ' O ' ' HB3' ' A' ' 965' ' ' LEU . 0.2 OUTLIER -44.07 -47.35 8.85 Favored 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 169.22 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.545 ' HD2' HD12 ' A' ' 960' ' ' LEU . 9.5 ptp180 -69.79 -27.18 64.68 Favored 'General case' 0 C--N 1.32 -0.699 0 O-C-N 120.848 -1.158 . . . . 0.0 110.831 179.159 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 964' ' ' THR . . . . . 0.459 HG21 ' HB3' ' A' ' 928' ' ' ASN . 93.0 m -68.94 -32.78 72.63 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 171.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.723 HD22 HD23 ' A' ' 991' ' ' LEU . 0.2 OUTLIER -65.44 -41.87 92.99 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.073 172.721 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.518 ' HG ' HE21 ' A' ' 988' ' ' GLN . 5.1 tt -69.98 -42.91 72.48 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.415 -0.811 . . . . 0.0 108.95 -174.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -66.99 -44.07 81.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.258 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.564 HG23 ' HB2' ' A' ' 924' ' ' LYS . 19.4 p -62.38 -48.48 79.57 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.77 0.319 . . . . 0.0 111.224 179.455 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 1.004 HG13 HG23 ' A' ' 984' ' ' ILE . 45.7 t -72.68 -31.43 37.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.81 178.393 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.814 ' HB2' HE22 ' A' ' 988' ' ' GLN . 15.1 t70 -69.96 -40.87 75.16 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 178.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.565 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 31.2 tt0 -64.79 -34.23 77.87 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 114.013 -1.449 . . . . 0.0 109.258 178.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.504 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 61.6 m -71.36 -18.81 62.35 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.324 178.058 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.732 ' HB2' HG21 ' A' ' 984' ' ' ILE . 9.7 tt -65.27 -49.78 63.08 Favored Pre-proline 0 CA--C 1.532 0.254 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.482 -176.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.692 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 4.9 Cg_exo -81.84 -9.68 11.93 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 121.659 1.573 . . . . 0.0 113.058 171.16 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.544 HG22 ' O ' ' A' ' 971' ' ' GLU . 25.4 t -66.47 -51.03 62.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 171.593 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.543 ' O ' ' HB ' ' A' ' 980' ' ' THR . 20.3 tp -128.75 90.05 47.29 Favored Pre-proline 0 N--CA 1.45 -0.465 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 173.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . 0.434 ' HB2' ' H ' ' A' ' 978' ' ' ALA . 95.1 Cg_endo -87.49 -154.96 0.05 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.995 2.464 . . . . 0.0 114.104 -169.79 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . 0.434 ' H ' ' HB2' ' A' ' 977' ' ' PRO . . . 68.04 -93.68 0.03 OUTLIER 'General case' 0 C--O 1.231 0.124 0 CA-C-N 114.896 -1.047 . . . . 0.0 111.815 178.524 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.512 ' O ' ' HE2' ' A' 1046 ' ' MET . 19.7 m -99.45 -34.72 10.16 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.606 -173.799 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.543 ' HB ' ' O ' ' A' ' 976' ' ' LEU . 54.6 m -62.58 -18.92 63.12 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 121.936 0.874 . . . . 0.0 109.366 175.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.623 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 2.8 t60 -56.9 -35.09 68.58 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 114.187 -1.37 . . . . 0.0 111.427 178.486 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . 0.482 ' HG2' ' O ' ' A' ' 979' ' ' SER . 6.0 ptp180 -84.54 -19.46 33.15 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -174.058 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.601 ' HG3' HG11 ' A' 1038 ' ' VAL . 0.4 OUTLIER -75.55 -33.98 60.71 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 121.903 0.859 . . . . 0.0 108.785 171.542 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 1.004 HG23 HG13 ' A' ' 969' ' ' VAL . 62.1 mt -72.95 -29.24 28.57 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.893 0 CA-C-N 114.219 -1.355 . . . . 0.0 109.596 177.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . 0.623 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 57.6 mt-10 -63.27 -47.87 80.55 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.512 0.672 . . . . 0.0 109.844 172.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 986' ' ' MET . . . . . 0.483 ' HG2' HD12 ' A' ' 990' ' ' LEU . 54.0 ttm -71.64 -47.38 54.79 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.88 -172.39 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.822 ' HA ' ' HG ' ' A' 1035 ' ' LEU . . . -61.1 -50.61 72.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.785 -175.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.814 HE22 ' HB2' ' A' ' 970' ' ' ASP . 53.4 mt-30 -56.99 -30.67 64.34 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.0 0.429 . . . . 0.0 110.696 177.056 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . 0.738 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 1.9 ttmt -79.09 -40.33 31.44 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 -178.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.483 HD12 ' HG2' ' A' ' 986' ' ' MET . 3.1 mp -60.33 -54.05 50.29 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 119.552 -0.859 . . . . 0.0 112.867 -178.119 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.723 HD23 HD22 ' A' ' 965' ' ' LEU . 11.7 tp -65.64 -26.44 67.81 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.061 -0.656 . . . . 0.0 109.401 177.225 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . 0.738 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 23.8 t-20 -52.97 -57.74 9.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.632 178.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 13.4 m -80.42 -36.3 33.91 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -175.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.43 -36.7 84.71 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 119.386 -0.926 . . . . 0.0 111.268 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.682 ' N ' HD23 ' A' 1028 ' ' LEU . 2.3 tm? -68.16 -24.79 65.02 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.308 171.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -71.61 -28.7 63.98 Favored 'General case' 0 C--N 1.316 -0.86 0 C-N-CA 119.283 -0.967 . . . . 0.0 109.978 170.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -76.26 -37.66 57.3 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 110.415 -0.217 . . . . 0.0 110.415 173.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.845 HD13 ' HB2' ' A' 1025 ' ' ALA . 1.1 tt -56.6 -46.77 80.68 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.293 0.568 . . . . 0.0 110.855 178.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.485 ' N ' HD22 ' A' ' 998' ' ' LEU . 84.7 mt -65.95 -46.76 87.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.722 -172.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -56.38 -40.28 74.32 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.333 0.587 . . . . 0.0 111.552 -177.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.669 ' HD3' ' HG2' ' A' 1020 ' ' GLN . 96.8 mttt -84.88 -33.92 22.7 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.79 -173.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.668 ' SD ' ' HE3' ' A' 1018 ' ' LYS . 5.3 ttp -62.4 -30.31 71.12 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 122.351 1.072 . . . . 0.0 108.574 173.267 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.502 ' O ' ' HG3' ' A' 1006 ' ' GLN . 3.8 tptm -67.38 -53.03 32.94 Favored 'General case' 0 N--CA 1.439 -0.975 0 CA-C-N 113.777 -1.556 . . . . 0.0 110.491 -171.001 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.696 ' HB3' HD21 ' A' 1013 ' ' LEU . 8.4 mp -69.95 -16.65 63.24 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.815 -179.356 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1005 ' ' ALA . . . . . 0.699 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -70.98 -39.45 72.47 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 119.344 -0.942 . . . . 0.0 110.219 -178.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.879 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.4 pp0? -74.75 -32.95 62.23 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 120.384 -0.526 . . . . 0.0 111.328 167.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.652 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 28.5 mt-30 -50.92 -44.51 60.13 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.258 0.551 . . . . 0.0 110.379 176.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.706 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 49.7 m-85 -122.2 41.1 3.49 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.561 172.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 1.036 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 14.9 p -50.52 -21.18 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.646 171.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1010 ' ' MET . . . . . 0.488 ' O ' HG23 ' A' 1011 ' ' THR . 97.0 mmm -38.7 -50.32 1.63 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.33 -1.304 . . . . 0.0 111.381 172.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1011 ' ' THR . . . . . 0.488 HG23 ' O ' ' A' 1010 ' ' MET . 0.7 OUTLIER -163.68 -86.15 0.02 OUTLIER 'General case' 0 C--O 1.246 0.897 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 179.369 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 42.5 t -54.02 -67.46 0.26 Allowed 'General case' 0 C--O 1.238 0.474 0 CA-C-N 114.786 -1.097 . . . . 0.0 112.605 -166.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.708 ' HG ' ' CE1' ' A' 1017 ' ' TYR . 6.8 mp -50.09 -42.39 50.13 Favored 'General case' 0 CA--C 1.5 -0.967 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 -179.189 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 1.036 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -53.47 -48.53 68.79 Favored 'General case' 0 N--CA 1.442 -0.827 0 O-C-N 123.65 0.594 . . . . 0.0 111.222 -166.866 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 27.0 pt20 -74.45 -45.56 45.49 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.262 -176.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -66.53 -53.14 38.16 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.495 0.664 . . . . 0.0 110.751 -178.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.708 ' CE1' ' HG ' ' A' 1013 ' ' LEU . 15.9 m-85 -62.93 -37.63 87.8 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 114.628 -1.169 . . . . 0.0 113.37 -174.555 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.89 ' HE2' ' HE1' ' A' 1021 ' ' MET . 17.3 tptm -81.54 -29.1 33.62 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.988 -177.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -74.27 -51.74 14.41 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 174.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1020 ' ' GLN . . . . . 0.669 ' HG2' ' HD3' ' A' 1001 ' ' LYS . 10.5 tt0 -51.02 -34.47 29.62 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.07 163.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.89 ' HE1' ' HE2' ' A' 1018 ' ' LYS . 9.9 tmm? -62.87 -50.55 70.47 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 174.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1022 ' ' LEU . . . . . 0.83 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -80.11 -2.83 46.21 Favored 'General case' 0 C--O 1.221 -0.445 0 C-N-CA 119.276 -0.97 . . . . 0.0 109.858 -176.811 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 88.5 m -84.57 -39.56 18.59 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 171.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.511 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.21 -21.16 50.44 Favored 'General case' 0 C--O 1.22 -0.486 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 172.139 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.899 ' HB1' HG21 ' A' ' 936' ' ' VAL . . . -85.03 -25.11 27.86 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.137 170.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.57 ' O ' HG22 ' A' 1030 ' ' VAL . 61.0 t60 -75.78 -23.91 55.95 Favored 'General case' 0 C--O 1.217 -0.61 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 164.365 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1027 ' ' ALA . . . . . 0.483 ' HB1' ' O ' ' A' 1024 ' ' ALA . . . -71.01 -39.98 72.09 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 123.057 0.543 . . . . 0.0 109.8 164.118 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.682 HD23 ' N ' ' A' ' 995' ' ' LEU . 15.0 mt -62.47 -44.7 95.77 Favored 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.104 170.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -60.01 -36.43 77.19 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 111.286 0.106 . . . . 0.0 111.286 173.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.57 HG22 ' O ' ' A' 1026 ' ' HIS . 8.8 t -70.35 -50.81 43.4 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 CA-C-O 121.506 0.67 . . . . 0.0 109.795 -179.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1031 ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -71.16 -42.35 69.23 Favored 'General case' 0 C--O 1.208 -1.101 0 CA-C-N 114.784 -1.098 . . . . 0.0 111.483 -175.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.778 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -66.8 -32.64 74.06 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.668 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 65.4 tttp -64.37 -49.82 70.12 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.747 0.784 . . . . 0.0 110.116 170.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.466 ' O ' HG22 ' A' 1038 ' ' VAL . 59.9 t30 -72.28 -38.74 68.72 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 114.826 -1.079 . . . . 0.0 112.018 -173.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.822 ' HG ' ' HA ' ' A' ' 987' ' ' ALA . 0.0 OUTLIER -64.83 -40.5 95.29 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 119.215 -0.421 . . . . 0.0 110.817 -177.498 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.566 ' HB3' HG22 ' A' ' 925' ' ' VAL . 4.2 pp -67.8 -39.57 84.0 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 117.232 -1.787 . . . . 0.0 110.177 174.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.08 -39.26 59.47 Favored 'General case' 0 C--N 1.344 0.328 0 CA-C-O 121.725 0.774 . . . . 0.0 110.207 172.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.601 HG11 ' HG3' ' A' ' 983' ' ' GLU . 12.3 t -57.91 -46.35 87.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 114.321 -1.309 . . . . 0.0 111.841 176.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.582 ' HA ' ' HB1' ' A' 1042 ' ' ALA . 2.4 mp -73.91 -27.62 22.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 118.329 0.513 . . . . 0.0 111.484 174.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -64.45 -46.96 80.87 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.332 170.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.849 ' HA ' HG13 ' A' ' 919' ' ' ILE . 45.7 mt-30 -60.47 -46.09 91.34 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 172.253 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.582 ' HB1' ' HA ' ' A' 1039 ' ' ILE . . . -55.49 -51.4 67.09 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.58 -175.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.511 ' HG2' ' O ' ' A' 1039 ' ' ILE . 4.8 ptp85 -62.07 -34.73 76.82 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.034 -173.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 12.9 mt -83.47 -42.21 17.16 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 119.201 -1.0 . . . . 0.0 111.635 174.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.434 ' O ' ' HB2' ' A' 1049 ' ' GLN . 24.9 ttpp -55.13 -34.62 63.89 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.218 0.532 . . . . 0.0 111.294 -177.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.618 ' O ' ' HB3' ' A' 1050 ' ' SER . 18.2 mmt -86.57 -39.11 16.49 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 177.199 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.715 HG22 ' HA ' ' A' 1053 ' ' HIS . 3.7 mm -96.0 -46.8 13.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 O-C-N 121.77 -0.581 . . . . 0.0 111.603 -174.213 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 56.4 m -63.36 -6.71 5.07 Favored 'General case' 0 C--N 1.316 -0.851 0 O-C-N 121.202 -0.936 . . . . 0.0 111.626 177.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1049 ' ' GLN . . . . . 0.607 ' HA ' HE21 ' A' 1049 ' ' GLN . 0.1 OUTLIER -128.54 -70.39 0.68 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.256 -0.429 . . . . 0.0 112.056 -169.296 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A 1050 ' ' SER . . . . . 0.618 ' HB3' ' O ' ' A' 1046 ' ' MET . 36.0 t -58.55 -61.86 2.28 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.871 0.367 . . . . 0.0 111.024 -179.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1051 ' ' ARG . . . . . 0.42 ' HA ' ' HD2' ' A' 1052 ' ' PRO . 78.5 mtp180 -132.83 104.83 12.81 Favored Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 178.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1052 ' ' PRO . . . . . 0.42 ' HD2' ' HA ' ' A' 1051 ' ' ARG . 26.7 Cg_exo -21.3 130.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.855 1 C-N-CA 126.439 4.76 . . . . 0.0 116.818 -172.374 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A 1053 ' ' HIS . . . . . 0.715 ' HA ' HG22 ' A' 1047 ' ' ILE . 54.0 t-80 . . . . . 0 C--N 1.337 0.047 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.441 -179.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.767 0 N-CA-C 112.303 -0.319 . . . . 0.0 112.303 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 15.9 t -87.09 139.53 32.47 Favored Pre-proline 0 C--N 1.323 -0.566 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 178.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.44 163.28 39.38 Favored 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 122.429 2.086 . . . . 0.0 112.063 178.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -90.46 95.36 2.08 Favored Glycine 0 N--CA 1.444 -0.774 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 177.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 912' ' ' ILE . . . . . 0.696 HG13 ' H ' ' A' ' 913' ' ' SER . 13.6 pt 41.46 -99.46 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 124.046 0.938 . . . . 0.0 112.726 -175.728 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 913' ' ' SER . . . . . 0.696 ' H ' HG13 ' A' ' 912' ' ' ILE . 14.6 t -123.51 141.35 52.09 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 -178.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 101.29 4.2 53.47 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.267 -178.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 79.46 -72.43 2.53 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 121.136 -0.554 . . . . 0.0 112.5 178.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . -161.84 87.74 0.11 Allowed Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 121.198 -0.525 . . . . 0.0 111.838 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . -89.61 71.02 2.3 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.223 -179.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . 0.512 ' H ' HD12 ' A' 1044 ' ' LEU . . . -61.92 -52.19 51.98 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.811 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 919' ' ' ILE . . . . . 0.454 ' HB ' ' HB3' ' A' 1040 ' ' ASP . 0.0 OUTLIER -65.85 130.1 30.8 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.706 0 CA-C-O 121.269 0.556 . . . . 0.0 110.195 176.629 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . . . . . . . . . 36.6 mmm-85 -115.04 -36.26 4.47 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.729 -169.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 50.3 m 60.69 30.94 20.05 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.637 -174.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -126.12 96.25 4.67 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.518 -1.219 . . . . 0.0 108.377 178.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.573 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 2.6 p30 -166.63 150.02 7.0 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 123.195 1.474 . . . . 0.0 114.344 -168.746 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.847 ' HB3' HG23 ' A' ' 968' ' ' THR . 14.0 tppt? -58.22 -26.98 63.51 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 113.312 -1.767 . . . . 0.0 112.651 170.113 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.584 HG11 HD12 ' A' ' 965' ' ' LEU . 3.6 t -64.29 -43.36 97.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-N 118.79 0.723 . . . . 0.0 111.274 -172.726 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.573 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.2 OUTLIER -78.69 -19.06 53.36 Favored 'General case' 0 CA--C 1.502 -0.89 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.845 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.66 -23.32 53.25 Favored 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 119.64 -0.824 . . . . 0.0 111.147 168.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.439 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 8.2 m120 -74.74 -27.53 60.4 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 168.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.676 HG23 ' HB1' ' A' 1032 ' ' ALA . 60.0 t -77.51 -30.95 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.258 176.224 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 930' ' ' THR . . . . . . . . . . . . . 27.9 m -60.32 -41.36 93.35 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 171.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -68.72 -54.05 17.0 Favored Glycine 0 CA--C 1.526 0.761 0 CA-C-N 114.996 -1.002 . . . . 0.0 113.621 176.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.659 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.2 pp -63.44 -49.33 74.12 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -175.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 63.5 t -65.62 -36.84 78.56 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-O 121.112 0.482 . . . . 0.0 110.883 -175.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.725 ' HB3' ' HZ2' ' A' ' 934' ' ' LYS . 4.3 ttpm? -58.92 -46.58 87.58 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.178 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.403 ' O ' ' HB2' ' A' ' 939' ' ' MET . . . -55.3 -41.63 72.61 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 111.545 0.202 . . . . 0.0 111.545 176.268 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.736 HG22 ' HB1' ' A' 1025 ' ' ALA . 61.9 t -49.21 -75.49 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 123.206 0.603 . . . . 0.0 112.448 -177.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.41 HG13 ' N ' ' A' ' 938' ' ' GLU . 35.4 pt -74.3 -42.03 50.6 Favored 'Isoleucine or valine' 0 C--O 1.245 0.836 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -175.123 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.656 ' HB2' ' O ' ' A' ' 934' ' ' LYS . 25.4 mm-40 -60.86 -51.29 69.94 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.907 0.384 . . . . 0.0 110.529 -174.306 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.638 ' HB3' ' OE1' ' A' ' 950' ' ' GLU . 65.4 mtt -74.16 -26.52 60.35 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.861 -178.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.625 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 53.3 p -52.05 -48.15 64.75 Favored 'General case' 0 CA--C 1.52 -0.202 0 O-C-N 123.705 0.628 . . . . 0.0 111.672 -170.142 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 23.3 t -116.27 -23.07 8.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.606 -173.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.591 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 0.4 OUTLIER -83.63 -46.42 12.37 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 119.787 -0.765 . . . . 0.0 111.304 -173.245 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.588 HG12 ' HA ' ' A' ' 939' ' ' MET . 44.8 mm -70.89 -23.49 23.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . . . . . . . . . 2.8 mm100 -61.73 -35.78 25.17 Favored Pre-proline 0 CA--C 1.544 0.75 0 N-CA-C 115.236 1.569 . . . . 0.0 115.236 -172.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.591 ' HD2' ' O ' ' A' ' 942' ' ' LYS . 76.5 Cg_exo -55.12 -23.18 34.85 Favored 'Trans proline' 0 C--N 1.353 0.784 0 C-N-CA 121.771 1.647 . . . . 0.0 112.905 170.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.734 ' HB2' ' HD2' ' A' ' 947' ' ' PRO . . . -92.79 -178.98 0.95 Allowed Pre-proline 0 C--N 1.326 -0.446 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 178.336 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.734 ' HD2' ' HB2' ' A' ' 946' ' ' ALA . 64.8 Cg_exo -40.85 113.6 0.24 Allowed 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 122.696 2.264 . . . . 0.0 112.549 173.378 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.521 ' HB2' HG21 ' A' 1009 ' ' VAL . 81.8 Cg_endo -83.13 -156.63 0.07 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.646 0 C-N-CA 123.183 2.589 . . . . 0.0 113.922 -170.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 0.875 ' HB3' ' HB2' ' A' 1006 ' ' GLN . 2.3 mt-10 61.47 10.63 3.3 Favored 'General case' 0 CA--C 1.494 -1.191 0 CA-C-N 114.403 -1.271 . . . . 0.0 109.714 -169.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.705 ' O ' ' HB3' ' A' ' 954' ' ' MET . 0.6 OUTLIER -61.41 0.27 0.31 Allowed 'General case' 0 C--O 1.209 -1.06 0 O-C-N 123.815 0.697 . . . . 0.0 111.972 -170.337 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.651 ' CE1' ' HD3' ' A' 1018 ' ' LYS . 0.1 OUTLIER -68.62 -34.91 76.58 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 123.56 0.744 . . . . 0.0 110.031 177.021 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 0.964 HG23 ' HD3' ' A' ' 953' ' ' PRO . 0.9 OUTLIER -82.62 -39.22 0.83 Allowed Pre-proline 0 N--CA 1.453 -0.281 0 CA-C-O 119.219 -0.42 . . . . 0.0 111.415 176.175 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 0.964 ' HD3' HG23 ' A' ' 952' ' ' VAL . 35.8 Cg_exo -49.84 -42.15 45.05 Favored 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 121.417 1.412 . . . . 0.0 110.729 161.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.705 ' HB3' ' O ' ' A' ' 950' ' ' GLU . 2.5 ttm -70.4 -28.96 65.49 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 113.831 -1.531 . . . . 0.0 111.846 177.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.868 HG23 ' HA ' ' A' ' 952' ' ' VAL . 76.0 t -53.39 -40.34 39.91 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 173.037 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.402 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 8.9 tmtt? -68.45 -33.17 73.72 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 114.973 -1.012 . . . . 0.0 111.723 173.601 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . 0.42 ' HG3' ' HE3' ' A' ' 939' ' ' MET . 6.9 mm-40 -78.35 -47.63 17.3 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -176.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.556 HG22 ' HG3' ' A' ' 954' ' ' MET . 2.7 t -84.54 -34.92 9.9 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.011 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 -178.143 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -59.8 -39.53 95.49 Favored Glycine 0 N--CA 1.434 -1.453 0 N-CA-C 110.636 -0.986 . . . . 0.0 110.636 178.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . 0.531 ' O ' ' HG2' ' A' ' 963' ' ' ARG . 9.1 tt -68.13 -36.17 79.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.348 -0.426 . . . . 0.0 110.626 175.276 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -76.25 -60.23 2.42 Favored 'General case' 0 C--N 1.321 -0.65 0 O-C-N 122.093 -0.379 . . . . 0.0 110.952 -174.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 1.079 HD13 HD21 ' A' ' 995' ' ' LEU . 3.4 pp -53.54 -34.13 57.11 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 112.435 0.531 . . . . 0.0 112.435 173.153 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.531 ' HG2' ' O ' ' A' ' 960' ' ' LEU . 3.7 ptm180 -71.83 -39.98 69.39 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 119.949 1.25 . . . . 0.0 111.166 174.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 38.3 m -61.24 -38.82 88.05 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 174.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.664 HD11 HD21 ' A' 1035 ' ' LEU . 0.3 OUTLIER -55.97 -54.72 41.42 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.66 174.738 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.657 ' HG ' HE21 ' A' ' 988' ' ' GLN . 5.2 tt -69.52 -34.68 74.62 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.164 -172.572 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . 0.415 ' O ' ' HB2' ' A' ' 971' ' ' GLU . . . -71.8 -29.16 64.15 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.807 178.108 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.847 HG23 ' HB3' ' A' ' 924' ' ' LYS . 23.7 m -71.99 -32.9 67.68 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 118.824 0.738 . . . . 0.0 109.79 172.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.986 HG12 HG21 ' A' ' 984' ' ' ILE . 24.3 t -70.24 -40.8 78.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.424 171.404 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.957 ' HB2' HE22 ' A' ' 988' ' ' GLN . 16.4 t70 -65.58 -42.1 92.13 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 122.301 1.048 . . . . 0.0 108.864 179.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.53 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 37.6 tt0 -62.16 -37.6 85.85 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 113.54 -1.664 . . . . 0.0 109.867 177.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 63.7 m -67.1 -18.76 65.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.085 176.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.612 ' HG ' ' HB2' ' A' ' 981' ' ' HIS . 9.4 tt -68.69 -51.74 20.56 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.648 -172.601 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.53 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 95.7 Cg_endo -84.37 -7.35 9.91 Favored 'Trans proline' 0 C--N 1.354 0.821 0 CA-C-N 119.883 0.994 . . . . 0.0 112.878 174.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.506 HG22 ' O ' ' A' ' 971' ' ' GLU . 75.3 t -74.96 -42.95 46.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 C-N-CA 120.226 -0.59 . . . . 0.0 109.419 170.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.441 HD22 HG21 ' A' ' 980' ' ' THR . 4.7 mp -115.63 83.93 11.85 Favored Pre-proline 0 C--O 1.233 0.197 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 174.012 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_exo -72.28 -7.08 20.31 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.166 2.578 . . . . 0.0 113.307 -172.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . 0.562 ' HB1' ' SD ' ' A' 1046 ' ' MET . . . -83.94 -159.11 0.36 Allowed 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 110.089 -0.338 . . . . 0.0 110.089 178.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.551 ' O ' ' HG2' ' A' ' 982' ' ' ARG . 18.4 m -37.67 -36.35 0.17 Allowed 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 114.163 1.172 . . . . 0.0 114.163 -177.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.855 ' HA ' ' HB2' ' A' 1042 ' ' ALA . 89.4 m -53.89 -36.36 62.6 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 117.879 0.308 . . . . 0.0 111.703 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.612 ' HB2' ' HG ' ' A' ' 973' ' ' LEU . 0.5 OUTLIER -62.66 -33.81 75.8 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.961 -175.729 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . 0.551 ' HG2' ' O ' ' A' ' 979' ' ' SER . 9.3 ptm180 -85.4 -19.82 30.77 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 121.046 -0.261 . . . . 0.0 111.046 -178.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.67 -34.48 69.75 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 166.256 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.986 HG21 HG12 ' A' ' 969' ' ' VAL . 44.9 mt -69.9 -33.01 53.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.637 176.872 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . 0.526 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 50.5 mt-10 -57.96 -49.81 75.53 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.559 175.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 50.9 ttp -72.83 -42.49 63.74 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 114.9 -1.046 . . . . 0.0 110.755 -175.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.822 ' HB2' ' HB2' ' A' 1035 ' ' LEU . . . -68.21 -50.27 55.25 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 114.898 -1.046 . . . . 0.0 112.279 -172.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.957 HE22 ' HB2' ' A' ' 970' ' ' ASP . 48.7 mt-30 -54.39 -43.73 71.67 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 176.2 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . 0.712 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 0.0 OUTLIER -63.52 -42.15 98.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.046 177.88 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 26.3 tp -51.86 -59.32 4.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.324 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.44 ' HA ' HD23 ' A' ' 991' ' ' LEU . 0.7 OUTLIER -63.43 -35.5 80.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.709 0.766 . . . . 0.0 108.936 178.143 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . 0.712 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 25.5 t-20 -50.37 -55.39 15.86 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 113.82 -1.536 . . . . 0.0 112.749 -176.661 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 5.5 m -77.86 -30.03 50.69 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.31 -0.556 . . . . 0.0 111.99 -178.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . 0.428 ' O ' ' HB3' ' A' ' 997' ' ' GLU . 0.1 OUTLIER -73.75 -33.79 64.46 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 118.877 -1.129 . . . . 0.0 111.667 179.826 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 1.079 HD21 HD13 ' A' ' 962' ' ' LEU . 1.9 pp -68.02 -19.12 64.88 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 169.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -78.21 -23.93 47.31 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 119.414 -0.914 . . . . 0.0 110.133 169.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.428 ' HB3' ' O ' ' A' ' 994' ' ' ASP . 6.9 tp10 -74.23 -43.96 55.04 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.976 -0.749 . . . . 0.0 108.976 171.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.719 HD11 ' HB2' ' A' 1025 ' ' ALA . 7.5 tp -56.91 -48.06 79.09 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.266 -179.371 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.865 ' HA ' ' SD ' ' A' 1002 ' ' MET . 67.5 mt -68.76 -38.08 78.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.828 -171.278 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 25.8 m-80 -62.76 -35.41 79.72 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.63 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.471 ' O ' ' HB3' ' A' 1017 ' ' TYR . 0.7 OUTLIER -85.4 -39.84 17.13 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.293 0.568 . . . . 0.0 110.816 -175.469 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.865 ' SD ' ' HA ' ' A' ' 999' ' ' ILE . 8.2 ptm -62.29 -27.08 68.77 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 122.255 1.026 . . . . 0.0 108.653 177.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.66 ' O ' ' HG3' ' A' 1006 ' ' GLN . 19.9 tptt -73.92 -54.04 8.81 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 114.158 -1.383 . . . . 0.0 110.575 -171.056 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.572 ' HA ' ' HB2' ' A' 1007 ' ' GLN . 6.4 mt -69.54 -12.52 61.72 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.004 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1005 ' ' ALA . . . . . 0.707 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -75.73 -38.7 58.27 Favored 'General case' 0 C--O 1.213 -0.838 0 C-N-CA 119.296 -0.962 . . . . 0.0 108.594 -178.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.954 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 1.3 pp0? -74.33 -36.7 63.66 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.764 -0.375 . . . . 0.0 111.126 170.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.572 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 33.9 mt-30 -49.26 -43.32 42.86 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.034 0.445 . . . . 0.0 111.289 178.599 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.635 ' HB2' ' HG ' ' A' 1013 ' ' LEU . 49.4 m-85 -126.04 44.74 2.78 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.313 0.578 . . . . 0.0 110.839 169.17 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 1.001 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 7.9 p -53.17 -20.21 2.57 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.409 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.63 171.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1010 ' ' MET . . . . . 0.465 ' O ' HG22 ' A' 1011 ' ' THR . 60.2 mtm -48.42 -40.59 26.51 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.162 -1.381 . . . . 0.0 111.915 174.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1011 ' ' THR . . . . . 0.465 HG22 ' O ' ' A' 1010 ' ' MET . 1.0 OUTLIER -160.66 -94.18 0.02 OUTLIER 'General case' 0 C--O 1.248 0.998 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 -179.344 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 4.6 m -59.12 -62.65 1.72 Allowed 'General case' 0 C--O 1.24 0.555 0 CA-C-N 114.517 -1.22 . . . . 0.0 113.121 -162.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.696 HD22 ' HE2' ' A' 1017 ' ' TYR . 14.6 mt -53.57 -37.38 62.86 Favored 'General case' 0 CA--C 1.498 -1.044 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.735 -178.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 1.001 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -53.78 -54.56 36.46 Favored 'General case' 0 N--CA 1.441 -0.919 0 O-C-N 123.867 0.729 . . . . 0.0 110.817 -166.693 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -70.57 -42.45 71.07 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.82 -175.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -67.0 -53.76 28.26 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.555 0.693 . . . . 0.0 111.149 -179.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.707 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 12.0 m-85 -62.56 -34.34 76.77 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 113.823 1.045 . . . . 0.0 113.823 -176.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.651 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 54.1 tptt -79.05 -31.38 44.51 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 114.92 -1.036 . . . . 0.0 110.247 -176.122 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -71.81 -42.51 66.96 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 175.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -56.16 -36.25 68.1 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.539 163.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.552 ' HB3' ' HA ' ' A' 1018 ' ' LYS . 0.0 OUTLIER -66.82 -51.74 52.0 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.377 0.132 . . . . 0.0 110.834 -177.032 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A 1022 ' ' LEU . . . . . 0.402 ' O ' ' HG ' ' A' 1022 ' ' LEU . 0.0 OUTLIER -78.09 -13.48 59.85 Favored 'General case' 0 C--O 1.218 -0.558 0 C-N-CA 119.595 -0.842 . . . . 0.0 109.955 -176.036 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A 1023 ' ' THR . . . . . 0.48 ' HA ' ' HB3' ' A' 1026 ' ' HIS . 87.5 m -88.44 -32.75 18.14 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.671 177.093 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.495 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.28 -23.36 47.24 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 171.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.736 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -86.21 -21.67 27.34 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.255 169.307 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.64 ' O ' HG22 ' A' 1030 ' ' VAL . 84.9 t60 -76.38 -27.07 56.22 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 165.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1027 ' ' ALA . . . . . 0.432 ' HB1' ' O ' ' A' 1024 ' ' ALA . . . -68.98 -41.51 77.78 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 123.806 0.842 . . . . 0.0 109.957 163.19 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.631 ' HB2' ' HA ' ' A' 1025 ' ' ALA . 12.3 mt -61.23 -39.95 92.18 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 119.989 -0.684 . . . . 0.0 109.666 170.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -60.96 -37.34 82.05 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.484 0.183 . . . . 0.0 110.973 171.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.64 HG22 ' O ' ' A' 1026 ' ' HIS . 18.1 t -69.28 -50.45 52.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 121.746 0.784 . . . . 0.0 110.109 -178.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1031 ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -74.18 -32.83 63.25 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-N 114.445 -1.252 . . . . 0.0 111.024 -174.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.875 ' HA ' HD22 ' A' 1035 ' ' LEU . . . -71.39 -32.36 68.35 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 173.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -63.73 -43.89 95.17 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.661 0.743 . . . . 0.0 109.363 171.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.431 ' O ' ' HB3' ' A' 1037 ' ' ASP . 48.3 t30 -79.22 -49.25 12.81 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 114.865 -1.061 . . . . 0.0 112.364 -173.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.875 HD22 ' HA ' ' A' 1032 ' ' ALA . 0.2 OUTLIER -60.33 -39.7 88.01 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 118.012 0.369 . . . . 0.0 110.662 -174.422 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.637 ' H ' HD23 ' A' 1035 ' ' LEU . 2.5 tm? -68.83 -43.19 76.02 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 117.998 -1.481 . . . . 0.0 108.87 178.669 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.431 ' HB3' ' O ' ' A' 1034 ' ' ASN . 27.8 t70 -52.6 -41.76 63.95 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.457 174.49 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.455 ' HB ' ' O ' ' A' 1035 ' ' LEU . 24.6 t -56.41 -41.38 71.71 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.694 0 CA-C-N 114.182 -1.372 . . . . 0.0 111.706 174.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.647 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 1.6 mp -81.16 -28.63 10.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 118.215 0.461 . . . . 0.0 111.282 177.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.454 ' HB3' ' HB ' ' A' ' 919' ' ' ILE . 0.1 OUTLIER -59.23 -48.6 81.01 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 168.889 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -70.76 -33.43 70.78 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.53 175.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.855 ' HB2' ' HA ' ' A' ' 980' ' ' THR . . . -55.37 -50.22 70.27 Favored 'General case' 0 CA--C 1.512 -0.511 0 C-N-CA 123.384 0.673 . . . . 0.0 112.422 178.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.587 ' HG2' ' O ' ' A' 1039 ' ' ILE . 4.0 ptp85 -64.58 -34.87 79.28 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.911 -0.404 . . . . 0.0 109.911 -177.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.512 HD12 ' H ' ' A' ' 918' ' ' GLY . 51.7 tp -72.31 -30.91 65.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.102 0.477 . . . . 0.0 110.61 173.16 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1045 ' ' LYS . . . . . . . . . . . . . 4.5 tmtm? -71.76 -37.92 70.43 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.055 -174.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.562 ' SD ' ' HB1' ' A' ' 978' ' ' ALA . 1.2 ptm -73.09 -30.52 63.73 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.834 172.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.441 HG12 ' O ' ' A' 1043 ' ' ARG . 34.5 mm -73.65 -42.2 55.13 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 118.608 0.64 . . . . 0.0 110.381 179.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 68.9 p -72.38 -5.42 36.27 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.362 178.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1049 ' ' GLN . . . . . 0.449 ' HB3' ' O ' ' A' 1046 ' ' MET . 41.9 tp60 -86.23 -77.37 0.31 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.221 -0.9 . . . . 0.0 111.543 -177.368 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 36.9 p 176.5 -46.62 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.853 -172.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1051 ' ' ARG . . . . . 0.444 ' HA ' ' HD3' ' A' 1052 ' ' PRO . 54.6 ttt180 -85.82 103.09 3.21 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.295 178.36 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1052 ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' 1051 ' ' ARG . 4.1 Cg_exo -79.27 -171.74 1.33 Allowed 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 122.801 2.334 . . . . 0.0 113.486 -169.569 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 51.6 t-80 . . . . . 0 C--N 1.326 -0.424 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.172 -177.662 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.701 0 N-CA-C 111.842 -0.503 . . . . 0.0 111.842 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 909' ' ' SER . . . . . 0.458 ' HA ' ' HD3' ' A' ' 910' ' ' PRO . 34.8 t -95.68 138.64 21.76 Favored Pre-proline 0 C--N 1.321 -0.643 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 179.56 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 910' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' A' ' 909' ' ' SER . 17.2 Cg_exo -67.8 81.03 0.47 Allowed 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.915 2.41 . . . . 0.0 112.284 178.37 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -147.44 26.04 1.53 Allowed Glycine 0 N--CA 1.447 -0.585 0 N-CA-C 111.228 -0.749 . . . . 0.0 111.228 177.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 60.0 mt -92.98 92.1 3.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.208 0.528 . . . . 0.0 110.015 -177.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 6.0 p -91.25 -25.56 19.43 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.031 -179.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 98.58 -0.3 58.1 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.904 -0.665 . . . . 0.0 111.909 -177.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 83.32 -82.91 1.64 Allowed Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 121.098 -0.572 . . . . 0.0 112.152 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . 171.42 -61.0 0.17 Allowed Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 121.1 -0.571 . . . . 0.0 111.866 179.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . -154.37 -155.38 7.22 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.074 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . 0.595 ' CA ' ' HB2' ' A' 1044 ' ' LEU . . . 76.52 136.23 0.68 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 121.276 -0.488 . . . . 0.0 112.868 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 919' ' ' ILE . . . . . 0.44 ' HB ' ' HB3' ' A' 1040 ' ' ASP . 0.1 OUTLIER -79.21 117.05 24.18 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.39 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 171.565 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . . . . . . . . . 81.5 mtt180 -97.24 -11.02 24.67 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.758 -172.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 921' ' ' SER . . . . . 0.455 ' O ' ' HB2' ' A' ' 922' ' ' ASN . 32.3 t 69.24 114.67 0.04 OUTLIER 'General case' 0 CA--C 1.513 -0.445 0 O-C-N 124.034 0.834 . . . . 0.0 109.777 -177.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.653 ' O ' ' HB2' ' A' ' 923' ' ' ASP . 13.9 m120 73.61 -167.55 0.11 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.662 -1.154 . . . . 0.0 109.733 -174.083 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.768 ' HB3' HG21 ' A' ' 925' ' ' VAL . 3.5 t70 145.82 -177.83 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 -167.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.423 ' HA ' ' HD2' ' A' ' 924' ' ' LYS . 0.3 OUTLIER -57.95 -29.47 65.21 Favored 'General case' 0 C--N 1.317 -0.808 0 O-C-N 121.685 -0.634 . . . . 0.0 110.138 174.328 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.768 HG21 ' HB3' ' A' ' 923' ' ' ASP . 20.0 m -60.42 -29.22 43.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.318 0.58 . . . . 0.0 110.744 175.221 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.715 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -73.79 -35.16 64.9 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.004 -0.544 . . . . 0.0 112.205 179.381 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . 0.908 ' HA ' ' HB ' ' A' ' 930' ' ' THR . 12.1 pt-20 -76.26 -22.71 54.79 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 119.566 1.075 . . . . 0.0 110.736 179.388 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.416 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 1.4 m120 -71.81 -30.3 65.35 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 174.306 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.678 HG23 ' HB1' ' A' 1032 ' ' ALA . 75.6 t -80.53 -32.5 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.297 0 CA-C-N 114.593 -1.185 . . . . 0.0 109.556 172.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.908 ' HB ' ' HA ' ' A' ' 927' ' ' GLU . 1.2 m -54.4 -44.72 72.59 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 167.137 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -68.35 -53.2 22.59 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-N 115.006 -0.997 . . . . 0.0 114.008 175.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.641 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.0 pp -64.68 -48.32 75.18 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 117.518 0.659 . . . . 0.0 112.772 -175.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 49.7 t -66.64 -36.69 77.88 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.394 0 CA-C-O 121.04 0.448 . . . . 0.0 110.925 -174.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.404 ' HE2' ' HB3' ' A' ' 934' ' ' LYS . 22.0 ttpt -60.09 -41.98 93.65 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.303 179.046 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -62.46 -32.1 72.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.554 0.216 . . . . 0.0 111.543 176.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.774 HG21 ' HB2' ' A' 1025 ' ' ALA . 98.6 t -58.6 -75.83 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -177.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 27.4 pt -73.35 -39.45 55.38 Favored 'Isoleucine or valine' 0 C--O 1.239 0.516 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -173.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -63.09 -51.9 64.79 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.686 0.755 . . . . 0.0 109.809 -174.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.799 ' HA ' ' HG3' ' A' ' 942' ' ' LYS . 21.6 mmt -73.32 -26.59 61.11 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.877 -177.383 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.658 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 25.7 p -52.74 -41.38 63.94 Favored 'General case' 0 CA--C 1.519 -0.247 0 O-C-N 123.746 0.654 . . . . 0.0 111.458 -173.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 45.0 m -99.43 -20.52 16.42 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.95 -175.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.799 ' HG3' ' HA ' ' A' ' 939' ' ' MET . 0.0 OUTLIER -82.4 -8.22 59.63 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 119.133 -1.027 . . . . 0.0 109.958 -178.996 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.929 HG21 ' HB2' ' A' ' 949' ' ' GLU . 41.0 pt -45.05 -53.15 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 O-C-N 123.515 0.509 . . . . 0.0 111.492 170.013 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.644 ' N ' HG13 ' A' ' 943' ' ' ILE . 27.7 mm-40 67.34 147.66 0.11 Allowed Pre-proline 0 CA--C 1.534 0.363 0 O-C-N 123.727 0.642 . . . . 0.0 111.256 -174.341 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 944' ' ' GLN . 8.1 Cg_exo -73.7 60.59 4.38 Favored 'Trans proline' 0 CA--C 1.531 0.371 0 C-N-CA 122.873 2.382 . . . . 0.0 113.076 -177.152 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.879 ' HB3' ' HD3' ' A' ' 947' ' ' PRO . . . -167.98 -58.17 0.01 OUTLIER Pre-proline 0 CA--C 1.537 0.469 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.523 176.044 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.879 ' HD3' ' HB3' ' A' ' 946' ' ' ALA . 3.5 Cg_exo -79.11 129.74 8.97 Favored 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 122.451 2.101 . . . . 0.0 111.612 174.191 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.423 ' C ' ' H ' ' A' ' 950' ' ' GLU . 95.8 Cg_endo -80.69 26.51 0.59 Allowed 'Trans proline' 0 CA--C 1.515 -0.441 0 C-N-CA 122.794 2.329 . . . . 0.0 113.697 -176.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 0.929 ' HB2' HG21 ' A' ' 943' ' ' ILE . 43.3 tt0 60.71 -13.26 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.438 0 O-C-N 123.775 0.672 . . . . 0.0 112.686 -178.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.772 ' HB3' ' HG2' ' A' ' 953' ' ' PRO . 1.8 mp0 52.15 64.2 1.94 Allowed 'General case' 0 N--CA 1.44 -0.944 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 -154.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.839 ' CE1' ' HD3' ' A' 1018 ' ' LYS . 23.6 m-85 -47.79 -59.41 3.33 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.23 -0.895 . . . . 0.0 111.834 -175.485 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 0.84 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -54.69 -51.78 75.83 Favored Pre-proline 0 CA--C 1.542 0.643 0 CA-C-O 119.077 -0.487 . . . . 0.0 111.877 178.76 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 0.84 ' HD3' HG13 ' A' ' 952' ' ' VAL . 5.7 Cg_exo -46.4 -49.18 12.15 Favored 'Trans proline' 0 C--N 1.354 0.827 0 C-N-CA 122.522 2.148 . . . . 0.0 113.73 169.492 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.802 ' HA ' ' HE1' ' A' ' 954' ' ' MET . 2.3 tpt -58.47 -49.03 78.8 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.546 0.688 . . . . 0.0 110.233 176.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.884 HG23 ' HG2' ' A' 1002 ' ' MET . 56.8 t -53.37 -33.57 21.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 114.56 -1.2 . . . . 0.0 112.414 171.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 5.7 mptp? -63.36 -31.68 72.9 Favored 'General case' 0 C--N 1.315 -0.901 0 C-N-CA 119.737 -0.785 . . . . 0.0 111.149 173.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . 0.424 ' O ' ' HB3' ' A' ' 960' ' ' LEU . 45.0 mm-40 -79.76 -42.76 23.85 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.545 0.212 . . . . 0.0 111.506 176.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' ' 954' ' ' MET . 2.0 t -69.42 -33.46 57.55 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 177.639 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -66.1 -37.4 93.03 Favored Glycine 0 N--CA 1.435 -1.401 0 N-CA-C 110.352 -1.099 . . . . 0.0 110.352 173.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . 0.536 HD12 ' HD3' ' A' ' 963' ' ' ARG . 16.3 tp -62.81 -31.98 73.08 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 115.034 -0.583 . . . . 0.0 110.045 172.538 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.451 ' CB ' ' HB3' ' A' ' 932' ' ' LEU . . . -73.76 -58.54 3.23 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.763 -0.198 . . . . 0.0 110.588 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.522 ' HG ' ' N ' ' A' ' 963' ' ' ARG . 0.1 OUTLIER -39.22 -53.65 1.88 Allowed 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 166.682 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.536 ' HD3' HD12 ' A' ' 960' ' ' LEU . 6.5 ptm180 -67.7 -31.96 72.27 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 119.318 0.963 . . . . 0.0 111.516 -178.111 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 83.5 m -65.96 -35.6 81.04 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 175.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.909 HD22 HD12 ' A' 1035 ' ' LEU . 52.9 tp -70.88 -37.76 73.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.52 -1.218 . . . . 0.0 109.63 176.569 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 9.7 tt -68.21 -40.37 82.12 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 114.628 -1.169 . . . . 0.0 108.36 -175.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -70.63 -37.18 73.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.531 -0.759 . . . . 0.0 112.262 178.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 7.6 p -66.07 -41.42 90.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 118.802 0.728 . . . . 0.0 110.169 176.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.947 HG13 HG22 ' A' ' 984' ' ' ILE . 77.0 t -71.1 -38.58 71.87 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.324 174.619 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.619 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 7.1 t70 -68.01 -41.49 82.16 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.647 0.736 . . . . 0.0 109.045 -178.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.448 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 45.5 tt0 -62.93 -33.37 75.19 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.519 176.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.421 ' HB2' ' O ' ' A' ' 969' ' ' VAL . 62.2 m -67.06 -20.03 65.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.184 176.396 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.7 ' HB2' HG23 ' A' ' 984' ' ' ILE . 9.1 tt -68.64 -53.18 16.88 Favored Pre-proline 0 CA--C 1.534 0.352 0 CA-C-O 119.513 -0.28 . . . . 0.0 110.907 -174.192 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.696 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 4.1 Cg_endo -89.29 -2.69 6.06 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 121.766 1.644 . . . . 0.0 113.143 176.647 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . . . . . . . . . 20.9 t -86.5 -40.44 14.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.616 175.137 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.407 HD11 ' HB3' ' A' 1043 ' ' ARG . 91.1 mt -73.55 125.21 90.76 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.089 0.471 . . . . 0.0 110.544 177.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -81.8 24.11 0.73 Allowed 'Trans proline' 0 C--O 1.233 0.258 0 C-N-CA 123.395 2.73 . . . . 0.0 113.526 -173.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . 0.539 ' HB1' ' HB3' ' A' 1046 ' ' MET . . . -125.19 -176.06 3.47 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.568 -177.401 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.561 ' HB2' ' SD ' ' A' 1046 ' ' MET . 18.1 m -80.61 24.49 0.47 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.118 0.485 . . . . 0.0 111.008 -179.621 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.828 HG23 ' HB2' ' A' 1042 ' ' ALA . 23.7 m -63.61 -9.84 15.61 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.625 -178.025 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.459 ' HA ' ' HG ' ' A' ' 973' ' ' LEU . 7.9 p80 -52.98 -32.62 47.29 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -179.525 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . 0.613 ' HA ' ' HG2' ' A' ' 985' ' ' GLU . 4.4 ptm180 -83.46 -21.57 32.84 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 120.268 -0.573 . . . . 0.0 111.714 -174.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.4 ' HG2' ' HB3' ' A' 1042 ' ' ALA . 0.4 OUTLIER -79.33 -39.88 31.67 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 121.882 0.849 . . . . 0.0 109.232 171.63 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.947 HG22 HG13 ' A' ' 969' ' ' VAL . 75.0 mt -69.02 -33.22 57.75 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 CA-C-N 114.254 -1.339 . . . . 0.0 110.0 -178.334 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . 0.613 ' HG2' ' HA ' ' A' ' 982' ' ' ARG . 12.8 pt-20 -71.2 -43.54 67.17 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 119.553 -0.859 . . . . 0.0 109.525 -179.499 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 54.3 tpp -71.3 -43.52 66.94 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 114.583 -1.189 . . . . 0.0 111.344 -172.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.941 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -74.83 -50.09 18.33 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.879 -1.055 . . . . 0.0 112.687 -170.327 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.587 HE22 ' HB2' ' A' ' 970' ' ' ASP . 3.6 pt20 -60.02 -29.1 68.27 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.972 176.472 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . 0.726 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 20.8 tttm -70.03 -39.64 75.66 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.19 172.479 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.453 ' HB3' ' O ' ' A' ' 987' ' ' ALA . 16.7 tp -50.37 -60.54 2.89 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.412 -0.813 . . . . 0.0 112.651 -179.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.723 HD21 ' HG ' ' A' 1035 ' ' LEU . 1.6 pt? -73.46 -22.25 60.23 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.584 0.707 . . . . 0.0 110.036 -177.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . 0.726 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 48.8 t-20 -51.94 -55.43 20.37 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 114.317 -1.311 . . . . 0.0 110.965 175.363 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 14.6 m -73.16 -31.87 64.51 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.854 -179.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.5 -31.73 68.94 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 119.58 -0.848 . . . . 0.0 112.059 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.586 ' N ' HD22 ' A' 1028 ' ' LEU . 8.3 tt -71.05 -16.65 62.61 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 122.168 -0.333 . . . . 0.0 110.227 171.187 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -76.81 -24.41 52.79 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 119.854 -0.738 . . . . 0.0 109.901 168.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -74.1 -42.93 59.34 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 109.144 -0.688 . . . . 0.0 109.144 171.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.713 HD11 ' HE3' ' A' 1021 ' ' MET . 0.4 OUTLIER -55.69 -43.48 76.47 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.34 -0.846 . . . . 0.0 111.024 -179.597 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.773 HG12 HG12 ' A' ' 955' ' ' VAL . 75.5 mt -64.45 -43.94 96.98 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.957 -177.016 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 29.1 m-80 -63.8 -33.75 76.38 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.321 0.582 . . . . 0.0 111.856 -178.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.964 ' HD3' ' HG2' ' A' 1020 ' ' GLN . 89.7 mttt -82.55 -42.48 18.29 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.539 -174.055 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.884 ' HG2' HG23 ' A' ' 955' ' ' VAL . 0.0 OUTLIER -62.88 -25.48 68.32 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.919 0.866 . . . . 0.0 108.893 176.341 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.61 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 10.4 tptp -71.04 -54.97 9.3 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.432 -168.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.756 ' HB3' HD21 ' A' 1013 ' ' LEU . 80.3 mt -70.69 -14.11 62.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.343 179.242 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1005 ' ' ALA . . . . . 0.716 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -70.5 -50.95 32.46 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 119.704 -0.798 . . . . 0.0 110.002 178.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.674 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.2 pp0? -74.11 -30.4 62.31 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.319 -0.553 . . . . 0.0 112.049 173.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.635 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 12.1 mt-30 -50.78 -45.42 59.11 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.524 0.678 . . . . 0.0 110.175 173.165 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.628 ' CD1' HD23 ' A' 1013 ' ' LEU . 73.3 m-85 -121.93 43.58 2.82 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.267 175.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 1.111 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 7.7 p -51.92 -29.44 11.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-O 121.79 0.805 . . . . 0.0 110.65 173.256 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1010 ' ' MET . . . . . 0.409 ' HG3' ' OG1' ' A' 1011 ' ' THR . 24.1 ptp -69.04 -5.69 23.46 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.003 -0.999 . . . . 0.0 111.897 176.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1011 ' ' THR . . . . . 0.911 HG22 ' H ' ' A' 1012 ' ' SER . 1.2 m -141.55 -168.45 2.66 Favored 'General case' 0 C--O 1.258 1.544 0 CA-C-O 122.952 1.358 . . . . 0.0 113.98 -172.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1012 ' ' SER . . . . . 0.911 ' H ' HG22 ' A' 1011 ' ' THR . 15.5 m -57.72 -32.57 67.53 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 114.2 -1.364 . . . . 0.0 111.899 -175.615 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.756 HD21 ' HB3' ' A' 1004 ' ' LEU . 7.5 mp -49.72 -43.32 47.63 Favored 'General case' 0 CA--C 1.499 -1.006 0 C-N-CA 120.425 -0.51 . . . . 0.0 112.206 172.388 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 1.111 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -56.63 -50.16 72.85 Favored 'General case' 0 N--CA 1.439 -1.016 0 C-N-CA 119.871 -0.731 . . . . 0.0 109.437 -173.533 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 1015 ' ' GLN . . . . . 0.457 ' N ' HE21 ' A' 1014 ' ' GLN . 3.7 pt20 -71.31 -42.15 69.0 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 114.869 -1.059 . . . . 0.0 111.965 -175.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -67.12 -56.31 10.53 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.352 0.596 . . . . 0.0 111.623 179.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.716 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 13.8 m-85 -63.93 -33.1 74.95 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 -173.298 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.839 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 42.2 tptt -79.68 -30.8 41.24 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.453 -178.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1019 ' ' LYS . . . . . 0.499 ' O ' HD21 ' A' 1022 ' ' LEU . 1.1 mptm? -70.68 -51.21 29.19 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 173.152 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1020 ' ' GLN . . . . . 0.964 ' HG2' ' HD3' ' A' 1001 ' ' LYS . 8.0 tt0 -50.69 -33.56 23.24 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.761 -1.109 . . . . 0.0 111.206 165.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.713 ' HE3' HD11 ' A' ' 998' ' ' LEU . 1.9 tmt? -68.32 -46.82 69.21 Favored 'General case' 0 CA--C 1.512 -0.508 0 O-C-N 122.168 -0.333 . . . . 0.0 110.355 176.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1022 ' ' LEU . . . . . 0.637 ' HA ' ' HB1' ' A' 1025 ' ' ALA . 0.0 OUTLIER -80.47 -7.29 59.11 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 118.857 -1.137 . . . . 0.0 109.595 -179.28 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 84.8 m -83.93 -40.4 18.58 Favored 'General case' 0 C--N 1.333 -0.133 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 174.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.553 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -77.27 -21.13 54.13 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 172.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.774 ' HB2' HG21 ' A' ' 936' ' ' VAL . . . -85.09 -23.01 28.69 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.401 169.437 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.564 ' O ' HG21 ' A' 1030 ' ' VAL . 16.3 t60 -76.96 -24.84 52.3 Favored 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 166.26 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1027 ' ' ALA . . . . . 0.422 ' HA ' ' HB ' ' A' 1030 ' ' VAL . . . -73.74 -39.01 64.58 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 123.489 0.716 . . . . 0.0 109.67 165.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.682 ' HB2' ' HA ' ' A' 1025 ' ' ALA . 22.7 mt -60.63 -44.34 96.48 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 168.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -59.99 -38.45 82.62 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 111.445 0.165 . . . . 0.0 111.445 173.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.564 HG21 ' O ' ' A' 1026 ' ' HIS . 7.8 t -69.93 -50.31 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.166 0 CA-C-O 121.488 0.661 . . . . 0.0 110.071 -178.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.447 ' O ' HD13 ' A' 1035 ' ' LEU . 23.8 m-20 -66.63 -38.05 86.11 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 114.687 -1.142 . . . . 0.0 110.496 -178.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.678 ' HB1' HG23 ' A' ' 929' ' ' VAL . . . -59.76 -42.57 93.57 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.349 173.237 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 50.9 mttp -64.03 -53.14 54.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.665 0.745 . . . . 0.0 110.054 173.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.421 ' O ' HG23 ' A' 1038 ' ' VAL . 9.0 t30 -63.18 -52.18 63.4 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.175 -1.375 . . . . 0.0 111.813 -171.207 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.941 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 0.0 OUTLIER -65.31 -38.0 88.85 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 119.307 -0.378 . . . . 0.0 110.825 -173.204 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.732 ' H ' HD11 ' A' 1035 ' ' LEU . 4.0 pp -72.98 -35.1 66.83 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 116.951 -1.899 . . . . 0.0 109.718 -179.326 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.421 ' N ' HD13 ' A' 1036 ' ' LEU . 38.3 t70 -59.12 -42.86 91.56 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 114.988 -1.006 . . . . 0.0 109.823 174.494 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' 1034 ' ' ASN . 19.6 t -53.9 -42.3 52.77 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.706 0 CA-C-N 113.847 -1.524 . . . . 0.0 111.522 173.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.651 ' O ' ' HG2' ' A' 1043 ' ' ARG . 1.7 mp -79.11 -31.11 14.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 118.35 0.523 . . . . 0.0 111.387 177.466 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.44 ' HB3' ' HB ' ' A' ' 919' ' ' ILE . 0.4 OUTLIER -56.83 -50.39 72.53 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.655 0.74 . . . . 0.0 109.511 169.907 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -65.61 -42.93 91.04 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.222 174.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.828 ' HB2' HG23 ' A' ' 980' ' ' THR . . . -52.33 -48.46 65.44 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 122.973 0.509 . . . . 0.0 112.37 -175.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.665 ' O ' HG12 ' A' 1047 ' ' ILE . 13.4 ptt180 -64.27 -47.76 78.31 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.905 -178.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.595 ' HB2' ' CA ' ' A' ' 918' ' ' GLY . 47.5 tp -67.37 -36.57 81.63 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 120.461 -0.496 . . . . 0.0 111.221 178.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.651 ' O ' ' HB2' ' A' 1049 ' ' GLN . 1.3 tmtp? -64.84 -48.43 74.35 Favored 'General case' 0 C--O 1.211 -0.969 0 CA-C-O 121.577 0.703 . . . . 0.0 109.878 -179.493 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.561 ' SD ' ' HB2' ' A' ' 979' ' ' SER . 18.8 mmt -68.2 -34.7 76.75 Favored 'General case' 0 C--N 1.297 -1.698 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.74 -177.697 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.665 HG12 ' O ' ' A' 1043 ' ' ARG . 38.2 mm -60.47 -63.33 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.514 171.414 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1048 ' ' SER . . . . . 0.651 ' O ' ' HD2' ' A' 1052 ' ' PRO . 67.2 m -136.63 52.89 1.93 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -172.623 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1049 ' ' GLN . . . . . 0.651 ' HB2' ' O ' ' A' 1045 ' ' LYS . 0.9 OUTLIER -54.42 -22.38 12.35 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 179.041 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 12.5 t -66.93 -6.33 16.18 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 111.613 0.227 . . . . 0.0 111.613 -177.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1051 ' ' ARG . . . . . 0.851 ' HB2' ' HD3' ' A' 1052 ' ' PRO . 19.5 mmm180 -118.5 -74.32 0.01 OUTLIER Pre-proline 0 CA--C 1.542 0.641 0 CA-C-O 119.076 -0.488 . . . . 0.0 111.452 172.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1052 ' ' PRO . . . . . 0.851 ' HD3' ' HB2' ' A' 1051 ' ' ARG . 93.7 Cg_endo -95.78 170.9 1.23 Allowed 'Trans proline' 0 C--N 1.357 1.018 0 C-N-CA 121.926 1.751 . . . . 0.0 113.338 179.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1053 ' ' HIS . . . . . 0.408 ' HD2' ' N ' ' A' 1045 ' ' LYS . 4.2 m-70 . . . . . 0 N--CA 1.465 0.28 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.845 175.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.702 0 N-CA-C 112.023 -0.431 . . . . 0.0 112.023 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 37.3 t -96.93 123.04 54.93 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-O 120.818 0.342 . . . . 0.0 110.487 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -84.72 0.14 9.1 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 122.851 2.367 . . . . 0.0 111.659 175.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -114.72 71.35 0.24 Allowed Glycine 0 N--CA 1.445 -0.736 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.048 -179.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 68.7 mt -83.45 106.36 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 178.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 13.1 t -91.27 110.85 22.15 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.462 -176.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 88.26 -80.27 1.64 Allowed Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.256 179.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 83.93 -32.64 3.19 Favored Glycine 0 CA--C 1.518 0.275 0 C-N-CA 121.155 -0.545 . . . . 0.0 112.541 178.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . 91.9 58.82 1.37 Allowed Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.068 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 917' ' ' GLY . . . . . 0.65 ' HA2' HD22 ' A' ' 922' ' ' ASN . . . -58.79 131.57 52.11 Favored Glycine 0 C--N 1.333 0.415 0 N-CA-C 111.735 -0.546 . . . . 0.0 111.735 177.53 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . 0.702 ' HA2' ' HD2' ' A' 1043 ' ' ARG . . . 162.61 169.23 25.7 Favored Glycine 0 C--O 1.225 -0.452 0 C-N-CA 120.162 -1.018 . . . . 0.0 112.791 -171.215 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 919' ' ' ILE . . . . . 0.908 ' HA ' ' HB3' ' A' 1040 ' ' ASP . 40.1 pt -57.99 44.77 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 N-CA-C 115.993 1.849 . . . . 0.0 115.993 -176.57 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . . . . . . . . . 39.7 ptt180 -140.11 11.73 2.4 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 121.553 -0.717 . . . . 0.0 111.109 179.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 21.8 m 60.31 25.6 15.07 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 123.013 0.525 . . . . 0.0 111.325 177.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.65 HD22 ' HA2' ' A' ' 917' ' ' GLY . 5.6 m120 39.94 -147.14 0.02 OUTLIER 'General case' 0 C--O 1.233 0.22 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.809 178.117 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.753 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 5.9 p-10 -112.26 -60.2 1.9 Allowed 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.794 ' HB3' HG22 ' A' ' 968' ' ' THR . 11.2 tptm -72.34 -29.88 64.22 Favored 'General case' 0 C--N 1.31 -1.133 0 O-C-N 120.462 -1.399 . . . . 0.0 112.532 -164.131 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.592 HG12 ' HB ' ' A' ' 968' ' ' THR . 14.0 m -65.86 -31.74 55.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 CA-C-O 121.045 0.45 . . . . 0.0 110.421 177.173 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.753 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -77.14 -23.52 51.7 Favored 'General case' 0 CA--C 1.504 -0.797 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 174.525 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.78 -25.27 48.91 Favored 'General case' 0 C--N 1.301 -1.529 0 C-N-CA 120.067 -0.653 . . . . 0.0 111.542 173.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.579 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 3.2 m120 -77.16 -30.34 54.96 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 174.226 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.629 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 62.6 t -79.74 -29.52 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.766 175.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.468 ' O ' ' HB3' ' A' ' 934' ' ' LYS . 84.8 m -57.8 -39.97 78.81 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 119.127 0.876 . . . . 0.0 108.642 169.043 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -72.7 -52.52 9.63 Favored Glycine 0 CA--C 1.527 0.812 0 CA-C-N 114.978 -1.01 . . . . 0.0 113.775 177.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.629 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.1 pp -63.2 -45.43 91.76 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 117.745 0.772 . . . . 0.0 112.706 -176.062 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 61.5 t -65.56 -39.44 85.06 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 CA-C-O 121.253 0.549 . . . . 0.0 110.366 -178.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.468 ' HB3' ' O ' ' A' ' 930' ' ' THR . 1.4 tmtt? -61.08 -35.94 78.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.942 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.432 ' HB1' ' SD ' ' A' ' 954' ' ' MET . . . -64.61 -41.98 95.83 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 118.129 0.422 . . . . 0.0 110.801 177.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.801 HG23 ' HB1' ' A' 1025 ' ' ALA . 58.0 t -47.63 -73.84 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.974 -179.485 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.401 HG13 ' N ' ' A' ' 938' ' ' GLU . 25.6 pt -65.64 -41.38 90.46 Favored 'Isoleucine or valine' 0 C--O 1.244 0.813 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -177.015 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.51 ' HG2' ' HD2' ' A' ' 942' ' ' LYS . 36.2 tt0 -69.6 -51.89 31.01 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.588 -170.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 23.8 mmt -73.71 -27.18 61.08 Favored 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 119.757 -0.777 . . . . 0.0 109.371 -174.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.58 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 59.9 p -54.74 -40.64 69.51 Favored 'General case' 0 C--N 1.343 0.288 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.429 -174.611 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 35.8 t -95.27 -15.54 23.1 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.046 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.51 ' HD2' ' HG2' ' A' ' 938' ' ' GLU . 51.2 mttm -83.03 -10.57 58.68 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 119.95 -0.7 . . . . 0.0 110.55 -178.242 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.491 ' HA ' ' HB2' ' A' ' 949' ' ' GLU . 41.7 pt -41.88 -43.45 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 O-C-N 123.547 0.529 . . . . 0.0 112.104 167.597 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.475 ' N ' HG13 ' A' ' 943' ' ' ILE . 58.8 tp60 65.49 114.52 0.03 OUTLIER Pre-proline 0 N--CA 1.465 0.291 0 C-N-CA 123.458 0.703 . . . . 0.0 110.795 -176.039 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.72 69.84 3.55 Favored 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 122.665 2.244 . . . . 0.0 113.458 -176.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.866 ' HB1' ' HD3' ' A' ' 947' ' ' PRO . . . -170.47 -59.54 0.0 OUTLIER Pre-proline 0 CA--C 1.534 0.347 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.783 172.826 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.866 ' HD3' ' HB1' ' A' ' 946' ' ' ALA . 86.9 Cg_endo -93.13 141.48 1.9 Allowed 'Trans proline' 0 N--CA 1.451 -1.022 0 C-N-CA 122.397 2.064 . . . . 0.0 111.032 171.243 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.567 ' HA ' HG22 ' A' 1009 ' ' VAL . 11.7 Cg_exo -68.88 132.69 25.33 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 121.714 1.61 . . . . 0.0 112.589 -179.337 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 0.701 ' HB3' ' CD1' ' A' ' 951' ' ' TYR . 19.8 tt0 -61.22 -15.46 34.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.26 -0.882 . . . . 0.0 108.939 168.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.667 ' HB2' ' HG2' ' A' ' 953' ' ' PRO . 7.4 mm-40 74.84 -22.71 0.25 Allowed 'General case' 0 C--N 1.344 0.359 0 CA-C-N 114.756 -1.111 . . . . 0.0 109.647 -169.411 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.781 ' HB3' ' HG3' ' A' 1002 ' ' MET . 1.0 OUTLIER 62.5 -46.65 0.18 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.533 1.133 . . . . 0.0 112.936 174.441 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 0.596 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 23.8 t -53.41 -45.4 98.51 Favored Pre-proline 0 C--N 1.323 -0.563 0 C-N-CA 123.151 0.58 . . . . 0.0 111.608 171.047 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 0.667 ' HG2' ' HB2' ' A' ' 950' ' ' GLU . 38.4 Cg_exo -51.58 -39.42 65.52 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.186 1.924 . . . . 0.0 112.53 174.029 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.432 ' SD ' ' HB1' ' A' ' 935' ' ' ALA . 5.3 tpt -73.96 -36.41 64.59 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.762 175.073 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.683 HG23 ' HE1' ' A' 1002 ' ' MET . 71.2 t -52.67 -40.74 35.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.794 168.166 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 3.1 tmtm? -66.59 -33.02 74.73 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.597 175.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . 0.412 ' HB3' ' HA ' ' A' ' 954' ' ' MET . 7.0 tp10 -77.55 -45.81 24.24 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 121.002 0.429 . . . . 0.0 111.01 -174.278 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.484 HG13 HD22 ' A' ' 998' ' ' LEU . 14.6 p -87.05 -27.53 5.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.618 -178.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -63.82 -38.91 96.84 Favored Glycine 0 N--CA 1.447 -0.567 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 173.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . 0.464 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 17.0 tp -63.11 -38.26 90.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.279 -0.46 . . . . 0.0 109.893 174.264 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.405 ' HB3' ' HB3' ' A' ' 932' ' ' LEU . . . -70.3 -40.76 74.06 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.706 -176.154 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.587 HD11 HD12 ' A' ' 991' ' ' LEU . 0.2 OUTLIER -67.74 -44.16 78.23 Favored 'General case' 0 C--O 1.217 -0.644 0 CA-C-O 118.782 -0.627 . . . . 0.0 111.437 173.423 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.464 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 6.1 ptp180 -64.85 -31.68 73.03 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 120.187 1.358 . . . . 0.0 110.457 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 964' ' ' THR . . . . . 0.443 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 30.4 m -69.33 -39.11 78.39 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 176.602 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.981 HD12 HD22 ' A' 1036 ' ' LEU . 37.5 tp -62.79 -44.11 97.04 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.559 -1.2 . . . . 0.0 109.949 175.179 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.728 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.5 tt -68.2 -35.22 77.66 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.318 -0.856 . . . . 0.0 109.119 -172.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -69.81 -43.48 71.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.815 178.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.794 HG22 ' HB3' ' A' ' 924' ' ' LYS . 4.6 m -64.41 -41.11 96.8 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 119.843 -0.743 . . . . 0.0 110.134 178.321 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.715 HG13 HG23 ' A' ' 984' ' ' ILE . 43.6 t -67.65 -38.09 79.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.178 173.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.639 ' HB2' HE22 ' A' ' 988' ' ' GLN . 19.2 t70 -66.73 -38.61 87.01 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 122.21 1.005 . . . . 0.0 108.696 -178.325 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.451 ' C ' ' HD2' ' A' ' 974' ' ' PRO . 28.1 tt0 -76.01 -21.94 56.34 Favored 'General case' 0 N--CA 1.437 -1.106 0 CA-C-N 113.964 -1.471 . . . . 0.0 110.128 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.589 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 52.7 m -72.08 -17.67 61.98 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.708 171.651 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.817 ' HA ' HD12 ' A' ' 984' ' ' ILE . 9.4 tt -66.04 -51.0 48.95 Favored Pre-proline 0 CA--C 1.53 0.176 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 179.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.507 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 95.0 Cg_endo -81.97 -2.44 11.3 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 120.964 1.109 . . . . 0.0 113.546 171.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.688 HG11 HD13 ' A' ' 976' ' ' LEU . 0.3 OUTLIER -73.06 -32.16 38.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.691 178.351 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.688 HD13 HG11 ' A' ' 975' ' ' VAL . 0.0 OUTLIER -108.91 158.26 34.67 Favored Pre-proline 0 CA--C 1.53 0.194 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 169.27 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -80.46 99.21 1.13 Allowed 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 122.866 2.377 . . . . 0.0 113.625 -176.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . 68.94 -77.58 0.05 Allowed 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 167.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 979' ' ' SER . . . . . . . . . . . . . 4.7 m -38.34 -55.31 1.36 Allowed 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 114.776 1.399 . . . . 0.0 114.776 -165.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.582 ' HG1' ' HA ' ' A' 1043 ' ' ARG . 15.8 m -70.42 -8.53 51.61 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -172.369 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.65 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 0.3 OUTLIER -51.82 -34.85 42.12 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -175.542 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -82.22 -21.03 36.56 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.116 0.871 . . . . 0.0 111.94 -171.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.554 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 0.4 OUTLIER -77.77 -33.81 52.55 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.386 0.612 . . . . 0.0 109.723 169.615 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.817 HD12 ' HA ' ' A' ' 973' ' ' LEU . 69.3 mt -70.8 -30.28 41.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 CA-C-N 114.889 -1.05 . . . . 0.0 108.469 179.319 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . 0.65 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 45.9 mt-10 -63.97 -54.47 34.01 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.302 174.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 986' ' ' MET . . . . . 0.549 ' HA ' ' HD2' ' A' ' 989' ' ' LYS . 75.2 mtp -70.61 -41.52 72.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.789 -170.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.942 ' HB3' ' HB2' ' A' 1035 ' ' LEU . . . -65.24 -50.81 64.38 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.19 -0.914 . . . . 0.0 112.167 -173.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.728 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 3.7 pt20 -61.83 -28.2 69.31 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 120.452 -0.499 . . . . 0.0 111.074 178.528 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . 0.664 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 55.9 mttm -70.0 -43.42 71.45 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.449 0.643 . . . . 0.0 111.182 173.418 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.684 HD22 ' HB3' ' A' 1035 ' ' LEU . 7.7 tp -50.52 -60.08 3.38 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 114.694 -1.139 . . . . 0.0 112.539 -176.647 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.617 ' HB2' ' CD2' ' A' 1035 ' ' LEU . 0.4 OUTLIER -63.9 -33.49 75.83 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 121.398 0.618 . . . . 0.0 109.401 179.643 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . 0.664 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 44.7 t-20 -52.44 -51.89 56.88 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.584 -1.189 . . . . 0.0 110.546 177.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 993' ' ' SER . . . . . 0.486 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 32.7 t -75.01 -42.44 57.4 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.464 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.54 -36.31 80.23 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.971 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.642 ' HG ' HD21 ' A' ' 998' ' ' LEU . 8.1 tt -73.18 -19.75 61.04 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 122.198 -0.314 . . . . 0.0 110.617 172.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -75.0 -25.55 58.9 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 119.841 -0.744 . . . . 0.0 109.788 168.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.548 ' O ' ' HG2' ' A' 1001 ' ' LYS . 4.6 mm-40 -75.43 -40.16 57.98 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 172.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.762 HD13 ' HB2' ' A' 1025 ' ' ALA . 0.2 OUTLIER -56.18 -47.01 79.13 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.325 177.917 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.529 HG13 ' O ' ' A' ' 995' ' ' LEU . 95.8 mt -64.73 -42.12 94.1 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.575 -174.545 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 14.5 m-80 -59.49 -39.41 83.69 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.345 0.593 . . . . 0.0 111.856 -178.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 69.5 mmtt -77.96 -37.61 47.12 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 122.097 0.951 . . . . 0.0 108.739 -177.028 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.867 ' HB2' ' HG3' ' A' 1021 ' ' MET . 1.7 ttp -61.64 -28.71 69.57 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 114.061 -1.427 . . . . 0.0 109.179 175.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.463 ' O ' ' HG3' ' A' 1006 ' ' GLN . 2.9 tptm -73.76 -47.03 42.03 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.948 -167.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.827 HD12 ' HG3' ' A' 1007 ' ' GLN . 3.8 mm? -77.5 -13.56 59.89 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.102 179.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1005 ' ' ALA . . . . . 0.812 ' HB3' ' HB3' ' A' 1017 ' ' TYR . . . -75.38 -32.21 60.72 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 119.443 -0.903 . . . . 0.0 110.61 -177.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.712 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 5.2 pp0? -75.13 -33.27 61.54 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 118.867 -0.587 . . . . 0.0 110.961 165.406 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.827 ' HG3' HD12 ' A' 1004 ' ' LEU . 13.7 mm100 -48.33 -44.12 33.88 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.126 0.488 . . . . 0.0 110.497 176.245 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.851 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 28.6 m-85 -130.01 47.4 2.51 Favored 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 120.014 -0.674 . . . . 0.0 111.074 170.027 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 1.033 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 7.2 p -50.95 -24.47 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 CA-C-O 121.945 0.878 . . . . 0.0 109.599 167.293 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 16.4 mmt -48.68 -44.6 38.05 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 113.838 -1.528 . . . . 0.0 110.922 175.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 2.6 p -154.98 -101.9 0.04 OUTLIER 'General case' 0 C--O 1.251 1.182 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 -177.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 16.4 p -57.67 -64.02 1.04 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-N 114.552 -1.204 . . . . 0.0 112.881 -164.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.851 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 4.6 mp -45.99 -42.94 13.75 Favored 'General case' 0 CA--C 1.5 -0.98 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 1.033 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -55.03 -47.77 74.29 Favored 'General case' 0 N--CA 1.438 -1.042 0 O-C-N 123.866 0.729 . . . . 0.0 110.345 -168.499 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A 1015 ' ' GLN . . . . . 0.602 ' O ' ' HD3' ' A' 1019 ' ' LYS . 97.8 mt-30 -69.37 -51.57 35.42 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.08 -177.458 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -64.35 -48.0 77.19 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.36 0.6 . . . . 0.0 111.188 -176.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.812 ' HB3' ' HB3' ' A' 1005 ' ' ALA . 7.2 m-85 -68.24 -37.52 80.87 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.258 -0.883 . . . . 0.0 113.139 -173.393 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.587 ' HD3' ' CE2' ' A' ' 951' ' ' TYR . 47.1 tptt -80.96 -28.42 35.68 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.3 -176.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1019 ' ' LYS . . . . . 0.602 ' HD3' ' O ' ' A' 1015 ' ' GLN . 5.6 mptp? -73.32 -53.27 11.21 Favored 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 174.091 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1020 ' ' GLN . . . . . 0.476 ' HG2' ' HG3' ' A' 1001 ' ' LYS . 9.2 tt0 -50.56 -32.01 17.35 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.809 164.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.867 ' HG3' ' HB2' ' A' 1002 ' ' MET . 2.4 ttp -68.69 -50.66 49.18 Favored 'General case' 0 CA--C 1.514 -0.417 0 O-C-N 122.333 -0.23 . . . . 0.0 110.621 176.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1022 ' ' LEU . . . . . 0.656 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -84.9 -9.41 58.13 Favored 'General case' 0 C--O 1.219 -0.553 0 C-N-CA 119.629 -0.829 . . . . 0.0 110.317 -174.035 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 52.4 m -83.34 -34.8 25.57 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 171.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.521 ' O ' ' HB1' ' A' 1027 ' ' ALA . . . -78.28 -21.85 49.14 Favored 'General case' 0 C--O 1.223 -0.319 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 171.018 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.801 ' HB1' HG23 ' A' ' 936' ' ' VAL . . . -85.64 -23.38 27.52 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.176 170.187 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.586 ' O ' HG23 ' A' 1030 ' ' VAL . 46.9 t-80 -75.77 -24.58 56.03 Favored 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 165.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1027 ' ' ALA . . . . . 0.521 ' HB1' ' O ' ' A' 1024 ' ' ALA . . . -70.68 -38.88 73.78 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 123.53 0.732 . . . . 0.0 109.654 164.236 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.613 HD12 HD23 ' A' ' 998' ' ' LEU . 21.6 mt -60.95 -47.21 87.49 Favored 'General case' 0 C--N 1.314 -0.939 0 C-N-CA 120.191 -0.604 . . . . 0.0 109.495 169.681 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -57.74 -40.92 80.79 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 111.366 0.135 . . . . 0.0 111.366 173.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.586 HG23 ' O ' ' A' 1026 ' ' HIS . 16.1 t -70.18 -52.17 32.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-O 121.232 0.539 . . . . 0.0 110.711 -177.093 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.702 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 5.7 m-20 -77.27 -29.14 53.75 Favored 'General case' 0 C--O 1.214 -0.783 0 CA-C-N 115.441 -0.8 . . . . 0.0 112.746 -174.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.584 ' O ' ' HG ' ' A' 1036 ' ' LEU . . . -66.51 -32.68 74.18 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 170.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.491 ' HB3' ' O ' ' A' 1030 ' ' VAL . 22.9 tttm -64.96 -51.24 62.88 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 122.078 0.942 . . . . 0.0 109.098 168.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.702 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 32.4 t30 -61.58 -52.11 65.75 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 113.396 -1.729 . . . . 0.0 112.572 -173.399 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.942 ' HB2' ' HB3' ' A' ' 987' ' ' ALA . 1.5 pp -62.45 -37.95 87.89 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 118.941 -0.552 . . . . 0.0 110.23 -176.187 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.981 HD22 HD12 ' A' ' 965' ' ' LEU . 19.9 mt -66.95 -45.86 76.48 Favored 'General case' 0 C--O 1.224 -0.279 0 C-N-CA 116.809 -1.956 . . . . 0.0 108.785 176.795 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.473 ' HB3' ' O ' ' A' 1034 ' ' ASN . 28.3 t70 -50.19 -40.79 48.07 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 114.46 -1.245 . . . . 0.0 111.038 175.273 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.506 ' HB ' ' O ' ' A' 1035 ' ' LEU . 24.2 t -53.33 -51.09 43.84 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.692 0 CA-C-N 114.267 -1.333 . . . . 0.0 111.66 173.015 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.804 HG12 HG12 ' A' ' 984' ' ' ILE . 3.0 mp -72.4 -33.08 44.58 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.428 0 CA-C-N 118.917 0.78 . . . . 0.0 110.738 176.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.908 ' HB3' ' HA ' ' A' ' 919' ' ' ILE . 90.1 m-20 -52.88 -52.59 56.92 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 122.317 1.056 . . . . 0.0 109.343 173.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.501 ' HA ' ' HE2' ' A' 1053 ' ' HIS . 48.5 mt-30 -75.61 -35.72 60.45 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.524 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.657 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -53.96 -50.05 67.37 Favored 'General case' 0 CA--C 1.499 -0.994 0 C-N-CA 123.465 0.706 . . . . 0.0 111.998 -178.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.702 ' HD2' ' HA2' ' A' ' 918' ' ' GLY . 0.1 OUTLIER -62.2 -41.09 98.04 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -177.394 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.702 ' N ' ' HD3' ' A' 1043 ' ' ARG . 50.7 tp -74.51 -39.17 62.58 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 121.52 0.676 . . . . 0.0 110.319 -177.559 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.467 ' N ' ' HD2' ' A' 1053 ' ' HIS . 28.7 tttt -64.56 -44.78 89.68 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 114.877 -1.056 . . . . 0.0 110.793 179.221 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1046 ' ' MET . . . . . . . . . . . . . 14.2 mmt -66.87 -35.56 80.31 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.748 179.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.669 HG12 ' O ' ' A' 1043 ' ' ARG . 20.6 mm -51.38 -48.49 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.368 172.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 66.3 m -144.87 65.42 1.27 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 111.592 0.219 . . . . 0.0 111.592 -177.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -68.63 -21.44 64.48 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.651 178.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 5.2 m -77.23 4.04 11.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.289 0.566 . . . . 0.0 110.518 177.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1051 ' ' ARG . . . . . 0.479 ' HG3' ' HD2' ' A' 1052 ' ' PRO . 16.9 tpt180 -135.1 146.37 58.13 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 175.163 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1052 ' ' PRO . . . . . 0.479 ' HD2' ' HG3' ' A' 1051 ' ' ARG . 74.1 Cg_exo -49.69 115.88 2.05 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 121.963 1.775 . . . . 0.0 112.113 177.208 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1053 ' ' HIS . . . . . 0.501 ' HE2' ' HA ' ' A' 1041 ' ' GLN . 8.0 t-80 . . . . . 0 C--N 1.333 -0.111 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.754 -178.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.699 0 N-CA-C 111.453 -0.659 . . . . 0.0 111.453 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 38.0 m 69.56 127.43 0.03 OUTLIER Pre-proline 0 CA--C 1.53 0.211 0 CA-C-O 121.26 0.552 . . . . 0.0 111.484 178.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.98 47.15 2.13 Favored 'Trans proline' 0 CA--C 1.53 0.315 0 C-N-CA 122.931 2.421 . . . . 0.0 112.128 178.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . 118.05 -116.5 3.46 Favored Glycine 0 N--CA 1.444 -0.817 0 N-CA-C 111.099 -0.8 . . . . 0.0 111.099 -176.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 44.5 mm 65.79 102.23 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.324 0 C-N-CA 122.89 0.476 . . . . 0.0 111.117 178.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 39.7 p 48.58 38.84 12.02 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.648 -178.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . -83.7 -0.61 89.92 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 121.111 -0.566 . . . . 0.0 112.536 -179.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . -109.42 143.89 16.54 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.071 178.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . 81.66 23.57 57.81 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 121.034 -0.603 . . . . 0.0 112.608 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . -124.44 117.64 3.14 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.283 -179.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . 0.613 ' CA ' ' HG ' ' A' 1044 ' ' LEU . . . 84.5 170.37 46.83 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.871 -0.68 . . . . 0.0 113.247 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 919' ' ' ILE . . . . . 0.5 HG21 ' CG ' ' A' 1040 ' ' ASP . 3.2 mp -61.19 118.01 3.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 C-N-CA 123.254 0.622 . . . . 0.0 109.968 175.265 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -171.29 46.2 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.702 -169.199 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 7.7 t -114.59 145.68 41.68 Favored 'General case' 0 C--N 1.321 -0.64 0 O-C-N 121.602 -0.687 . . . . 0.0 110.993 178.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -148.74 85.08 1.48 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.27 -0.877 . . . . 0.0 108.942 175.017 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.658 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 5.0 p-10 -125.31 -157.44 0.78 Allowed 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.336 -171.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.519 ' HB2' HG21 ' A' ' 968' ' ' THR . 68.2 mmtt -54.28 -31.72 54.48 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -174.693 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.61 ' O ' HG23 ' A' ' 929' ' ' VAL . 34.0 m -57.51 -32.52 41.99 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.36 0 CA-C-O 121.164 0.507 . . . . 0.0 110.494 175.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.658 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.1 OUTLIER -74.56 -41.72 60.04 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.337 -179.738 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . 0.469 ' O ' HG23 ' A' ' 930' ' ' THR . 10.8 pt-20 -76.59 -25.6 54.12 Favored 'General case' 0 C--N 1.317 -0.807 0 C-N-CA 119.175 -1.01 . . . . 0.0 111.342 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -66.17 -28.59 68.89 Favored 'General case' 0 C--N 1.319 -0.754 0 O-C-N 121.651 -0.655 . . . . 0.0 110.346 167.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.61 HG23 ' O ' ' A' ' 925' ' ' VAL . 69.2 t -79.23 -34.9 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.312 172.535 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.469 HG23 ' O ' ' A' ' 927' ' ' GLU . 1.3 t -67.99 -30.43 69.69 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 120.369 1.44 . . . . 0.0 108.275 173.151 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -73.17 -53.11 8.02 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-N 115.398 -0.819 . . . . 0.0 113.084 174.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.47 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 0.9 OUTLIER -65.79 -49.69 67.4 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -178.414 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.415 ' O ' ' HB ' ' A' ' 936' ' ' VAL . 72.6 t -68.59 -32.39 54.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 CA-C-O 121.185 0.517 . . . . 0.0 110.733 -174.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . . . . . . . . . 24.7 ttpt -61.99 -45.96 91.33 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.084 176.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.468 ' O ' ' HB2' ' A' ' 939' ' ' MET . . . -56.38 -35.33 67.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.464 0.173 . . . . 0.0 111.366 176.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.806 HG23 ' HB1' ' A' 1025 ' ' ALA . 57.8 t -52.79 -74.95 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.696 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 23.5 pt -74.74 -42.64 47.55 Favored 'Isoleucine or valine' 0 C--O 1.245 0.851 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -175.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.421 ' HG2' ' HD3' ' A' ' 942' ' ' LYS . 31.5 tt0 -64.9 -51.41 62.06 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.383 0.611 . . . . 0.0 109.99 -171.409 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.586 ' HA ' ' HG2' ' A' ' 942' ' ' LYS . 65.4 mtt -73.55 -25.49 60.41 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.254 -178.211 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.74 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 32.6 p -52.75 -38.73 61.37 Favored 'General case' 0 C--N 1.347 0.468 0 O-C-N 123.797 0.686 . . . . 0.0 111.346 -173.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 10.9 p -106.93 -24.98 11.84 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -176.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.586 ' HG2' ' HA ' ' A' ' 939' ' ' MET . 60.5 pttt -83.26 -45.38 13.89 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 119.012 -1.075 . . . . 0.0 112.625 -165.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 1.049 ' HB ' ' HG3' ' A' ' 949' ' ' GLU . 5.1 mt -78.52 -1.11 3.9 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 N-CA-C 112.713 0.634 . . . . 0.0 112.713 -175.505 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.429 ' HB3' ' HD3' ' A' ' 945' ' ' PRO . 34.7 tt0 -62.56 -43.68 84.82 Favored Pre-proline 0 CA--C 1.541 0.616 0 N-CA-C 113.496 0.924 . . . . 0.0 113.496 -175.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.541 ' HD2' ' O ' ' A' ' 942' ' ' LYS . 42.6 Cg_exo -58.63 -20.73 51.84 Favored 'Trans proline' 0 C--N 1.356 0.973 0 C-N-CA 121.994 1.796 . . . . 0.0 112.562 174.43 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.67 ' HB2' ' HD2' ' A' ' 947' ' ' PRO . . . -91.06 179.18 1.51 Allowed Pre-proline 0 C--N 1.322 -0.606 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 176.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.67 ' HD2' ' HB2' ' A' ' 946' ' ' ALA . 87.7 Cg_exo -43.96 131.73 8.28 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 121.975 1.783 . . . . 0.0 111.544 170.525 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.999 ' HG3' HG11 ' A' 1009 ' ' VAL . 32.5 Cg_exo -19.66 65.73 0.0 OUTLIER 'Trans proline' 0 C--N 1.357 1.019 1 C-N-CA 127.644 5.562 . . . . 0.0 116.561 -167.758 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 1.049 ' HG3' ' HB ' ' A' ' 943' ' ' ILE . 0.4 OUTLIER 47.57 -0.09 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -168.314 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.799 ' HB3' ' HG2' ' A' ' 953' ' ' PRO . 42.7 mt-10 45.51 63.25 1.85 Allowed 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 -158.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.944 ' HB3' ' HG3' ' A' 1002 ' ' MET . 20.2 m-85 -51.31 -50.8 58.67 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.509 -176.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 0.788 ' O ' ' HB ' ' A' ' 955' ' ' VAL . 25.3 t -63.49 -48.4 81.51 Favored Pre-proline 0 C--N 1.324 -0.511 0 O-C-N 122.49 -0.131 . . . . 0.0 110.863 178.604 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 0.799 ' HG2' ' HB3' ' A' ' 950' ' ' GLU . 25.7 Cg_exo -50.6 -40.0 55.47 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 121.928 1.752 . . . . 0.0 112.806 166.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.714 ' HE1' ' HG2' ' A' ' 949' ' ' GLU . 36.9 ttm -67.33 -31.92 72.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.034 0.445 . . . . 0.0 110.235 175.752 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.788 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 49.7 t -52.59 -39.12 28.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.087 168.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.548 ' HB2' ' O ' ' A' ' 953' ' ' PRO . 12.8 mptt -64.82 -36.4 84.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.592 0.234 . . . . 0.0 111.293 172.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -78.87 -46.93 17.53 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.768 0.318 . . . . 0.0 111.773 -172.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.572 HG22 HD21 ' A' ' 962' ' ' LEU . 14.5 p -80.75 -32.01 12.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 179.214 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -59.72 -42.84 98.13 Favored Glycine 0 N--CA 1.446 -0.674 0 N-CA-C 110.719 -0.953 . . . . 0.0 110.719 174.134 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . 0.552 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 7.7 tt -67.39 -41.35 85.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.822 0.344 . . . . 0.0 110.305 177.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -66.97 -43.45 83.05 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.063 0.459 . . . . 0.0 111.689 -174.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.739 HD12 HD23 ' A' ' 995' ' ' LEU . 4.0 pp -84.94 -26.47 27.18 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.01 -178.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.602 ' HG3' ' N ' ' A' ' 964' ' ' THR . 8.6 ptt180 -66.82 -39.08 87.56 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 118.656 -1.218 . . . . 0.0 109.606 171.149 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 964' ' ' THR . . . . . 0.602 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 12.5 m -64.67 -31.51 72.76 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.693 HD21 HD21 ' A' ' 991' ' ' LEU . 54.2 tp -63.44 -51.43 65.75 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 121.561 0.695 . . . . 0.0 109.541 173.436 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.746 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.3 tt -63.36 -37.81 88.73 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 114.52 -1.218 . . . . 0.0 109.081 -175.114 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . 0.465 ' HA ' ' HB3' ' A' ' 970' ' ' ASP . . . -74.37 -28.66 61.22 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.667 179.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.519 HG21 ' HB2' ' A' ' 924' ' ' LYS . 31.4 m -72.0 -32.53 67.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 119.19 0.905 . . . . 0.0 109.214 171.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.621 HG12 HG21 ' A' ' 984' ' ' ILE . 71.3 t -71.35 -40.1 72.79 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.166 171.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.61 ' HB2' HE22 ' A' ' 988' ' ' GLN . 24.8 t70 -69.23 -38.65 78.63 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 122.033 0.921 . . . . 0.0 108.572 -179.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.643 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 6.8 tp10 -63.78 -35.34 80.26 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.583 174.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.445 ' HB2' ' O ' ' A' ' 969' ' ' VAL . 64.8 m -64.9 -17.93 64.75 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.12 174.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.742 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 2.4 tm? -66.18 -53.07 34.78 Favored Pre-proline 0 CA--C 1.537 0.456 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -176.51 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.742 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 94.0 Cg_endo -91.31 -19.31 0.88 Allowed 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 121.236 1.291 . . . . 0.0 114.23 174.275 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . . . . . . . . . 3.4 t -60.26 -44.27 95.23 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 CA-C-N 118.019 0.372 . . . . 0.0 110.666 177.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.408 ' C ' ' H ' ' A' ' 978' ' ' ALA . 33.8 tp -97.47 106.76 34.85 Favored Pre-proline 0 N--CA 1.447 -0.579 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 173.495 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -75.75 31.22 0.38 Allowed 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 123.214 2.609 . . . . 0.0 112.765 -176.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . 0.408 ' H ' ' C ' ' A' ' 976' ' ' LEU . . . -109.13 174.66 5.77 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.951 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.661 ' HB2' ' SD ' ' A' 1046 ' ' MET . 7.2 m -76.53 15.82 0.57 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.227 0.537 . . . . 0.0 111.32 -178.208 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.797 ' HG1' ' HA ' ' A' 1043 ' ' ARG . 55.1 m -60.35 -18.77 52.32 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 121.366 0.603 . . . . 0.0 110.1 173.209 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.469 ' HA ' HD11 ' A' ' 984' ' ' ILE . 0.3 OUTLIER -52.56 -25.7 11.23 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 114.816 -1.083 . . . . 0.0 113.825 -176.73 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . 0.652 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 0.0 OUTLIER -84.37 -20.16 32.42 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.396 -0.815 . . . . 0.0 111.6 -177.409 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.474 ' CB ' ' HB3' ' A' 1042 ' ' ALA . 0.3 OUTLIER -78.5 -34.96 47.04 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.808 0.813 . . . . 0.0 109.157 168.912 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.621 HG21 HG12 ' A' ' 969' ' ' VAL . 70.4 mt -69.58 -30.13 44.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 114.459 -1.246 . . . . 0.0 109.31 179.459 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . 0.652 ' HG3' ' O ' ' A' ' 982' ' ' ARG . 2.4 pp20? -70.37 -44.01 68.95 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 121.494 0.664 . . . . 0.0 109.923 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 24.9 ttt -72.09 -42.78 65.76 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.474 -173.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.965 ' HB2' ' HB2' ' A' 1035 ' ' LEU . . . -74.44 -51.77 13.94 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.984 -1.007 . . . . 0.0 112.488 -170.31 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.746 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 4.2 pt20 -61.87 -23.15 66.11 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.277 177.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . 0.794 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 15.1 tttt -73.07 -37.24 66.87 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.887 171.654 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.626 HD23 ' OD1' ' A' 1031 ' ' ASP . 15.7 tp -60.37 -57.73 11.5 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 119.616 -0.833 . . . . 0.0 111.89 179.128 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.693 HD21 HD21 ' A' ' 965' ' ' LEU . 11.6 tp -53.42 -33.95 55.93 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.475 0.655 . . . . 0.0 110.162 175.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . 0.794 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 24.6 t-20 -50.04 -53.84 24.22 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.065 -1.425 . . . . 0.0 111.426 -179.417 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 20.0 m -79.57 -26.79 41.27 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 179.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.64 -44.03 75.02 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.569 -0.852 . . . . 0.0 111.011 178.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.739 HD23 HD12 ' A' ' 962' ' ' LEU . 0.8 OUTLIER -66.02 -21.93 66.42 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 123.179 0.591 . . . . 0.0 110.478 172.405 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -75.91 -26.16 56.7 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 119.171 -1.012 . . . . 0.0 110.009 171.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.491 ' CD ' ' HZ2' ' A' 1001 ' ' LYS . 4.8 tp10 -75.38 -43.38 50.59 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 171.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.872 HD23 HD11 ' A' 1028 ' ' LEU . 0.1 OUTLIER -56.37 -48.1 77.54 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.316 -0.857 . . . . 0.0 111.742 -177.683 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.717 HD11 HG12 ' A' ' 955' ' ' VAL . 47.5 mm -69.65 -37.76 74.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.455 -175.018 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 11.7 m-80 -63.66 -36.1 82.73 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 121.126 0.489 . . . . 0.0 111.83 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.587 ' HD3' ' HB3' ' A' 1020 ' ' GLN . 35.2 mttp -82.47 -35.34 27.56 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.477 0.656 . . . . 0.0 110.453 -176.499 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.944 ' HG3' ' HB3' ' A' ' 951' ' ' TYR . 15.2 tpp -60.42 -29.45 69.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 122.423 1.106 . . . . 0.0 108.514 173.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 2.7 tptm -73.69 -52.66 12.54 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 113.865 -1.516 . . . . 0.0 111.04 -167.02 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.764 ' HA ' ' HB2' ' A' 1007 ' ' GLN . 7.8 mp -76.8 -13.43 60.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.731 -178.393 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1005 ' ' ALA . . . . . 0.71 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -69.12 -44.58 72.08 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 119.317 -0.953 . . . . 0.0 109.434 179.348 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.802 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 2.9 pp0? -71.86 -34.03 68.89 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 120.127 -0.629 . . . . 0.0 111.435 170.134 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.764 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 51.8 mt-30 -47.14 -48.95 23.19 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.993 0.425 . . . . 0.0 110.901 176.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.809 ' HB2' HD13 ' A' 1013 ' ' LEU . 89.0 m-85 -125.15 47.75 2.12 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.191 -0.603 . . . . 0.0 110.529 171.465 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 1.004 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 12.5 p -51.76 -22.04 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 115.087 -0.961 . . . . 0.0 110.434 171.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1010 ' ' MET . . . . . 0.466 ' O ' HG22 ' A' 1011 ' ' THR . 22.7 mmt -41.67 -36.61 1.0 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.402 -1.272 . . . . 0.0 111.961 176.117 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1011 ' ' THR . . . . . 0.466 HG22 ' O ' ' A' 1010 ' ' MET . 0.2 OUTLIER -167.7 -92.42 0.01 OUTLIER 'General case' 0 C--O 1.246 0.911 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 176.522 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 12.2 m -53.1 -64.62 0.76 Allowed 'General case' 0 C--O 1.237 0.408 0 CA-C-N 114.571 -1.195 . . . . 0.0 113.311 -164.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.809 HD13 ' HB2' ' A' 1008 ' ' TYR . 4.1 mp -52.7 -40.28 62.81 Favored 'General case' 0 CA--C 1.496 -1.099 0 O-C-N 123.25 0.343 . . . . 0.0 111.365 -177.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 1.004 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.09 -48.33 70.8 Favored 'General case' 0 N--CA 1.44 -0.93 0 O-C-N 123.639 0.587 . . . . 0.0 110.506 -168.206 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A 1015 ' ' GLN . . . . . 0.53 ' O ' ' HD3' ' A' 1019 ' ' LYS . 25.1 mt-30 -71.39 -47.92 53.18 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 120.343 -0.543 . . . . 0.0 111.605 -179.076 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -67.5 -56.33 9.98 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.148 0.499 . . . . 0.0 111.25 -176.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.71 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 10.3 m-85 -56.46 -38.6 71.89 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.283 -177.148 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.933 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 22.9 tptm -80.01 -30.89 39.68 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 114.865 -1.061 . . . . 0.0 110.808 -177.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1019 ' ' LYS . . . . . 0.53 ' HD3' ' O ' ' A' 1015 ' ' GLN . 1.6 mptm? -70.87 -52.88 17.52 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 174.302 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1020 ' ' GLN . . . . . 0.587 ' HB3' ' HD3' ' A' 1001 ' ' LYS . 25.3 mt-30 -50.79 -32.86 21.21 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.107 164.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.481 ' SD ' HD12 ' A' ' 998' ' ' LEU . 10.7 tmm? -65.73 -50.73 63.74 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 177.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1022 ' ' LEU . . . . . 0.692 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -81.08 -5.01 57.14 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 119.301 -0.96 . . . . 0.0 109.707 -177.023 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 87.4 m -88.21 -35.9 17.08 Favored 'General case' 0 C--O 1.223 -0.306 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 173.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.548 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -77.76 -21.73 51.31 Favored 'General case' 0 C--O 1.22 -0.478 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 170.705 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.806 ' HB1' HG23 ' A' ' 936' ' ' VAL . . . -85.34 -24.09 27.77 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.368 169.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.608 ' O ' HG22 ' A' 1030 ' ' VAL . 28.4 t60 -76.97 -24.14 52.3 Favored 'General case' 0 C--O 1.215 -0.743 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 166.095 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1027 ' ' ALA . . . . . 0.514 ' HA ' ' HB ' ' A' 1030 ' ' VAL . . . -73.23 -39.81 65.18 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 123.88 0.872 . . . . 0.0 109.875 165.068 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.872 HD11 HD23 ' A' ' 998' ' ' LEU . 39.7 mt -59.68 -45.11 93.07 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 168.237 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -61.45 -34.88 76.17 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.592 0.234 . . . . 0.0 111.41 173.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.608 HG22 ' O ' ' A' 1026 ' ' HIS . 4.3 t -66.85 -50.33 66.16 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -179.49 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.745 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 34.2 t70 -74.55 -28.4 60.94 Favored 'General case' 0 C--O 1.206 -1.212 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.424 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.581 ' HB3' HG22 ' A' ' 929' ' ' VAL . . . -55.16 -45.59 75.71 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 171.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.402 ' O ' ' HB2' ' A' 1037 ' ' ASP . 78.0 tttt -67.82 -40.7 83.76 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.421 174.003 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.745 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 7.0 t30 -77.96 -56.1 4.76 Favored 'General case' 0 C--O 1.221 -0.444 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.176 -170.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.965 ' HB2' ' HB2' ' A' ' 987' ' ' ALA . 0.2 OUTLIER -61.37 -39.99 92.69 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 118.978 -0.534 . . . . 0.0 110.654 -175.025 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.64 HD12 ' N ' ' A' 1037 ' ' ASP . 0.0 OUTLIER -72.94 -29.57 63.2 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 116.029 -2.268 . . . . 0.0 109.644 -179.372 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.64 ' N ' HD12 ' A' 1036 ' ' LEU . 15.2 t70 -63.03 -41.92 99.65 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-O 122.116 0.96 . . . . 0.0 109.314 174.349 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.438 HG22 ' O ' ' A' 1034 ' ' ASN . 36.3 t -59.95 -45.48 95.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 113.764 -1.562 . . . . 0.0 111.591 177.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.615 HD12 ' HA ' ' A' ' 984' ' ' ILE . 2.0 mp -72.79 -31.63 37.28 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 C-N-CA 119.972 -0.691 . . . . 0.0 110.917 174.064 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.5 ' CG ' HG21 ' A' ' 919' ' ' ILE . 1.7 t0 -58.54 -46.34 87.03 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.317 0.579 . . . . 0.0 109.746 170.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.483 ' HG3' ' O ' ' A' 1037 ' ' ASP . 78.2 mt-30 -60.36 -49.43 77.61 Favored 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 173.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.721 ' CB ' HG21 ' A' ' 980' ' ' THR . . . -54.2 -52.27 61.77 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 114.279 -1.328 . . . . 0.0 113.353 -173.146 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.797 ' HA ' ' HG1' ' A' ' 980' ' ' THR . 0.0 OUTLIER -64.07 -41.24 97.4 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 -176.2 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.613 ' HG ' ' CA ' ' A' ' 918' ' ' GLY . 3.0 tm? -72.4 -43.35 64.04 Favored 'General case' 0 N--CA 1.44 -0.94 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 -177.275 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.626 ' HB3' ' HB2' ' A' 1053 ' ' HIS . 22.8 mttp -50.65 -41.39 55.25 Favored 'General case' 0 C--O 1.213 -0.853 0 CA-C-N 114.689 -1.141 . . . . 0.0 109.659 172.568 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.661 ' SD ' ' HB2' ' A' ' 979' ' ' SER . 10.3 mmt -84.17 -23.42 30.6 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -179.261 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.693 HG12 ' O ' ' A' 1043 ' ' ARG . 23.5 mm -59.69 -42.62 89.16 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.396 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 174.335 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 48.9 m -141.96 72.54 1.38 Allowed 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.994 176.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.13 157.45 22.79 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.865 179.202 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 5.0 t -164.83 -38.01 0.03 OUTLIER 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 -177.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1051 ' ' ARG . . . . . 0.452 ' HB2' ' HD3' ' A' 1052 ' ' PRO . 52.2 mtp180 -143.42 -58.31 0.02 OUTLIER Pre-proline 0 CA--C 1.537 0.467 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.711 175.295 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1052 ' ' PRO . . . . . 0.452 ' HD3' ' HB2' ' A' 1051 ' ' ARG . 13.1 Cg_endo -89.81 103.32 0.34 Allowed 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 122.251 1.967 . . . . 0.0 114.556 -168.02 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1053 ' ' HIS . . . . . 0.626 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 33.5 t-80 . . . . . 0 N--CA 1.467 0.407 0 CA-C-N 115.417 -0.81 . . . . 0.0 108.932 169.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.749 0 N-CA-C 111.991 -0.444 . . . . 0.0 111.991 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 909' ' ' SER . . . . . 0.583 ' N ' ' HD2' ' A' ' 910' ' ' PRO . 14.1 m -52.66 -49.38 86.54 Favored Pre-proline 0 CA--C 1.538 0.494 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -177.151 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 910' ' ' PRO . . . . . 0.583 ' HD2' ' N ' ' A' ' 909' ' ' SER . 6.3 Cg_exo -39.7 -43.73 3.22 Favored 'Trans proline' 0 C--N 1.366 1.461 0 C-N-CA 123.616 2.877 . . . . 0.0 113.776 179.068 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . 151.36 72.22 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.013 -1.089 . . . . 0.0 113.614 176.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 30.1 pt -80.29 -13.67 13.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.323 0.582 . . . . 0.0 109.946 173.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 19.1 p -145.78 103.98 3.82 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.957 178.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . -152.67 -82.36 0.04 OUTLIER Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.83 -0.7 . . . . 0.0 111.91 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . -73.79 -59.79 3.91 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.691 -0.766 . . . . 0.0 111.623 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . 134.07 -81.8 0.3 Allowed Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.212 178.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . -176.93 -137.98 2.82 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 121.09 -0.576 . . . . 0.0 112.041 -179.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . 0.584 ' HA2' HD12 ' A' 1044 ' ' LEU . . . 82.05 144.86 4.93 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 121.017 -0.611 . . . . 0.0 111.639 -177.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 919' ' ' ILE . . . . . 0.481 ' HA ' ' HB3' ' A' 1040 ' ' ASP . 0.2 OUTLIER -73.54 99.68 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.409 -2.488 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 178.695 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.454 ' H ' ' CG ' ' A' 1040 ' ' ASP . 47.2 ttt180 -177.26 -35.67 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.341 -166.732 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 20.4 m -69.01 106.82 2.9 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.002 -172.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.447 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 7.0 t30 -63.58 -45.76 88.93 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.306 -177.096 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.714 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 8.5 m-20 48.2 176.74 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 175.384 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.48 ' HB2' HG21 ' A' ' 968' ' ' THR . 27.8 mmtp -56.04 -21.19 20.27 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.105 -1.407 . . . . 0.0 112.605 178.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.871 ' HA ' HD22 ' A' ' 928' ' ' ASN . 16.3 m -65.87 -28.76 44.86 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.394 0 CA-C-O 120.96 0.41 . . . . 0.0 110.575 178.237 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.714 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.1 OUTLIER -78.71 -31.76 46.64 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.814 172.326 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -77.08 -24.14 51.89 Favored 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 118.837 -1.145 . . . . 0.0 113.528 -177.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.871 HD22 ' HA ' ' A' ' 925' ' ' VAL . 8.8 p30 -70.75 -45.8 64.14 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 118.388 -1.325 . . . . 0.0 109.106 166.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.681 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 98.3 t -53.04 -33.84 20.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 N-CA-C 113.809 1.041 . . . . 0.0 113.809 171.031 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 930' ' ' THR . . . . . . . . . . . . . 33.1 m -62.05 -43.42 98.88 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 119.884 1.22 . . . . 0.0 108.836 174.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -67.8 -51.73 33.49 Favored Glycine 0 CA--C 1.53 1.025 0 CA-C-N 114.65 -1.159 . . . . 0.0 113.574 175.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.681 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.8 pp -65.66 -49.13 69.76 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -174.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.457 HG23 HG11 ' A' ' 929' ' ' VAL . 53.3 t -65.89 -37.97 81.07 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.417 0 CA-C-O 121.101 0.477 . . . . 0.0 110.466 -176.007 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.558 ' HD2' ' C ' ' A' ' 934' ' ' LYS . 4.1 tmmm? -58.51 -41.01 84.44 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.99 178.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -67.45 -31.69 72.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.804 0.335 . . . . 0.0 111.498 -179.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.74 HG22 ' HB1' ' A' 1025 ' ' ALA . 80.2 t -54.45 -65.92 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.052 178.502 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 25.6 pt -70.24 -39.33 76.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.414 -178.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.42 ' HG2' ' HD3' ' A' ' 942' ' ' LYS . 40.1 tt0 -65.51 -52.21 54.34 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 120.194 -0.602 . . . . 0.0 110.451 -173.577 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.498 ' HB3' ' OE2' ' A' ' 949' ' ' GLU . 1.4 mpt? -70.52 -24.97 62.92 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.462 -176.286 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.543 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 28.7 p -58.63 -39.0 79.26 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.737 -171.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 941' ' ' SER . . . . . 0.551 ' HA ' ' HG3' ' A' ' 944' ' ' GLN . 17.1 p -98.11 -8.78 26.98 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.561 -178.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.42 ' HD3' ' HG2' ' A' ' 938' ' ' GLU . 22.0 mtpp -81.78 -9.86 59.51 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 175.437 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.92 HG12 ' HG2' ' A' 1018 ' ' LYS . 2.5 pp -87.9 -9.73 10.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 C-N-CA 120.477 -0.489 . . . . 0.0 111.719 169.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.551 ' HG3' ' HA ' ' A' ' 941' ' ' SER . 40.2 mt-30 -63.56 -48.58 80.63 Favored Pre-proline 0 CA--C 1.531 0.235 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.087 178.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -65.22 118.36 5.37 Favored 'Trans proline' 0 C--N 1.351 0.705 0 N-CA-C 107.216 -1.879 . . . . 0.0 107.216 156.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . . . . . . . . . . . -107.95 65.3 0.25 Allowed Pre-proline 0 CA--C 1.535 0.383 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 -160.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -87.71 128.62 2.47 Favored 'Trans proline' 0 N--CA 1.449 -1.132 0 C-N-CA 121.774 1.649 . . . . 0.0 108.005 149.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.607 ' HA ' HG23 ' A' 1009 ' ' VAL . 38.8 Cg_exo -49.95 117.93 3.46 Favored 'Trans proline' 0 CA--C 1.513 -0.527 0 C-N-CA 121.98 1.787 . . . . 0.0 112.801 -172.155 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 0.585 ' C ' ' H ' ' A' ' 951' ' ' TYR . 30.3 tt0 -59.68 -22.27 61.72 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 172.798 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.63 ' HB2' ' HG2' ' A' ' 953' ' ' PRO . 35.0 mt-10 71.88 -14.77 0.49 Allowed 'General case' 0 C--N 1.344 0.357 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.799 -173.493 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.808 ' HE1' HG21 ' A' ' 943' ' ' ILE . 30.9 m-85 55.13 -42.94 0.02 OUTLIER 'General case' 0 C--O 1.217 -0.617 0 C-N-CA 125.309 1.444 . . . . 0.0 114.544 175.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 0.588 ' HA ' ' CG2' ' A' ' 955' ' ' VAL . 46.9 t -53.15 -45.38 98.3 Favored Pre-proline 0 C--N 1.319 -0.737 0 C-N-CA 122.944 0.497 . . . . 0.0 111.256 170.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 0.63 ' HG2' ' HB2' ' A' ' 950' ' ' GLU . 48.8 Cg_exo -51.53 -38.31 64.32 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 122.071 1.847 . . . . 0.0 112.078 172.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.429 ' O ' HG11 ' A' ' 958' ' ' VAL . 7.0 tpt -77.45 -32.48 54.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.076 -0.966 . . . . 0.0 110.644 175.624 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.635 HG22 ' SD ' ' A' 1002 ' ' MET . 88.9 t -52.92 -38.71 29.42 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 167.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.537 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 12.4 tmtt? -66.87 -35.48 80.11 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.451 175.346 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -78.66 -46.79 18.36 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -177.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.526 ' O ' ' HG ' ' A' ' 962' ' ' LEU . 11.2 p -83.58 -30.36 7.92 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.365 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.299 -178.311 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -61.09 -38.89 96.31 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 110.617 -0.993 . . . . 0.0 110.617 174.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . 0.568 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 9.4 tt -70.15 -36.41 74.72 Favored 'General case' 0 C--O 1.223 -0.296 0 CA-C-O 120.935 0.397 . . . . 0.0 110.146 177.297 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.571 ' O ' ' HB2' ' A' ' 928' ' ' ASN . . . -72.68 -42.56 64.12 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.152 0.501 . . . . 0.0 111.523 -176.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 1.034 HD12 HD23 ' A' ' 995' ' ' LEU . 4.1 pp -81.5 -24.63 36.57 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.466 -179.167 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.568 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 4.9 ptp180 -73.73 -31.04 63.18 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 119.159 -1.017 . . . . 0.0 109.934 168.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 93.1 m -62.86 -32.52 73.77 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 174.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.97 HD22 HD21 ' A' ' 991' ' ' LEU . 63.5 tp -65.46 -55.66 16.7 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.235 174.055 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.516 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 9.5 tt -55.54 -41.18 72.86 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 114.199 -1.364 . . . . 0.0 109.901 -175.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -72.43 -36.74 68.65 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.289 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.48 HG21 ' HB2' ' A' ' 924' ' ' LYS . 22.2 m -66.29 -42.04 88.95 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.446 176.203 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.702 HG12 HG21 ' A' ' 984' ' ' ILE . 18.0 t -73.22 -33.55 41.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.929 178.412 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.847 ' HB2' HE22 ' A' ' 988' ' ' GLN . 7.6 t70 -68.16 -42.46 80.02 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 122.087 0.946 . . . . 0.0 108.815 178.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.644 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 31.9 tt0 -69.82 -29.86 67.23 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-N 114.082 -1.417 . . . . 0.0 109.874 178.114 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 73.2 m -67.21 -17.66 64.91 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.664 174.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.702 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 10.2 tt -68.64 -51.69 21.14 Favored Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 121.064 -0.254 . . . . 0.0 110.39 -178.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.702 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 2.6 Cg_endo -84.95 -27.62 1.16 Allowed 'Trans proline' 0 C--N 1.359 1.08 0 C-N-CA 121.771 1.647 . . . . 0.0 114.206 174.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . . . . . . . . . 52.3 t -73.33 -40.69 57.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 O-C-N 122.155 -0.341 . . . . 0.0 111.376 -177.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.8 ' HB3' ' HD2' ' A' ' 977' ' ' PRO . 90.5 mt -82.2 178.92 2.15 Favored Pre-proline 0 C--N 1.325 -0.473 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 176.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . 0.8 ' HD2' ' HB3' ' A' ' 976' ' ' LEU . 4.6 Cg_exo -41.34 127.38 3.06 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 122.692 2.261 . . . . 0.0 111.775 173.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -56.04 -36.51 68.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.632 -0.713 . . . . 0.0 112.29 -169.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.592 ' HB2' ' SD ' ' A' 1046 ' ' MET . 10.7 m -87.07 3.18 47.16 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 -175.349 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.639 HG21 ' HB3' ' A' 1042 ' ' ALA . 74.7 m -74.4 -10.33 59.47 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.595 0.712 . . . . 0.0 109.184 170.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.572 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 1.7 p80 -48.88 -35.28 14.4 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 114.214 -1.357 . . . . 0.0 114.563 -174.367 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 3.8 ptp180 -78.96 -19.33 51.96 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 118.867 0.758 . . . . 0.0 111.062 -169.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.531 ' HG2' ' HB1' ' A' 1042 ' ' ALA . 0.0 OUTLIER -76.52 -37.94 55.93 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 120.401 -0.52 . . . . 0.0 109.865 171.928 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.792 HG13 HG12 ' A' 1039 ' ' ILE . 3.6 mp -66.51 -35.75 75.63 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.486 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 175.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . 0.572 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 40.5 mt-10 -56.99 -52.88 63.51 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.598 178.428 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 89.9 mtp -70.57 -39.88 73.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.478 -174.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.982 ' HB3' ' HB2' ' A' 1035 ' ' LEU . . . -76.9 -52.41 9.5 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.868 -1.06 . . . . 0.0 112.792 -169.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.847 HE22 ' HB2' ' A' ' 970' ' ' ASP . 3.7 pt20 -64.32 -24.88 67.8 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 121.6 0.714 . . . . 0.0 109.498 179.32 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . 0.794 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 31.7 tttm -73.39 -38.87 65.49 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.748 -1.115 . . . . 0.0 111.742 172.558 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.486 ' HG ' ' OD2' ' A' 1031 ' ' ASP . 17.1 tp -57.39 -58.27 9.02 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.423 -0.511 . . . . 0.0 112.275 178.277 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.97 HD21 HD22 ' A' ' 965' ' ' LEU . 13.6 tp -55.03 -34.45 63.52 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-O 121.365 0.602 . . . . 0.0 110.085 175.784 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . 0.794 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 24.7 t-20 -48.47 -53.21 18.8 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.197 -1.365 . . . . 0.0 111.606 -178.163 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 6.5 p -77.6 -29.95 52.2 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 120.591 -0.443 . . . . 0.0 112.131 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . 0.443 ' O ' ' HB2' ' A' ' 997' ' ' GLU . 0.9 OUTLIER -69.76 -39.04 76.95 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 119.646 -0.822 . . . . 0.0 110.741 -179.866 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 1.034 HD23 HD12 ' A' ' 962' ' ' LEU . 2.2 pp -68.41 -17.44 64.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.7 171.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -78.43 -24.38 46.18 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 119.523 -0.871 . . . . 0.0 110.259 168.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.64 ' O ' ' HG2' ' A' 1001 ' ' LYS . 71.6 mm-40 -72.08 -45.99 58.55 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 172.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.693 HD22 HD12 ' A' 1028 ' ' LEU . 0.2 OUTLIER -56.03 -46.76 78.74 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.752 -178.147 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.751 ' HA ' ' SD ' ' A' 1002 ' ' MET . 84.1 mt -66.99 -36.8 78.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.428 -173.392 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 19.9 m-80 -64.05 -35.36 80.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.124 0.488 . . . . 0.0 111.5 177.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.64 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 44.7 mmtm -77.4 -45.28 26.38 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.78 0.8 . . . . 0.0 109.792 -174.258 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.985 ' HB3' ' HG3' ' A' 1021 ' ' MET . 7.1 ptm -63.76 -25.92 68.41 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 122.165 0.983 . . . . 0.0 108.973 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.617 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 9.4 tptm -69.55 -52.66 24.26 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.439 -167.446 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.779 HD12 ' HG3' ' A' 1007 ' ' GLN . 4.0 mm? -75.33 -12.59 60.3 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.483 -0.781 . . . . 0.0 111.592 179.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1005 ' ' ALA . . . . . 0.732 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -71.96 -37.78 69.87 Favored 'General case' 0 C--O 1.213 -0.828 0 C-N-CA 119.389 -0.924 . . . . 0.0 110.52 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.681 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.4 pp0? -76.3 -30.69 57.85 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 119.105 -0.474 . . . . 0.0 110.984 173.132 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.779 ' HG3' HD12 ' A' 1004 ' ' LEU . 17.2 mm-40 -48.3 -49.28 34.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.393 0.616 . . . . 0.0 109.989 175.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.547 ' HB2' HD12 ' A' 1013 ' ' LEU . 68.7 m-85 -129.09 55.04 1.76 Allowed 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 121.483 0.659 . . . . 0.0 110.419 170.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 1.019 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 4.7 p -56.51 -25.54 21.15 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.527 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.786 168.155 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 59.8 mtt -74.01 1.32 11.21 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 114.818 -1.083 . . . . 0.0 111.081 176.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1011 ' ' THR . . . . . 0.598 HG21 ' H ' ' A' 1012 ' ' SER . 0.2 OUTLIER -151.63 -154.77 0.56 Allowed 'General case' 0 C--O 1.26 1.606 0 CA-C-O 122.9 1.333 . . . . 0.0 114.043 -176.357 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A 1012 ' ' SER . . . . . 0.598 ' H ' HG21 ' A' 1011 ' ' THR . 15.1 m -59.06 -43.84 91.77 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 113.902 -1.499 . . . . 0.0 112.376 -170.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.676 ' O ' ' HB2' ' A' 1017 ' ' TYR . 13.2 mt -48.6 -43.23 35.94 Favored 'General case' 0 CA--C 1.494 -1.183 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.888 178.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 1.019 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.72 -54.08 46.56 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-O 121.521 0.677 . . . . 0.0 109.798 -171.374 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -67.01 -44.94 79.02 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 114.283 -1.326 . . . . 0.0 110.825 -174.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -65.67 -56.21 13.37 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.296 0.569 . . . . 0.0 111.799 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.732 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 6.7 m-85 -62.02 -34.52 76.37 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.988 -1.005 . . . . 0.0 113.149 -172.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.92 ' HG2' HG12 ' A' ' 943' ' ' ILE . 55.6 tptt -80.61 -30.72 36.77 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.74 -176.683 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -73.0 -49.79 26.88 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 174.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -54.65 -30.54 55.5 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 114.999 -1.001 . . . . 0.0 110.782 165.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.985 ' HG3' ' HB3' ' A' 1002 ' ' MET . 2.5 ttp -68.95 -48.16 63.89 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 175.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1022 ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' 1022 ' ' LEU . 0.0 OUTLIER -79.13 -12.28 59.99 Favored 'General case' 0 C--O 1.216 -0.702 0 C-N-CA 119.835 -0.746 . . . . 0.0 109.977 -177.016 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 97.8 m -84.45 -36.07 22.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.111 175.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.513 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.73 -22.08 47.09 Favored 'General case' 0 C--O 1.222 -0.369 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 171.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.74 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -84.92 -21.98 29.45 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.877 -0.602 . . . . 0.0 109.887 169.069 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.523 ' O ' HG21 ' A' 1030 ' ' VAL . 8.5 t60 -76.0 -27.18 57.32 Favored 'General case' 0 C--O 1.217 -0.624 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 165.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1027 ' ' ALA . . . . . 0.44 ' HB2' ' O ' ' A' 1024 ' ' ALA . . . -69.27 -39.94 78.09 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 123.355 0.662 . . . . 0.0 110.09 164.045 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.693 HD12 HD22 ' A' ' 998' ' ' LEU . 26.0 mt -61.3 -44.61 96.92 Favored 'General case' 0 C--N 1.315 -0.921 0 C-N-CA 120.353 -0.539 . . . . 0.0 109.615 170.427 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -59.09 -40.28 84.81 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.529 0.204 . . . . 0.0 111.476 173.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.523 HG21 ' O ' ' A' 1026 ' ' HIS . 9.5 t -69.11 -46.31 78.41 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 CA-C-O 121.7 0.762 . . . . 0.0 110.179 -178.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.486 ' OD2' ' HG ' ' A' ' 990' ' ' LEU . 5.5 t70 -71.84 -42.54 66.81 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 114.339 -1.301 . . . . 0.0 110.187 -174.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.574 ' HB2' HG22 ' A' ' 929' ' ' VAL . . . -59.98 -36.27 76.8 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 174.309 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 36.4 tttm -66.14 -55.01 18.52 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.631 0.729 . . . . 0.0 110.001 173.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.458 ' O ' ' HB3' ' A' 1037 ' ' ASP . 9.6 t30 -64.91 -48.66 73.38 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 114.587 -1.188 . . . . 0.0 112.552 -172.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.982 ' HB2' ' HB3' ' A' ' 987' ' ' ALA . 2.0 pp -63.99 -40.67 96.89 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 119.401 -0.333 . . . . 0.0 110.108 -176.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.63 HD21 HG22 ' A' ' 925' ' ' VAL . 4.0 pp -70.59 -33.68 71.33 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 117.232 -1.787 . . . . 0.0 109.618 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.458 ' HB3' ' O ' ' A' 1034 ' ' ASN . 18.3 t70 -58.25 -44.36 88.27 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.654 173.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.442 ' HB ' ' O ' ' A' 1035 ' ' LEU . 24.8 t -55.09 -39.38 50.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 113.708 -1.587 . . . . 0.0 111.269 174.284 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.792 HG12 HG13 ' A' ' 984' ' ' ILE . 1.7 mp -80.45 -33.13 13.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.374 176.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.481 ' HB3' ' HA ' ' A' ' 919' ' ' ILE . 0.4 OUTLIER -55.61 -44.26 76.85 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 121.536 0.684 . . . . 0.0 109.482 170.874 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -70.06 -39.22 75.81 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.058 174.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.639 ' HB3' HG21 ' A' ' 980' ' ' THR . . . -55.62 -52.51 63.55 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -177.414 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.668 ' HG2' ' O ' ' A' 1039 ' ' ILE . 5.7 ptm180 -66.1 -41.14 91.02 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 -176.379 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.584 HD12 ' HA2' ' A' ' 918' ' ' GLY . 44.5 tp -61.71 -43.73 98.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.987 -0.552 . . . . 0.0 109.895 174.225 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.703 ' O ' ' HB2' ' A' 1049 ' ' GLN . 50.4 mtpt -67.15 -22.37 65.78 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.13 -177.529 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.876 ' HA ' ' HE3' ' A' 1046 ' ' MET . 2.6 mmt -93.52 -24.29 18.04 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 172.019 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.582 HD13 ' HG3' ' A' ' 977' ' ' PRO . 44.6 mm -91.97 -64.58 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.895 0.379 . . . . 0.0 110.659 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1048 ' ' SER . . . . . 0.538 ' HB3' ' NE2' ' A' 1049 ' ' GLN . 9.8 t -59.94 -34.37 73.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.654 0.74 . . . . 0.0 110.611 -179.611 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1049 ' ' GLN . . . . . 0.703 ' HB2' ' O ' ' A' 1045 ' ' LYS . 1.4 mp0 -96.12 155.4 16.77 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.543 -174.401 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 16.1 m -118.61 11.54 12.86 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.507 177.118 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1051 ' ' ARG . . . . . 0.735 ' HB3' ' HD3' ' A' 1052 ' ' PRO . 12.3 ttm180 -165.04 -54.35 0.01 OUTLIER Pre-proline 0 CA--C 1.538 0.496 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -178.068 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1052 ' ' PRO . . . . . 0.735 ' HD3' ' HB3' ' A' 1051 ' ' ARG . 31.6 Cg_exo -61.33 87.34 0.09 OUTLIER 'Trans proline' 0 C--N 1.359 1.108 0 C-N-CA 122.751 2.301 . . . . 0.0 113.822 -179.572 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1053 ' ' HIS . . . . . 0.722 ' HB3' ' HE1' ' A' 1046 ' ' MET . 35.5 t-80 . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.359 172.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.82 0 N-CA-C 111.813 -0.515 . . . . 0.0 111.813 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 4.9 p -158.49 107.9 1.66 Allowed Pre-proline 0 C--N 1.324 -0.519 0 CA-C-O 120.643 0.258 . . . . 0.0 110.747 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -65.64 -19.44 59.98 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 123.469 2.78 . . . . 0.0 113.132 -176.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -69.66 -21.99 76.56 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.976 -0.63 . . . . 0.0 112.587 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 47.0 mm -72.96 129.9 35.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 120.596 0.236 . . . . 0.0 110.452 -179.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 44.1 m -56.76 113.11 1.51 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.348 0.594 . . . . 0.0 111.225 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 119.74 -25.07 7.74 Favored Glycine 0 N--CA 1.444 -0.773 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.712 -178.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 98.3 -29.32 11.59 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.484 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . 134.88 -148.33 19.5 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 121.067 -0.587 . . . . 0.0 111.806 179.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . 99.74 -172.06 24.47 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.206 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . 101.2 -130.57 10.27 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.296 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 919' ' ' ILE . . . . . 0.656 ' HA ' ' HB3' ' A' 1040 ' ' ASP . 0.1 OUTLIER -75.77 127.01 37.12 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.835 0 C-N-CA 123.217 0.607 . . . . 0.0 110.0 -177.009 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 920' ' ' ARG . 14.7 ptt180 -163.69 -15.69 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 -178.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 25.7 p -153.37 101.16 2.5 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 119.548 -0.861 . . . . 0.0 112.561 -172.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.591 ' CG ' HD12 ' A' 1036 ' ' LEU . 1.4 p-10 -138.88 133.7 32.3 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.222 177.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.418 ' O ' ' CD1' ' A' ' 926' ' ' TYR . 7.3 m-20 -103.12 -75.64 0.6 Allowed 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -177.053 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.705 ' HB2' HG23 ' A' ' 968' ' ' THR . 0.0 OUTLIER -70.52 -53.52 15.85 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 114.444 1.276 . . . . 0.0 114.444 -170.5 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.689 ' H ' ' HD2' ' A' ' 924' ' ' LYS . 4.1 t -53.62 -40.57 42.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 CA-C-N 119.148 0.886 . . . . 0.0 111.895 -169.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.418 ' CD1' ' O ' ' A' ' 923' ' ' ASP . 0.7 OUTLIER -80.03 -20.94 44.17 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.084 -179.777 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 924' ' ' LYS . 9.3 pt-20 -76.71 -24.17 53.11 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 120.173 1.351 . . . . 0.0 109.542 169.286 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.535 ' OD1' ' HA ' ' A' ' 925' ' ' VAL . 1.1 m120 -68.57 -29.7 68.31 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 170.601 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.67 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 44.3 t -80.5 -30.24 12.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 114.726 -1.125 . . . . 0.0 109.841 175.258 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.453 ' OG1' ' HA ' ' A' ' 927' ' ' GLU . 31.1 m -57.36 -43.4 83.47 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 168.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -66.55 -52.35 35.43 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-N 114.518 -1.219 . . . . 0.0 114.106 176.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.67 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.2 pp -65.29 -49.32 69.96 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -175.269 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.45 HG23 ' CB ' ' A' 1029 ' ' ALA . 76.7 t -62.1 -42.17 94.0 Favored 'Isoleucine or valine' 0 C--O 1.242 0.68 0 CA-C-O 121.399 0.619 . . . . 0.0 110.312 -176.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.477 ' O ' ' HB2' ' A' ' 938' ' ' GLU . 4.7 tmmm? -58.52 -39.04 79.02 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.612 -1.176 . . . . 0.0 109.906 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.546 ' HA ' ' SD ' ' A' ' 939' ' ' MET . . . -66.75 -35.41 80.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.569 0.223 . . . . 0.0 111.169 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.598 HG22 ' HB1' ' A' 1025 ' ' ALA . 59.8 t -53.24 -77.12 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.687 -179.513 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.509 ' O ' ' HB2' ' A' ' 940' ' ' SER . 27.1 pt -67.43 -42.57 87.4 Favored 'Isoleucine or valine' 0 C--O 1.249 1.062 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -174.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.477 ' HB2' ' O ' ' A' ' 934' ' ' LYS . 7.5 mm-40 -66.49 -46.5 76.1 Favored 'General case' 0 C--N 1.315 -0.929 0 C-N-CA 120.932 -0.307 . . . . 0.0 110.928 -170.149 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.546 ' SD ' ' HA ' ' A' ' 935' ' ' ALA . 1.0 OUTLIER -69.84 -28.33 65.6 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.174 178.032 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.749 ' HA ' ' NZ ' ' A' 1018 ' ' LYS . 4.6 m -51.79 -45.02 63.66 Favored 'General case' 0 CA--C 1.514 -0.434 0 O-C-N 123.542 0.526 . . . . 0.0 112.355 -171.788 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 18.1 m -106.63 -22.5 12.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.109 -177.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.436 ' C ' ' HD3' ' A' ' 942' ' ' LYS . 7.6 tmtm? -84.01 -58.72 2.66 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 119.445 -0.902 . . . . 0.0 110.87 -169.287 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.861 HG22 ' HG2' ' A' ' 949' ' ' GLU . 10.5 tp -77.81 0.92 2.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 121.163 0.506 . . . . 0.0 110.62 -178.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.536 ' HB2' ' OE2' ' A' ' 949' ' ' GLU . 18.3 tt0 -106.41 77.56 0.47 Allowed Pre-proline 0 CA--C 1.541 0.608 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.469 176.473 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.658 ' HD3' ' O ' ' A' ' 943' ' ' ILE . 11.3 Cg_endo -93.84 -69.26 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 123.157 2.571 . . . . 0.0 111.845 177.392 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.753 ' H ' ' HD2' ' A' ' 947' ' ' PRO . . . -135.92 -48.31 0.02 OUTLIER Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.031 176.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.753 ' HD2' ' H ' ' A' ' 946' ' ' ALA . 60.6 Cg_endo -73.35 162.36 40.51 Favored 'Trans proline' 0 C--N 1.356 0.941 0 C-N-CA 121.852 1.701 . . . . 0.0 111.114 169.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.592 ' HA ' HG23 ' A' 1009 ' ' VAL . 29.9 Cg_endo -64.04 155.79 62.55 Favored 'Trans proline' 0 N--CA 1.464 -0.244 0 C-N-CA 122.183 1.922 . . . . 0.0 112.597 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 0.861 ' HG2' HG22 ' A' ' 943' ' ' ILE . 51.1 mt-10 -74.99 7.11 3.45 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.331 178.43 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.632 ' HB3' ' HG2' ' A' ' 953' ' ' PRO . 1.0 OUTLIER 50.09 64.37 1.81 Allowed 'General case' 0 N--CA 1.44 -0.964 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -163.899 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 1.013 ' HB3' ' HG3' ' A' 1002 ' ' MET . 16.5 m-85 -52.62 -51.75 58.61 Favored 'General case' 0 C--O 1.214 -0.79 0 CA-C-N 114.557 -1.201 . . . . 0.0 113.175 -174.398 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 0.791 ' O ' HG13 ' A' ' 955' ' ' VAL . 66.6 t -53.82 -54.06 50.81 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 117.949 0.34 . . . . 0.0 111.142 174.079 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 0.687 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 12.8 Cg_exo -48.3 -43.82 30.88 Favored 'Trans proline' 0 CA--C 1.545 1.071 0 C-N-CA 121.703 1.602 . . . . 0.0 113.413 170.588 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.492 ' HE2' ' HB2' ' A' ' 935' ' ' ALA . 5.2 tpt -71.12 -48.21 53.56 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.547 0.739 . . . . 0.0 112.023 -179.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.791 HG13 ' O ' ' A' ' 952' ' ' VAL . 0.3 OUTLIER -54.27 -29.65 19.8 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.772 169.059 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.53 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 9.5 tmtt? -68.64 -31.61 70.87 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.585 0.231 . . . . 0.0 111.296 169.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . 0.671 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 18.6 mm-40 -77.76 -44.69 26.84 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.395 0.617 . . . . 0.0 110.247 -176.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.416 HG12 ' HA ' ' A' ' 955' ' ' VAL . 7.3 p -77.01 -27.38 16.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.283 178.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . 0.515 ' HA2' HD12 ' A' ' 995' ' ' LEU . . . -65.44 -34.96 90.69 Favored Glycine 0 N--CA 1.448 -0.529 0 N-CA-C 110.293 -1.123 . . . . 0.0 110.293 170.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . 0.559 HD12 ' HD3' ' A' ' 963' ' ' ARG . 25.8 tp -63.67 -32.66 74.21 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.022 -0.589 . . . . 0.0 110.526 174.405 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.441 ' HB3' ' HB3' ' A' ' 932' ' ' LEU . . . -75.58 -58.19 3.43 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 121.137 -0.225 . . . . 0.0 110.612 -178.324 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.597 HD13 HD13 ' A' ' 991' ' ' LEU . 0.4 OUTLIER -42.82 -50.7 5.64 Favored 'General case' 0 C--O 1.212 -0.918 0 N-CA-C 112.748 0.648 . . . . 0.0 112.748 168.827 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.559 ' HD3' HD12 ' A' ' 960' ' ' LEU . 3.5 ptm180 -65.82 -28.51 69.04 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 119.654 1.116 . . . . 0.0 110.745 -177.626 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 38.8 m -68.78 -39.26 80.28 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 173.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.525 HD22 HD22 ' A' 1035 ' ' LEU . 0.1 OUTLIER -66.36 -38.96 88.79 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.389 -1.278 . . . . 0.0 110.66 177.287 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.821 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 9.9 tt -76.48 -38.79 54.76 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 115.415 -0.811 . . . . 0.0 108.92 -172.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -71.13 -31.66 68.0 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.304 177.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.705 HG23 ' HB2' ' A' ' 924' ' ' LYS . 11.8 p -68.77 -39.98 79.94 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 118.654 0.661 . . . . 0.0 110.29 175.289 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.865 HG13 HG22 ' A' ' 984' ' ' ILE . 97.7 t -71.14 -40.73 75.38 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.045 173.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.808 ' HB2' HE22 ' A' ' 988' ' ' GLN . 19.4 t70 -64.79 -42.98 94.62 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 122.003 0.906 . . . . 0.0 108.691 -179.103 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.687 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 11.2 tp10 -61.48 -38.13 86.16 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 114.032 -1.44 . . . . 0.0 109.415 177.123 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.711 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 58.8 m -64.42 -18.94 65.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.772 179.053 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.844 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 8.8 tt -66.89 -53.24 27.77 Favored Pre-proline 0 CA--C 1.536 0.434 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 -179.618 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.844 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 4.8 Cg_exo -80.83 -17.61 9.54 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 121.71 1.606 . . . . 0.0 113.78 172.063 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.711 ' HB ' ' HA ' ' A' ' 972' ' ' SER . 3.5 t -57.99 -67.67 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -178.14 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.658 ' HB2' ' HD3' ' A' ' 977' ' ' PRO . 64.7 mt -145.79 -59.27 0.02 OUTLIER Pre-proline 0 N--CA 1.468 0.436 0 C-N-CA 119.067 -1.053 . . . . 0.0 113.238 -172.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . 0.658 ' HD3' ' HB2' ' A' ' 976' ' ' LEU . 51.5 Cg_exo -54.61 99.37 0.06 OUTLIER 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.399 2.066 . . . . 0.0 113.446 -171.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . 0.507 ' C ' ' H ' ' A' ' 980' ' ' THR . . . -75.34 128.11 34.65 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.796 -178.434 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.494 ' HB2' ' SD ' ' A' 1046 ' ' MET . 20.1 m 62.45 -0.22 0.55 Allowed 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.973 -177.238 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.674 HG23 ' CB ' ' A' 1042 ' ' ALA . 67.4 m -73.12 -14.67 61.43 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 165.515 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.496 ' HA ' HD13 ' A' ' 984' ' ' ILE . 2.0 p-80 -52.04 -23.33 5.07 Favored 'General case' 0 C--O 1.216 -0.669 0 CA-C-N 113.971 -1.468 . . . . 0.0 113.403 179.03 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -82.56 -21.42 35.3 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 119.081 0.855 . . . . 0.0 110.755 178.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.636 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 0.2 OUTLIER -78.63 -33.98 46.87 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 168.454 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.865 HG22 HG13 ' A' ' 969' ' ' VAL . 53.5 mt -70.15 -30.65 44.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 114.766 -1.106 . . . . 0.0 108.055 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . 0.527 ' O ' ' HG3' ' A' ' 989' ' ' LYS . 9.6 mm-40 -64.1 -55.35 22.67 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.783 174.417 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 65.3 mtt -71.11 -44.78 64.95 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.131 -0.94 . . . . 0.0 111.619 -168.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.987 ' HB2' ' HB2' ' A' 1035 ' ' LEU . . . -66.6 -49.38 66.49 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.069 -0.968 . . . . 0.0 112.288 -173.352 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.821 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 3.2 pt20 -61.76 -29.92 70.45 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 119.817 -0.753 . . . . 0.0 111.26 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . 0.745 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 50.9 mttm -70.5 -39.16 74.31 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.616 0.722 . . . . 0.0 111.396 174.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.598 HD21 ' HB3' ' A' 1035 ' ' LEU . 15.8 tp -49.94 -60.49 2.87 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.447 -178.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.719 HD22 ' HA ' ' A' 1028 ' ' LEU . 0.3 OUTLIER -67.99 -28.55 67.53 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.522 0.677 . . . . 0.0 109.788 -179.885 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . 0.745 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 22.7 t-20 -52.27 -55.44 21.31 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.346 -1.297 . . . . 0.0 111.023 178.278 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 30.8 t -76.41 -34.75 58.82 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.383 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . 0.45 ' O ' ' HB3' ' A' ' 997' ' ' GLU . 0.7 OUTLIER -65.27 -37.04 85.97 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.6 -0.44 . . . . 0.0 112.162 179.306 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 1.052 ' HG ' HD23 ' A' ' 998' ' ' LEU . 6.8 tt -72.0 -17.49 62.04 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 122.32 -0.238 . . . . 0.0 110.546 172.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -72.8 -25.73 61.25 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 119.446 -0.901 . . . . 0.0 110.032 166.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.45 ' HB3' ' O ' ' A' ' 994' ' ' ASP . 12.1 tp10 -74.97 -38.4 61.68 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 173.371 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 1.052 HD23 ' HG ' ' A' ' 995' ' ' LEU . 0.1 OUTLIER -56.38 -46.39 80.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.039 178.629 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.583 ' O ' ' HB2' ' A' 1003 ' ' LYS . 76.2 mt -60.7 -46.11 96.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.679 -175.429 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -58.04 -39.87 79.49 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -175.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.559 ' O ' ' HB3' ' A' 1017 ' ' TYR . 32.7 mmtp -84.15 -37.05 22.42 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.721 0.772 . . . . 0.0 110.119 -175.551 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1002 ' ' MET . . . . . 1.013 ' HG3' ' HB3' ' A' ' 951' ' ' TYR . 34.3 tpp -57.97 -32.54 67.96 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.731 -1.122 . . . . 0.0 108.821 172.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.583 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 13.4 tptp -70.39 -53.7 15.46 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 113.808 -1.542 . . . . 0.0 111.369 -167.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.635 HD12 ' HG3' ' A' 1007 ' ' GLN . 4.1 mm? -76.9 -13.16 60.02 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.681 -177.383 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1005 ' ' ALA . . . . . 0.593 ' HB1' ' HB3' ' A' 1017 ' ' TYR . . . -68.45 -47.98 65.73 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 119.664 -0.814 . . . . 0.0 109.762 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.941 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 8.4 pt20 -70.87 -36.16 72.69 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 119.941 -0.704 . . . . 0.0 111.898 171.486 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.635 ' HG3' HD12 ' A' 1004 ' ' LEU . 12.4 mm100 -43.13 -51.55 5.86 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.108 0.48 . . . . 0.0 110.734 177.086 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.667 ' HB2' ' HG ' ' A' 1013 ' ' LEU . 66.4 m-85 -123.71 52.3 1.45 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.52 0.676 . . . . 0.0 110.088 169.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 1.022 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 13.0 p -53.73 -18.05 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.423 0 CA-C-N 114.576 -1.193 . . . . 0.0 110.288 169.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1010 ' ' MET . . . . . 0.487 ' C ' ' HG1' ' A' 1011 ' ' THR . 16.4 ptp -62.31 81.17 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.078 166.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1011 ' ' THR . . . . . 0.487 ' HG1' ' C ' ' A' 1010 ' ' MET . 45.8 p 68.0 -89.08 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 126.231 1.812 . . . . 0.0 114.589 175.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 37.6 m -45.98 -79.38 0.01 OUTLIER 'General case' 0 C--O 1.241 0.638 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 -165.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.667 ' HG ' ' HB2' ' A' 1008 ' ' TYR . 13.3 mt -54.57 -35.17 63.02 Favored 'General case' 0 CA--C 1.501 -0.92 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 -174.784 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 1.022 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.39 -48.61 71.36 Favored 'General case' 0 N--CA 1.445 -0.718 0 O-C-N 123.646 0.591 . . . . 0.0 110.912 -167.78 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -75.17 -41.06 58.88 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.565 -176.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -72.64 -46.74 52.5 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.203 0.525 . . . . 0.0 111.042 -176.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.593 ' HB3' ' HB1' ' A' 1005 ' ' ALA . 6.9 m-85 -67.87 -36.5 80.39 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.48 -176.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 1.047 ' HE2' ' HE3' ' A' 1021 ' ' MET . 9.5 tptm -79.86 -26.61 40.3 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.587 -175.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -74.18 -42.16 60.3 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 174.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -57.34 -35.04 69.41 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.191 163.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1021 ' ' MET . . . . . 1.047 ' HE3' ' HE2' ' A' 1018 ' ' LYS . 6.6 tmm? -66.41 -53.6 33.94 Favored 'General case' 0 C--O 1.219 -0.505 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 -179.039 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1022 ' ' LEU . . . . . 0.462 ' O ' ' HG ' ' A' 1022 ' ' LEU . 0.0 OUTLIER -78.98 -8.53 58.99 Favored 'General case' 0 C--O 1.22 -0.46 0 C-N-CA 119.367 -0.933 . . . . 0.0 109.852 -171.472 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 82.6 m -88.15 -35.27 17.51 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.944 174.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.479 ' O ' ' HB2' ' A' 1027 ' ' ALA . . . -79.0 -22.72 45.12 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-O 121.222 0.534 . . . . 0.0 109.582 171.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.598 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -86.18 -23.92 26.33 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.927 170.213 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.517 ' O ' HG21 ' A' 1030 ' ' VAL . 63.8 t60 -75.96 -22.58 55.76 Favored 'General case' 0 C--O 1.214 -0.777 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 164.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1027 ' ' ALA . . . . . 0.479 ' HB2' ' O ' ' A' 1024 ' ' ALA . . . -73.2 -39.11 65.83 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 123.282 0.633 . . . . 0.0 109.386 165.231 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.719 ' HA ' HD22 ' A' ' 991' ' ' LEU . 14.4 mt -59.87 -48.15 82.85 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 168.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1029 ' ' ALA . . . . . 0.45 ' CB ' HG23 ' A' ' 933' ' ' VAL . . . -57.73 -42.72 84.44 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.867 -0.151 . . . . 0.0 111.358 175.234 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.517 HG21 ' O ' ' A' 1026 ' ' HIS . 8.0 t -69.19 -51.79 39.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.318 0.58 . . . . 0.0 110.877 -176.623 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.475 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 12.4 m-20 -77.15 -29.38 54.56 Favored 'General case' 0 C--O 1.214 -0.779 0 CA-C-N 115.338 -0.847 . . . . 0.0 112.661 -174.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.405 ' HA ' ' CD2' ' A' 1035 ' ' LEU . . . -70.32 -31.24 68.46 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 172.224 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.532 ' O ' ' HE2' ' A' 1033 ' ' LYS . 1.0 OUTLIER -63.83 -49.95 70.81 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 168.892 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.515 ' O ' ' HB3' ' A' 1037 ' ' ASP . 42.2 t30 -64.13 -53.94 41.66 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-N 113.921 -1.49 . . . . 0.0 112.474 -175.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.987 ' HB2' ' HB2' ' A' ' 987' ' ' ALA . 2.3 pp -60.47 -41.27 93.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 119.638 -0.22 . . . . 0.0 110.551 -172.242 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.591 HD12 ' CG ' ' A' ' 922' ' ' ASN . 1.0 OUTLIER -68.77 -43.95 74.69 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 117.974 -1.491 . . . . 0.0 109.142 179.12 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.515 ' HB3' ' O ' ' A' 1034 ' ' ASN . 12.1 t70 -49.28 -42.91 42.54 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 114.801 -1.091 . . . . 0.0 110.22 173.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.593 ' CG1' ' HG3' ' A' ' 983' ' ' GLU . 21.2 t -56.82 -48.7 80.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 113.488 -1.687 . . . . 0.0 111.966 176.064 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.733 ' O ' ' HG2' ' A' 1043 ' ' ARG . 2.0 mp -70.68 -31.48 46.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 118.761 0.709 . . . . 0.0 111.435 177.039 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.656 ' HB3' ' HA ' ' A' ' 919' ' ' ILE . 0.2 OUTLIER -63.38 -47.41 82.18 Favored 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.559 174.204 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.409 ' O ' ' HB2' ' A' 1045 ' ' LYS . 39.0 mt-30 -61.58 -43.87 98.06 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.006 0.432 . . . . 0.0 109.863 172.204 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.674 ' CB ' HG23 ' A' ' 980' ' ' THR . . . -54.1 -50.99 65.58 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -176.399 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.733 ' HG2' ' O ' ' A' 1039 ' ' ILE . 1.3 ptp180 -63.7 -46.94 83.2 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.477 -174.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.63 HD11 HD12 ' A' 1047 ' ' ILE . 3.7 mm? -74.82 -21.37 59.32 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.764 0.316 . . . . 0.0 111.016 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.478 ' O ' ' HG2' ' A' 1049 ' ' GLN . 2.5 tmtm? -80.65 -34.81 34.61 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 179.109 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.579 ' SD ' ' HA ' ' A' 1052 ' ' PRO . 4.4 mmm -63.23 -30.94 71.99 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 120.231 -0.587 . . . . 0.0 110.0 171.39 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.63 HD12 HD11 ' A' 1044 ' ' LEU . 53.5 mt -79.5 -21.62 12.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.357 0.599 . . . . 0.0 110.139 175.246 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1048 ' ' SER . . . . . 0.4 ' HB3' ' HA ' ' A' 1045 ' ' LYS . 33.7 t -90.58 -1.0 57.88 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.387 -175.529 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1049 ' ' GLN . . . . . 0.478 ' HG2' ' O ' ' A' 1045 ' ' LYS . 14.7 mm100 -116.84 -178.4 3.42 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.081 0.467 . . . . 0.0 110.835 -178.797 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 10.4 t -125.17 17.95 8.38 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 169.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 72.0 ttt180 -147.9 141.78 15.93 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 114.055 -1.43 . . . . 0.0 107.699 -174.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1052 ' ' PRO . . . . . 0.579 ' HA ' ' SD ' ' A' 1046 ' ' MET . 71.4 Cg_exo -49.47 90.89 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 123.248 2.632 . . . . 0.0 114.416 -175.142 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1053 ' ' HIS . . . . . 0.499 ' CD2' ' HA ' ' A' 1042 ' ' ALA . 54.5 t-80 . . . . . 0 CA--C 1.536 0.424 0 CA-C-N 114.755 -1.111 . . . . 0.0 112.053 178.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.706 0 N-CA-C 112.229 -0.348 . . . . 0.0 112.229 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 909' ' ' SER . . . . . 0.773 ' HB3' ' HD3' ' A' ' 910' ' ' PRO . 9.1 t -105.22 -56.75 0.08 OUTLIER Pre-proline 0 CA--C 1.538 0.498 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 176.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 910' ' ' PRO . . . . . 0.773 ' HD3' ' HB3' ' A' ' 909' ' ' SER . 3.8 Cg_exo -77.39 25.63 0.48 Allowed 'Trans proline' 0 C--N 1.362 1.26 0 C-N-CA 122.737 2.291 . . . . 0.0 111.827 177.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 911' ' ' GLY . . . . . 0.43 ' H ' ' C ' ' A' ' 909' ' ' SER . . . -144.63 146.73 17.45 Favored Glycine 0 N--CA 1.44 -1.034 0 N-CA-C 110.455 -1.058 . . . . 0.0 110.455 177.647 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 8.6 tp -78.62 112.78 17.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.483 0.658 . . . . 0.0 111.045 -176.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 50.7 m -98.36 18.31 16.77 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.704 179.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 115.02 114.09 2.97 Favored Glycine 0 N--CA 1.445 -0.74 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.45 -177.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 915' ' ' GLY . . . . . 0.503 ' O ' ' HA ' ' A' ' 921' ' ' SER . . . -99.92 169.26 21.88 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.896 -0.668 . . . . 0.0 112.09 -177.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . 169.98 -60.64 0.18 Allowed Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.089 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . 67.85 95.2 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 N-CA-C 111.385 -0.686 . . . . 0.0 111.385 -176.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . 0.51 ' O ' ' HB2' ' A' 1044 ' ' LEU . . . 83.32 -96.41 1.92 Allowed Glycine 0 N--CA 1.442 -0.935 0 C-N-CA 119.896 -1.145 . . . . 0.0 111.136 -170.475 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 919' ' ' ILE . . . . . 0.734 ' HA ' ' O ' ' A' 1040 ' ' ASP . 29.2 pt -60.96 -179.84 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.922 0 C-N-CA 124.035 0.934 . . . . 0.0 112.843 179.069 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 1.001 ' HA ' ' HG2' ' A' 1043 ' ' ARG . 0.2 OUTLIER -67.95 -61.71 1.74 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.973 -1.012 . . . . 0.0 113.138 -163.007 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 921' ' ' SER . . . . . 0.503 ' HA ' ' O ' ' A' ' 915' ' ' GLY . 49.7 m -153.91 -56.53 0.11 Allowed 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 121.302 0.573 . . . . 0.0 109.855 -177.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.491 ' CG ' ' H ' ' A' ' 923' ' ' ASP . 23.7 p-10 -152.33 -76.66 0.13 Allowed 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.372 172.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.797 ' HB3' ' CD1' ' A' ' 926' ' ' TYR . 9.4 m-20 -168.1 17.06 0.03 OUTLIER 'General case' 0 C--O 1.21 -0.992 0 C-N-CA 122.444 0.298 . . . . 0.0 111.071 -171.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.46 ' O ' ' HG2' ' A' ' 927' ' ' GLU . 4.9 tptp -58.16 -41.26 83.44 Favored 'General case' 0 C--N 1.319 -0.732 0 O-C-N 120.932 -1.105 . . . . 0.0 112.858 -165.256 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.838 HG12 ' HB2' ' A' 1036 ' ' LEU . 1.5 p -62.45 -28.81 45.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 CA-C-O 121.291 0.567 . . . . 0.0 110.83 177.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.797 ' CD1' ' HB3' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -68.09 -30.02 69.1 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.498 0.719 . . . . 0.0 111.555 174.986 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . 0.466 ' O ' HG22 ' A' ' 930' ' ' THR . 3.6 pt-20 -74.97 -23.22 58.25 Favored 'General case' 0 C--N 1.315 -0.935 0 C-N-CA 118.661 -1.215 . . . . 0.0 109.636 -179.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.416 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 1.6 m120 -75.48 -30.98 60.07 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 172.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.664 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 83.3 t -81.68 -30.41 10.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.745 178.247 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.466 HG22 ' O ' ' A' ' 927' ' ' GLU . 3.1 t -65.37 -26.69 68.12 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 170.139 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -72.03 -52.87 10.21 Favored Glycine 0 CA--C 1.531 1.044 0 CA-C-N 115.047 -0.978 . . . . 0.0 113.379 172.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.664 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 3.2 pp -65.8 -47.43 75.15 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -177.617 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.41 HG22 ' HA ' ' A' 1029 ' ' ALA . 95.6 t -64.37 -34.39 69.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 CA-C-O 121.375 0.607 . . . . 0.0 110.237 -177.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.474 ' O ' ' HB3' ' A' ' 938' ' ' GLU . 37.9 tptt -62.48 -34.03 76.03 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.516 176.131 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -68.62 -40.31 80.4 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.316 -0.554 . . . . 0.0 110.644 174.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.788 HG22 ' HB2' ' A' 1025 ' ' ALA . 88.3 t -47.38 -78.92 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 123.417 0.687 . . . . 0.0 112.511 -178.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 19.2 pt -70.49 -41.94 78.22 Favored 'Isoleucine or valine' 0 C--O 1.249 1.028 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -175.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.686 ' O ' ' HB2' ' A' ' 942' ' ' LYS . 5.2 tp10 -70.46 -48.08 57.54 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.426 -168.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.627 ' HG3' HG13 ' A' ' 943' ' ' ILE . 16.2 ttt -74.49 -27.27 60.49 Favored 'General case' 0 C--N 1.308 -1.219 0 C-N-CA 119.276 -0.97 . . . . 0.0 110.05 -178.395 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.681 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 26.3 t -51.64 -55.68 17.95 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.512 -171.534 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 50.5 m -103.74 -21.1 13.75 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.398 -175.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.686 ' HB2' ' O ' ' A' ' 938' ' ' GLU . 11.8 mptt -85.35 -59.24 2.38 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 119.27 -0.972 . . . . 0.0 111.94 -167.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.627 HG13 ' HG3' ' A' ' 939' ' ' MET . 46.2 mm -56.26 -66.05 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 O-C-N 123.324 0.39 . . . . 0.0 111.711 -177.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.551 ' OE1' ' HA ' ' A' ' 949' ' ' GLU . 43.5 mt-30 -155.28 101.3 2.26 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-O 120.929 0.395 . . . . 0.0 111.23 -178.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.424 ' HD2' ' HD2' ' A' ' 947' ' ' PRO . 38.1 Cg_endo -85.47 -77.36 0.0 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.853 0 C-N-CA 122.568 2.179 . . . . 0.0 112.555 176.629 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.653 ' HB1' ' HD3' ' A' ' 947' ' ' PRO . . . -69.69 -49.42 21.17 Favored Pre-proline 0 CA--C 1.532 0.288 0 N-CA-C 111.532 0.197 . . . . 0.0 111.532 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.653 ' HD3' ' HB1' ' A' ' 946' ' ' ALA . 16.9 Cg_exo -68.44 137.32 39.27 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 121.328 1.352 . . . . 0.0 109.596 169.243 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.606 ' HB3' HG12 ' A' 1009 ' ' VAL . 10.0 Cg_endo -58.08 111.05 0.73 Allowed 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 121.747 1.631 . . . . 0.0 113.255 -175.318 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 0.65 ' HB3' ' CD1' ' A' ' 951' ' ' TYR . 28.7 tt0 -59.1 -16.12 17.67 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.412 -1.267 . . . . 0.0 108.558 165.098 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.697 ' HB3' ' HG2' ' A' ' 953' ' ' PRO . 30.2 tt0 74.92 -12.36 0.95 Allowed 'General case' 0 C--N 1.348 0.524 0 CA-C-N 114.526 -1.215 . . . . 0.0 108.572 -166.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.97 ' HB3' ' HG2' ' A' 1002 ' ' MET . 20.5 m-30 54.04 -50.09 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.475 1.51 . . . . 0.0 114.255 177.572 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 0.524 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 45.6 t -48.1 -44.69 62.07 Favored Pre-proline 0 CA--C 1.541 0.597 0 C-N-CA 122.849 0.46 . . . . 0.0 112.058 172.327 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 0.697 ' HG2' ' HB3' ' A' ' 950' ' ' GLU . 19.0 Cg_exo -47.62 -44.13 26.6 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 122.572 2.181 . . . . 0.0 113.185 173.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.656 ' SD ' ' HE1' ' A' 1002 ' ' MET . 14.1 ttt -71.76 -37.55 70.5 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 120.897 0.379 . . . . 0.0 110.227 175.774 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.503 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 86.2 t -52.96 -40.62 37.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.809 170.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.502 ' HE2' ' OE2' ' A' ' 957' ' ' GLU . 0.8 OUTLIER -62.7 -34.03 76.3 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.788 174.376 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . 0.502 ' OE2' ' HE2' ' A' ' 956' ' ' LYS . 69.7 mm-40 -77.87 -44.83 26.0 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.195 0.522 . . . . 0.0 111.111 -179.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.453 HG21 ' HB2' ' A' ' 932' ' ' LEU . 14.6 p -78.79 -29.37 14.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.928 -177.375 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -69.62 -35.52 74.6 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 110.549 -1.02 . . . . 0.0 110.549 172.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . 0.435 ' O ' ' HG2' ' A' ' 963' ' ' ARG . 8.6 tt -62.77 -41.22 99.13 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 174.121 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.417 ' CB ' ' HB3' ' A' ' 932' ' ' LEU . . . -69.32 -57.99 4.6 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 121.132 -0.227 . . . . 0.0 110.966 -179.593 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.601 ' HB2' HD22 ' A' ' 991' ' ' LEU . 0.1 OUTLIER -42.86 -49.22 5.85 Favored 'General case' 0 C--O 1.217 -0.642 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 169.763 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.456 ' N ' ' HG ' ' A' ' 962' ' ' LEU . 11.2 ptm180 -67.89 -28.77 67.8 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 120.108 1.322 . . . . 0.0 111.064 -179.529 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 28.0 m -68.3 -35.53 77.97 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 173.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.718 HD23 HD12 ' A' ' 991' ' ' LEU . 0.0 OUTLIER -66.57 -38.64 87.48 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 114.523 -1.217 . . . . 0.0 109.467 174.686 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 10.3 tt -65.92 -40.36 91.36 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-N 114.314 -1.312 . . . . 0.0 108.271 -177.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -65.29 -44.69 87.16 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.397 -0.82 . . . . 0.0 112.249 178.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 13.8 p -64.81 -41.02 96.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 118.858 0.753 . . . . 0.0 110.412 179.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.703 HG13 HG22 ' A' ' 984' ' ' ILE . 87.3 t -72.96 -41.85 60.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.021 176.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.718 ' HB2' HE22 ' A' ' 988' ' ' GLN . 14.0 t70 -67.03 -38.83 86.62 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 -177.57 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.609 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 14.2 tt0 -60.83 -33.85 73.66 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.012 -0.995 . . . . 0.0 109.773 174.231 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.515 ' HB2' ' O ' ' A' ' 969' ' ' VAL . 64.2 m -65.57 -18.29 65.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.085 177.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.727 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 10.5 tt -70.61 -52.02 11.45 Favored Pre-proline 0 CA--C 1.537 0.48 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.256 -178.529 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.727 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 2.2 Cg_endo -88.01 -4.7 6.95 Favored 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 121.758 1.639 . . . . 0.0 113.94 173.751 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.453 HG22 ' O ' ' A' ' 971' ' ' GLU . 15.9 t -74.71 -41.07 47.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 120.157 -0.617 . . . . 0.0 109.766 171.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -95.31 108.09 36.78 Favored Pre-proline 0 C--N 1.328 -0.362 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 172.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -50.78 101.1 0.04 OUTLIER 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 123.552 2.835 . . . . 0.0 114.418 -171.1 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . 69.78 -67.82 0.22 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.033 -0.985 . . . . 0.0 113.573 172.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.464 ' HB2' ' HE1' ' A' 1046 ' ' MET . 5.7 p -48.93 -50.64 34.39 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 114.464 1.283 . . . . 0.0 114.464 -166.388 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.579 HG21 ' CD1' ' A' ' 984' ' ' ILE . 32.5 m -70.61 -5.1 26.84 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -172.1 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.681 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 2.5 p80 -50.13 -34.52 22.45 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -175.352 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -82.66 -20.79 35.55 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -168.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.59 -37.65 41.93 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.316 0.579 . . . . 0.0 109.684 172.58 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.777 HG13 HG12 ' A' 1039 ' ' ILE . 2.5 mp -65.68 -29.74 47.94 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.524 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 176.005 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . 0.681 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 42.3 mt-10 -63.79 -52.45 60.2 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-O 121.36 0.6 . . . . 0.0 110.579 176.164 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 58.7 mtt -70.06 -46.34 65.17 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 114.978 -1.01 . . . . 0.0 111.424 -169.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.436 ' CA ' ' HG ' ' A' 1035 ' ' LEU . . . -75.09 -51.11 14.29 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.719 -1.128 . . . . 0.0 112.776 -169.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.718 HE22 ' HB2' ' A' ' 970' ' ' ASP . 2.2 pt20 -63.29 -20.95 65.93 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 119.406 -0.918 . . . . 0.0 109.209 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . 0.622 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 9.1 ttmm -73.94 -42.43 60.58 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.042 -0.981 . . . . 0.0 112.591 170.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.491 HD13 HD13 ' A' 1035 ' ' LEU . 1.2 mt -56.29 -54.05 49.96 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -178.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.718 HD12 HD23 ' A' ' 965' ' ' LEU . 1.2 tt -65.22 -32.21 73.77 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 175.774 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . 0.652 ' HB2' ' O ' ' A' ' 988' ' ' GLN . 47.3 t-20 -53.95 -56.88 13.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.932 179.003 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 20.7 t -79.32 -33.88 42.77 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -177.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . 0.49 ' O ' ' HB3' ' A' ' 997' ' ' GLU . 0.2 OUTLIER -69.0 -33.41 73.63 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.17 -0.612 . . . . 0.0 111.705 178.946 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.601 ' N ' HD23 ' A' 1028 ' ' LEU . 2.9 tm? -69.33 -19.63 63.87 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 169.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -76.08 -21.76 56.36 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 119.434 -0.906 . . . . 0.0 110.415 167.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.608 ' HA ' ' ND2' ' A' 1000 ' ' ASN . 7.7 tp10 -75.25 -42.41 55.19 Favored 'General case' 0 C--O 1.239 0.528 0 C-N-CA 122.367 0.267 . . . . 0.0 110.532 173.228 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.912 HD12 ' HB3' ' A' 1025 ' ' ALA . 1.6 tt -56.53 -44.21 80.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.725 0.298 . . . . 0.0 110.366 177.518 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.559 HG13 ' O ' ' A' ' 995' ' ' LEU . 88.5 mt -66.46 -46.87 85.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 CA-C-N 115.868 -0.605 . . . . 0.0 112.274 -172.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1000 ' ' ASN . . . . . 0.608 ' ND2' ' HA ' ' A' ' 997' ' ' GLU . 10.2 p30 -63.21 -37.51 87.54 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.438 0.637 . . . . 0.0 111.374 -172.147 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.569 ' HD3' ' HB3' ' A' 1020 ' ' GLN . 49.9 mttp -83.96 -34.15 24.48 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.086 -178.883 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.97 ' HG2' ' HB3' ' A' ' 951' ' ' TYR . 12.7 ttt -62.48 -27.23 68.99 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 122.054 0.93 . . . . 0.0 109.013 175.537 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.548 ' O ' ' HG3' ' A' 1007 ' ' GLN . 10.3 tptp -72.91 -55.28 6.84 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-N 113.724 -1.58 . . . . 0.0 110.224 -170.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.414 ' HA ' ' HB2' ' A' 1007 ' ' GLN . 90.5 mt -66.24 -13.53 60.52 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.615 179.435 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1005 ' ' ALA . . . . . 0.702 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -72.88 -51.76 17.4 Favored 'General case' 0 C--O 1.212 -0.898 0 C-N-CA 119.634 -0.827 . . . . 0.0 110.147 178.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.979 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -68.86 -32.39 72.02 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 118.332 0.515 . . . . 0.0 111.94 174.272 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.548 ' HG3' ' O ' ' A' 1003 ' ' LYS . 19.4 mt-30 -51.79 -40.86 61.11 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.18 0.514 . . . . 0.0 111.282 175.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.5 ' HB2' ' HG ' ' A' 1013 ' ' LEU . 54.9 m-85 -126.49 39.06 4.01 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.333 173.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 1.035 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 12.9 p -54.28 -22.14 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 CA-C-O 121.692 0.758 . . . . 0.0 110.332 177.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1010 ' ' MET . . . . . 0.509 ' O ' HG22 ' A' 1011 ' ' THR . 59.1 mtt -50.03 -29.32 8.47 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.355 -1.293 . . . . 0.0 111.831 177.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1011 ' ' THR . . . . . 0.509 HG22 ' O ' ' A' 1010 ' ' MET . 0.6 OUTLIER -163.79 -99.51 0.02 OUTLIER 'General case' 0 C--O 1.253 1.275 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 177.311 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 4.7 p -56.92 -65.24 0.65 Allowed 'General case' 0 C--O 1.237 0.438 0 CA-C-N 114.267 -1.333 . . . . 0.0 113.57 -163.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.619 ' HB3' ' CD2' ' A' 1017 ' ' TYR . 8.9 mt -52.1 -37.01 52.64 Favored 'General case' 0 CA--C 1.501 -0.913 0 N-CA-C 111.558 0.207 . . . . 0.0 111.558 -177.395 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 1.035 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.35 -52.72 60.69 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-O 121.202 0.525 . . . . 0.0 110.974 -168.998 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A 1015 ' ' GLN . . . . . 0.685 ' O ' ' HB3' ' A' 1019 ' ' LYS . 4.6 pp0? -71.42 -36.83 71.44 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.261 -174.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1016 ' ' GLU . . . . . 0.449 ' HA ' ' HD2' ' A' 1019 ' ' LYS . 17.3 tt0 -73.2 -51.64 17.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.8 0.809 . . . . 0.0 111.015 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.702 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 12.2 m-85 -66.85 -37.79 85.14 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -174.587 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.571 ' HD2' ' HE1' ' A' 1021 ' ' MET . 45.7 tptt -79.99 -29.31 39.49 Favored 'General case' 0 N--CA 1.461 0.094 0 CA-C-N 115.056 -0.974 . . . . 0.0 109.967 -177.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1019 ' ' LYS . . . . . 0.685 ' HB3' ' O ' ' A' 1015 ' ' GLN . 0.0 OUTLIER -74.29 -40.41 62.29 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.778 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A 1020 ' ' GLN . . . . . 0.569 ' HB3' ' HD3' ' A' 1001 ' ' LYS . 48.0 mt-30 -60.86 -33.28 72.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.526 162.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.571 ' HE1' ' HD2' ' A' 1018 ' ' LYS . 11.5 tmm? -65.19 -51.27 62.07 Favored 'General case' 0 CA--C 1.506 -0.723 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 -178.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1022 ' ' LEU . . . . . 0.758 ' HA ' ' HB1' ' A' 1025 ' ' ALA . 0.1 OUTLIER -84.39 -2.67 57.52 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 119.231 -0.988 . . . . 0.0 109.76 -174.485 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 53.1 m -89.0 -34.07 16.96 Favored 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 171.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.526 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.76 -21.31 48.11 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 169.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.912 ' HB3' HD12 ' A' ' 998' ' ' LEU . . . -85.55 -24.4 27.26 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.785 169.514 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.568 ' O ' HG23 ' A' 1030 ' ' VAL . 53.6 t-80 -75.84 -23.09 55.71 Favored 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 164.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1027 ' ' ALA . . . . . 0.46 ' HB1' ' O ' ' A' 1024 ' ' ALA . . . -73.04 -40.47 65.08 Favored 'General case' 0 C--N 1.318 -0.8 0 C-N-CA 123.345 0.658 . . . . 0.0 109.419 165.528 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.601 HD23 ' N ' ' A' ' 995' ' ' LEU . 26.3 mt -61.3 -43.92 98.08 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 170.288 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1029 ' ' ALA . . . . . 0.41 ' HA ' HG22 ' A' ' 933' ' ' VAL . . . -59.5 -42.78 92.95 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 111.429 0.159 . . . . 0.0 111.429 173.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' 1026 ' ' HIS . 10.5 t -66.42 -50.58 66.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.237 0 CA-C-O 121.61 0.719 . . . . 0.0 110.346 -178.276 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1031 ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -72.24 -39.54 68.4 Favored 'General case' 0 C--O 1.204 -1.308 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.113 -176.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.514 ' HB1' HG23 ' A' ' 929' ' ' VAL . . . -63.83 -35.44 80.63 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.917 -0.313 . . . . 0.0 110.235 176.429 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 8.0 tmtm? -61.57 -44.23 97.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.607 0.718 . . . . 0.0 109.624 172.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.51 ' O ' HG22 ' A' 1038 ' ' VAL . 40.5 t30 -70.8 -53.57 14.88 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 114.868 -1.06 . . . . 0.0 111.165 -177.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.616 HD22 ' HB2' ' A' ' 991' ' ' LEU . 0.0 OUTLIER -59.0 -42.17 89.43 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.192 -173.375 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.838 ' HB2' HG12 ' A' ' 925' ' ' VAL . 3.9 pp -62.9 -48.59 78.29 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 118.372 -1.331 . . . . 0.0 109.762 178.411 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.434 ' N ' HD11 ' A' 1036 ' ' LEU . 24.0 t70 -52.21 -38.61 58.45 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 114.165 -1.38 . . . . 0.0 110.784 175.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.512 HG13 HD13 ' A' 1039 ' ' ILE . 25.3 t -62.46 -50.62 79.14 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.916 0 CA-C-N 113.96 -1.473 . . . . 0.0 112.827 -179.383 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.777 HG12 HG13 ' A' ' 984' ' ' ILE . 1.5 mp -76.36 -29.33 18.79 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 CA-C-N 119.881 1.219 . . . . 0.0 111.666 -177.185 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.734 ' O ' ' HA ' ' A' ' 919' ' ' ILE . 1.2 m-20 -55.87 -51.16 68.53 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.278 167.346 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.613 ' O ' ' HB3' ' A' 1044 ' ' LEU . 36.2 mt-30 -77.1 -23.29 51.85 Favored 'General case' 0 C--N 1.312 -1.036 0 O-C-N 121.911 -0.493 . . . . 0.0 111.552 177.028 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.641 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -55.53 -52.94 62.01 Favored 'General case' 0 CA--C 1.495 -1.161 0 CA-C-O 121.577 0.703 . . . . 0.0 111.011 176.372 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 1.001 ' HG2' ' HA ' ' A' ' 920' ' ' ARG . 0.0 OUTLIER -63.55 -35.53 80.79 Favored 'General case' 0 N--CA 1.432 -1.365 0 CA-C-N 114.775 -1.102 . . . . 0.0 108.401 -179.536 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.947 ' HG ' ' HB3' ' A' 1053 ' ' HIS . 6.7 tt -59.0 -51.16 71.26 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.407 175.037 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.707 ' O ' ' HB2' ' A' 1049 ' ' GLN . 4.9 tmmm? -71.82 -32.42 67.54 Favored 'General case' 0 N--CA 1.438 -1.03 0 CA-C-N 114.779 -1.101 . . . . 0.0 110.981 -171.326 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.55 ' HG3' ' HA ' ' A' ' 980' ' ' THR . 71.3 mmm -73.62 -44.35 57.23 Favored 'General case' 0 C--N 1.311 -1.078 0 O-C-N 121.342 -0.849 . . . . 0.0 111.38 177.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.585 HG12 ' O ' ' A' 1043 ' ' ARG . 43.8 mm -58.75 -52.25 62.34 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.301 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 173.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1048 ' ' SER . . . . . 0.93 ' HB2' ' HB2' ' A' 1053 ' ' HIS . 70.7 m -140.28 79.9 1.73 Allowed 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.461 -179.161 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1049 ' ' GLN . . . . . 0.707 ' HB2' ' O ' ' A' 1045 ' ' LYS . 21.9 tm0? -82.54 -38.46 23.71 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.235 167.401 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 19.1 t -59.96 -40.05 87.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.098 0.475 . . . . 0.0 110.724 -176.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -127.0 139.85 36.2 Favored Pre-proline 0 C--N 1.32 -0.69 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 173.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -61.42 109.21 0.7 Allowed 'Trans proline' 0 N--CA 1.463 -0.32 0 C-N-CA 121.639 1.559 . . . . 0.0 111.967 -173.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1053 ' ' HIS . . . . . 0.947 ' HB3' ' HG ' ' A' 1044 ' ' LEU . 1.2 t60 . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.447 -178.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.692 0 N-CA-C 111.796 -0.522 . . . . 0.0 111.796 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 66.3 m -155.08 89.15 3.1 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-O 120.815 0.34 . . . . 0.0 110.477 178.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -63.12 -47.22 8.6 Favored 'Trans proline' 0 C--N 1.343 0.268 0 C-N-CA 122.804 2.336 . . . . 0.0 112.44 -178.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -153.87 78.9 0.2 Allowed Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.765 -0.731 . . . . 0.0 111.929 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 2.4 pp -92.7 16.62 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.995 0.426 . . . . 0.0 111.432 -178.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 35.2 t -82.97 148.13 27.8 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.994 178.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . -133.52 53.77 0.79 Allowed Glycine 0 N--CA 1.443 -0.896 0 N-CA-C 111.434 -0.666 . . . . 0.0 111.434 178.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . -119.91 22.93 8.44 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.711 -178.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 916' ' ' GLY . . . . . 0.469 ' O ' ' HA ' ' A' ' 921' ' ' SER . . . 169.3 142.11 3.43 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.314 -179.34 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . 133.77 160.67 9.41 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.88 -0.676 . . . . 0.0 112.085 178.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -107.43 -79.66 1.22 Allowed Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 121.03 -0.605 . . . . 0.0 112.315 177.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 919' ' ' ILE . . . . . 0.718 ' HB ' ' C ' ' A' 1040 ' ' ASP . 21.2 mm -80.77 15.44 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.917 0.865 . . . . 0.0 111.419 177.367 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.945 ' HG3' ' H ' ' A' ' 921' ' ' SER . 22.6 tpt180 -177.7 -156.29 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 174.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 921' ' ' SER . . . . . 0.945 ' H ' ' HG3' ' A' ' 920' ' ' ARG . 20.8 m -145.32 85.13 1.72 Allowed 'General case' 0 N--CA 1.443 -0.813 0 CA-C-O 121.207 0.527 . . . . 0.0 111.235 -175.591 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.428 ' HB3' ' CD1' ' A' 1036 ' ' LEU . 32.4 t30 -111.41 133.57 53.62 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 168.162 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.686 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 6.9 p-10 -111.45 -35.79 5.72 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -161.411 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt -60.75 -19.67 59.59 Favored 'General case' 0 C--N 1.318 -0.763 0 O-C-N 121.378 -0.826 . . . . 0.0 112.545 -172.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.765 HG11 HD12 ' A' 1036 ' ' LEU . 0.2 OUTLIER -70.72 -29.88 39.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 172.899 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.686 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.1 OUTLIER -79.02 -21.0 47.58 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 178.566 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -73.15 -43.43 61.56 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 114.602 -1.181 . . . . 0.0 109.893 171.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.706 ' OD1' ' HB ' ' A' ' 964' ' ' THR . 69.7 m-80 -74.95 -27.32 60.14 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 119.159 0.89 . . . . 0.0 111.581 174.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.6 HG13 HG21 ' A' ' 933' ' ' VAL . 42.8 t -65.78 -33.31 62.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.194 167.245 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.677 ' O ' ' HB2' ' A' ' 934' ' ' LYS . 98.8 m -65.58 -42.68 91.46 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 119.372 0.987 . . . . 0.0 109.778 174.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -73.41 -53.9 7.21 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 120.603 -0.808 . . . . 0.0 113.621 179.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.495 ' O ' HG22 ' A' ' 936' ' ' VAL . 1.5 pp -64.47 -47.62 78.33 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -176.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.6 HG21 HG13 ' A' ' 929' ' ' VAL . 72.8 t -67.49 -36.61 76.87 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 CA-C-O 121.073 0.463 . . . . 0.0 111.028 -175.208 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.677 ' HB2' ' O ' ' A' ' 930' ' ' THR . 4.1 mmtp -62.75 -42.81 99.85 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.149 -179.642 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.499 ' HA ' ' SD ' ' A' ' 939' ' ' MET . . . -59.31 -35.47 73.86 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.717 0.294 . . . . 0.0 111.36 177.204 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.757 ' O ' ' HB2' ' A' ' 940' ' ' SER . 66.8 t -54.55 -74.87 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.729 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 21.1 pt -71.61 -42.5 71.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -174.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -64.42 -53.31 50.36 Favored 'General case' 0 C--O 1.243 0.738 0 CA-C-O 121.521 0.676 . . . . 0.0 110.634 -172.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.544 ' HB3' ' HE1' ' A' ' 954' ' ' MET . 1.8 mpt? -71.21 -24.67 62.25 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 119.439 -0.904 . . . . 0.0 109.131 -178.545 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.757 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 5.0 t -55.87 -34.91 65.91 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 121.824 0.821 . . . . 0.0 110.867 -175.456 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 12.3 m -97.52 -13.82 21.44 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 114.874 -1.057 . . . . 0.0 110.63 -176.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . . . . . . . . . 8.2 tmtt? -83.19 -25.65 31.58 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 176.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.877 HG21 ' HB2' ' A' ' 949' ' ' GLU . 2.7 pp -71.75 -8.24 10.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -178.63 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -90.12 -57.49 0.26 Allowed Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -177.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -68.11 -28.02 35.06 Favored 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 121.75 1.633 . . . . 0.0 112.027 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.543 ' HB3' ' HD2' ' A' ' 947' ' ' PRO . . . -92.35 167.07 15.62 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.348 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.543 ' HD2' ' HB3' ' A' ' 946' ' ' ALA . 28.5 Cg_endo -63.27 170.0 8.57 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.508 2.139 . . . . 0.0 111.305 172.526 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.577 ' HB3' HG12 ' A' 1009 ' ' VAL . 4.7 Cg_exo -40.45 125.94 2.04 Favored 'Trans proline' 0 CA--C 1.507 -0.858 0 C-N-CA 123.423 2.749 . . . . 0.0 113.121 177.54 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 0.877 ' HB2' HG21 ' A' ' 943' ' ' ILE . 12.1 tp10 -63.21 -21.13 66.02 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 114.743 -1.117 . . . . 0.0 109.116 171.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.47 ' HB3' ' CD ' ' A' ' 953' ' ' PRO . 28.1 tt0 73.58 -12.88 0.78 Allowed 'General case' 0 C--N 1.346 0.426 0 O-C-N 124.106 0.879 . . . . 0.0 109.084 -167.612 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.705 ' HE1' HG23 ' A' ' 943' ' ' ILE . 23.1 m-85 53.67 -37.45 0.02 OUTLIER 'General case' 0 C--O 1.216 -0.69 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 178.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 0.739 ' HA ' ' CG2' ' A' ' 955' ' ' VAL . 43.4 t -56.13 -44.71 99.83 Favored Pre-proline 0 C--N 1.323 -0.57 0 C-N-CA 123.005 0.522 . . . . 0.0 111.322 171.014 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 0.576 ' O ' ' HB3' ' A' ' 956' ' ' LYS . 47.0 Cg_exo -52.34 -36.36 68.31 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 121.843 1.696 . . . . 0.0 111.915 170.169 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.783 ' HE2' ' HG2' ' A' ' 949' ' ' GLU . 32.3 ttm -76.69 -31.01 56.95 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.123 176.001 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.837 HG22 ' HE2' ' A' 1002 ' ' MET . 85.4 t -53.26 -39.36 34.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 168.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.576 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 0.7 OUTLIER -63.8 -39.64 94.74 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.124 175.104 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -76.18 -46.7 27.23 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.442 -171.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.641 HG21 HD22 ' A' ' 962' ' ' LEU . 11.7 p -87.8 -28.45 5.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.347 -178.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . 0.507 ' O ' ' HG2' ' A' ' 963' ' ' ARG . . . -61.99 -46.93 93.05 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.471 -0.871 . . . . 0.0 111.2 176.379 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . 0.457 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 9.5 tt -64.62 -34.27 77.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.039 0.447 . . . . 0.0 110.206 177.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.43 ' O ' ' HB3' ' A' ' 928' ' ' ASN . . . -72.5 -46.78 53.12 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -178.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.842 HD11 HD21 ' A' ' 995' ' ' LEU . 4.0 pp -84.55 -18.07 36.86 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 119.345 -0.36 . . . . 0.0 111.482 -176.37 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.507 ' HG2' ' O ' ' A' ' 959' ' ' GLY . 8.5 ptp180 -70.31 -37.9 74.84 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 118.829 -1.148 . . . . 0.0 110.091 166.673 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 964' ' ' THR . . . . . 0.706 ' HB ' ' OD1' ' A' ' 928' ' ' ASN . 10.5 m -71.13 -26.46 63.02 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.488 ' CD1' HG23 ' A' ' 925' ' ' VAL . 9.7 tp -63.27 -46.36 87.19 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.618 169.145 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.786 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 9.7 tt -66.62 -33.25 75.24 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -177.437 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . 0.514 ' HA ' ' HB3' ' A' ' 970' ' ' ASP . . . -75.24 -32.95 61.26 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 115.342 -0.845 . . . . 0.0 112.224 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 2.4 p -71.53 -35.26 70.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.173 0.511 . . . . 0.0 110.157 176.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.735 HG11 HG22 ' A' ' 984' ' ' ILE . 48.6 t -74.45 -34.92 37.41 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.731 170.345 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.618 ' HB2' HE22 ' A' ' 988' ' ' GLN . 12.8 t70 -66.66 -41.57 87.97 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 122.422 1.106 . . . . 0.0 108.77 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.671 ' O ' HG21 ' A' ' 975' ' ' VAL . 36.0 tt0 -66.23 -29.11 69.29 Favored 'General case' 0 N--CA 1.436 -1.171 0 CA-C-N 113.818 -1.537 . . . . 0.0 110.308 178.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 69.0 m -69.62 -19.09 63.64 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.643 175.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.905 ' HA ' HD13 ' A' ' 984' ' ' ILE . 5.8 tt -66.09 -51.14 47.58 Favored Pre-proline 0 N--CA 1.454 -0.272 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.333 -177.747 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.67 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 1.1 Cg_endo -85.7 0.18 8.53 Favored 'Trans proline' 0 C--N 1.357 1.01 0 C-N-CA 121.85 1.7 . . . . 0.0 113.416 173.191 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.671 HG21 ' O ' ' A' ' 971' ' ' GLU . 11.6 t -64.89 -43.1 96.33 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.045 171.768 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.51 HD22 ' HG1' ' A' ' 980' ' ' THR . 5.3 mp -99.31 127.18 35.29 Favored Pre-proline 0 C--N 1.324 -0.516 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.172 175.25 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -36.34 -78.54 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 125.21 3.94 . . . . 0.0 115.202 -170.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -153.13 91.18 1.5 Allowed 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 111.733 0.272 . . . . 0.0 111.733 -175.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 979' ' ' SER . . . . . . . . . . . . . 14.1 p 173.83 -57.51 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.315 0 O-C-N 123.841 0.713 . . . . 0.0 109.936 178.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.66 HG22 ' HB2' ' A' 1042 ' ' ALA . 14.4 m -61.8 -14.75 35.78 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.939 -179.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.649 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 16.1 m-70 -50.25 -39.1 43.95 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.013 -177.714 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 14.9 ptm180 -82.1 -18.56 42.59 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.675 -0.239 . . . . 0.0 111.121 -170.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.879 ' HG2' ' HB3' ' A' 1042 ' ' ALA . 1.3 tp10 -75.19 -43.02 54.38 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 172.231 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.905 HD13 ' HA ' ' A' ' 973' ' ' LEU . 3.2 mp -65.54 -32.63 59.06 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 177.227 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . 0.649 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 34.6 mt-10 -55.25 -52.4 63.51 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.305 0.574 . . . . 0.0 110.262 174.417 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 45.8 ttm -72.71 -40.39 66.21 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 114.979 -1.01 . . . . 0.0 111.261 -173.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.802 ' HB3' ' HB2' ' A' 1035 ' ' LEU . . . -75.02 -50.93 14.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.524 -1.216 . . . . 0.0 112.71 -172.189 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.786 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 3.1 pt20 -62.88 -21.99 66.39 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 120.074 -0.651 . . . . 0.0 109.803 175.443 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . 0.722 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 59.2 tttt -74.91 -39.97 61.14 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.491 170.625 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.425 ' HB3' ' O ' ' A' ' 987' ' ' ALA . 18.0 tp -52.54 -59.22 4.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.665 177.576 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.552 ' HB3' ' CD1' ' A' 1035 ' ' LEU . 2.4 pp -59.8 -34.84 73.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.771 0.796 . . . . 0.0 109.481 177.795 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . 0.722 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 24.6 t-20 -52.85 -54.03 40.27 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 113.747 -1.569 . . . . 0.0 112.08 -178.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 6.0 m -78.83 -30.32 45.22 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 112.054 0.391 . . . . 0.0 112.054 -179.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.12 -42.76 88.74 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 119.488 -0.885 . . . . 0.0 111.488 176.33 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.842 HD21 HD11 ' A' ' 962' ' ' LEU . 1.2 pp -62.62 -23.26 66.97 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 122.717 0.407 . . . . 0.0 110.223 170.549 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -78.45 -27.23 46.39 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 119.456 -0.898 . . . . 0.0 110.406 174.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -73.99 -45.71 48.29 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 170.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.853 HD23 ' HE2' ' A' 1021 ' ' MET . 0.7 OUTLIER -56.7 -42.97 80.05 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.559 -1.2 . . . . 0.0 111.184 -178.508 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.686 ' HA ' ' HE1' ' A' 1002 ' ' MET . 69.0 mt -65.37 -43.99 94.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 O-C-N 122.458 -0.151 . . . . 0.0 111.255 -179.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 23.6 m-80 -60.4 -36.02 77.12 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.233 0.54 . . . . 0.0 111.446 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.48 ' O ' ' HB3' ' A' 1017 ' ' TYR . 13.5 mptt -73.56 -47.18 42.63 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.729 -174.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1002 ' ' MET . . . . . 1.018 ' HB3' ' HG3' ' A' 1021 ' ' MET . 16.1 ptt? -65.1 -23.79 67.25 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.841 0.829 . . . . 0.0 109.577 179.139 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.529 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 8.7 tptm -70.99 -44.99 64.8 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.162 -165.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.568 ' HB3' HD22 ' A' 1013 ' ' LEU . 6.7 mp -83.02 -13.09 56.57 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.913 178.62 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1005 ' ' ALA . . . . . 0.622 ' HB2' ' CB ' ' A' 1017 ' ' TYR . . . -70.47 -37.41 74.25 Favored 'General case' 0 C--O 1.211 -0.951 0 C-N-CA 118.904 -1.118 . . . . 0.0 109.532 178.202 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.815 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 3.9 pp0? -75.47 -40.12 57.81 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 119.151 -0.452 . . . . 0.0 111.874 171.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.571 ' HG3' ' CD2' ' A' 1008 ' ' TYR . 5.6 pt20 -53.68 -37.97 63.73 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 121.32 0.581 . . . . 0.0 110.349 -175.747 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.81 ' HB2' HD21 ' A' 1013 ' ' LEU . 73.4 m-85 -128.99 43.18 3.19 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.364 169.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 1.028 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 14.7 p -48.99 -21.91 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.702 169.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1010 ' ' MET . . . . . 0.484 ' N ' HG11 ' A' 1009 ' ' VAL . 65.3 mtt -31.8 -55.97 0.29 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.111 -1.404 . . . . 0.0 111.548 172.062 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1011 ' ' THR . . . . . 0.416 HG23 ' O ' ' A' 1010 ' ' MET . 1.7 p -159.25 -91.04 0.03 OUTLIER 'General case' 0 C--O 1.249 1.062 0 N-CA-C 113.332 0.864 . . . . 0.0 113.332 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 32.4 t -51.27 -65.57 0.53 Allowed 'General case' 0 C--O 1.237 0.41 0 CA-C-N 114.411 -1.268 . . . . 0.0 112.399 -166.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.81 HD21 ' HB2' ' A' 1008 ' ' TYR . 8.0 mp -47.88 -43.26 28.46 Favored 'General case' 0 CA--C 1.507 -0.674 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -179.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 1.028 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -57.08 -47.79 80.17 Favored 'General case' 0 C--N 1.319 -0.753 0 O-C-N 123.299 0.374 . . . . 0.0 111.509 -167.724 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A 1015 ' ' GLN . . . . . 0.725 ' O ' ' HB3' ' A' 1019 ' ' LYS . 15.0 mm100 -72.46 -37.98 68.37 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-O 120.93 0.395 . . . . 0.0 111.13 -176.651 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -69.33 -55.28 10.91 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.631 0.729 . . . . 0.0 110.828 -179.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.695 ' CE2' ' HG ' ' A' 1013 ' ' LEU . 13.6 m-85 -65.49 -39.57 92.07 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.758 -1.11 . . . . 0.0 113.779 -174.489 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.594 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 25.5 tptp -79.9 -28.91 39.8 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.501 -176.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1019 ' ' LYS . . . . . 0.725 ' HB3' ' O ' ' A' 1015 ' ' GLN . 0.0 OUTLIER -73.23 -45.32 56.77 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 175.072 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -54.91 -35.34 64.05 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.822 162.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1021 ' ' MET . . . . . 1.018 ' HG3' ' HB3' ' A' 1002 ' ' MET . 1.9 tmt? -64.71 -51.92 59.85 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 110.275 -0.268 . . . . 0.0 110.275 -179.021 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1022 ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' 1022 ' ' LEU . 0.0 OUTLIER -78.69 -8.61 58.86 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 119.511 -0.876 . . . . 0.0 109.778 -175.613 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 91.8 m -86.09 -36.88 19.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.08 174.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.549 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -79.28 -22.76 44.22 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-O 121.412 0.625 . . . . 0.0 109.415 173.743 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.678 ' HB3' HG21 ' A' ' 936' ' ' VAL . . . -86.27 -24.83 25.81 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.193 169.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.55 ' O ' HG21 ' A' 1030 ' ' VAL . 53.3 t60 -69.21 -36.28 77.09 Favored 'General case' 0 C--O 1.211 -0.947 0 N-CA-C 108.569 -0.901 . . . . 0.0 108.569 164.104 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1027 ' ' ALA . . . . . 0.549 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -58.4 -45.43 88.37 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 123.453 0.701 . . . . 0.0 111.204 162.043 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.638 ' HB2' ' HA ' ' A' 1025 ' ' ALA . 31.4 mt -56.96 -46.57 82.07 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 118.706 0.684 . . . . 0.0 109.64 173.642 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -59.33 -43.64 92.69 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 173.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.55 HG21 ' O ' ' A' 1026 ' ' HIS . 17.0 t -66.15 -50.68 67.01 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 CA-C-O 121.854 0.835 . . . . 0.0 110.721 -177.104 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.77 ' O ' HD13 ' A' 1035 ' ' LEU . 17.3 m-20 -75.96 -31.05 58.85 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.139 -175.137 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.569 ' HA ' ' CD1' ' A' 1035 ' ' LEU . . . -69.13 -34.02 74.36 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 171.684 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.544 ' HB3' ' O ' ' A' 1030 ' ' VAL . 0.0 OUTLIER -58.63 -37.4 75.85 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 167.63 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.448 ' O ' ' HB3' ' A' 1037 ' ' ASP . 53.2 t30 -79.35 -51.41 9.44 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 114.334 -1.303 . . . . 0.0 112.702 -173.057 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.802 ' HB2' ' HB3' ' A' ' 987' ' ' ALA . 0.0 OUTLIER -59.8 -31.39 69.66 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 119.142 0.883 . . . . 0.0 111.485 -174.137 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.765 HD12 HG11 ' A' ' 925' ' ' VAL . 9.9 tp -68.82 -51.24 42.8 Favored 'General case' 0 C--N 1.344 0.338 0 C-N-CA 117.262 -1.775 . . . . 0.0 109.41 175.148 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.448 ' HB3' ' O ' ' A' 1034 ' ' ASN . 25.3 t70 -45.03 -42.32 8.3 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 114.856 -1.066 . . . . 0.0 111.251 173.181 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.468 ' CG1' ' HG3' ' A' ' 983' ' ' GLU . 45.6 t -61.7 -40.6 87.34 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.489 0 CA-C-N 114.559 -1.201 . . . . 0.0 112.476 177.635 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.777 HG12 HG13 ' A' ' 984' ' ' ILE . 1.9 mp -83.31 -25.0 7.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 118.589 0.632 . . . . 0.0 110.522 177.327 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.746 ' O ' ' HG3' ' A' 1043 ' ' ARG . 68.9 m-20 -61.2 -45.1 95.97 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 164.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.457 ' HG2' HG13 ' A' ' 919' ' ' ILE . 43.0 mt-30 -62.04 -48.89 78.25 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.653 173.375 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.879 ' HB3' ' HG2' ' A' ' 983' ' ' GLU . . . -54.98 -45.86 75.03 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.61 -176.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.746 ' HG3' ' O ' ' A' 1040 ' ' ASP . 0.0 OUTLIER -59.9 -42.76 94.54 Favored 'General case' 0 N--CA 1.441 -0.875 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.906 -174.799 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.591 ' HB3' ' HE2' ' A' 1053 ' ' HIS . 43.0 tp -80.66 -34.72 34.59 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 121.13 0.49 . . . . 0.0 110.582 -178.684 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.586 ' HB2' ' HB2' ' A' 1053 ' ' HIS . 61.5 tttt -62.93 -49.8 73.35 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.016 -178.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.452 ' HG2' ' O ' ' A' 1042 ' ' ALA . 25.4 mmt -64.78 -36.91 85.85 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.676 -176.714 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.592 HG12 ' O ' ' A' 1043 ' ' ARG . 24.7 mm -52.88 -54.94 14.02 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.827 172.576 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 50.0 m -133.01 63.51 1.63 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.457 0.646 . . . . 0.0 111.805 -177.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -81.26 99.75 8.78 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.724 171.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1050 ' ' SER . . . . . 0.468 ' O ' ' HB2' ' A' 1051 ' ' ARG . 44.1 m -92.68 -1.78 56.59 Favored 'General case' 0 C--N 1.308 -1.236 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 173.037 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1051 ' ' ARG . . . . . 1.074 ' HB3' ' HD3' ' A' 1052 ' ' PRO . 44.8 ttp180 164.38 -68.34 0.0 OUTLIER Pre-proline 0 CA--C 1.538 0.494 0 CA-C-N 113.91 -1.495 . . . . 0.0 108.564 -177.204 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1052 ' ' PRO . . . . . 1.074 ' HD3' ' HB3' ' A' 1051 ' ' ARG . 67.4 Cg_endo -108.16 -152.33 0.02 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.173 0 C-N-CA 122.909 2.406 . . . . 0.0 112.028 177.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 1053 ' ' HIS . . . . . 0.591 ' HE2' ' HB3' ' A' 1044 ' ' LEU . 21.6 t-80 . . . . . 0 C--N 1.326 -0.421 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 171.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.747 0 N-CA-C 111.741 -0.544 . . . . 0.0 111.741 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 32.5 m -88.63 118.26 69.2 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-O 120.905 0.384 . . . . 0.0 111.125 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -92.05 25.55 0.46 Allowed 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 123.158 2.572 . . . . 0.0 110.995 174.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . 150.69 -155.65 26.28 Favored Glycine 0 N--CA 1.444 -0.801 0 N-CA-C 109.856 -1.298 . . . . 0.0 109.856 -175.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 9.5 tp -149.5 126.31 2.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 117.42 0.61 . . . . 0.0 110.568 176.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 8.3 p -172.02 -28.55 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.777 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 139.05 -27.35 2.67 Favored Glycine 0 N--CA 1.447 -0.613 0 N-CA-C 111.168 -0.773 . . . . 0.0 111.168 -176.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 82.89 -155.38 33.23 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.315 178.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . -82.87 60.09 4.91 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.985 -0.626 . . . . 0.0 112.661 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . -164.13 117.04 0.74 Allowed Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.031 178.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . 0.463 ' HA2' ' HD2' ' A' 1043 ' ' ARG . . . 171.88 150.84 7.41 Favored Glycine 0 C--O 1.226 -0.399 0 C-N-CA 120.862 -0.685 . . . . 0.0 111.792 179.257 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 919' ' ' ILE . . . . . 1.026 ' HA ' ' HB3' ' A' 1040 ' ' ASP . 38.7 pt -61.44 -175.78 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.344 0.336 0 CA-C-N 117.459 0.63 . . . . 0.0 111.675 -178.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.767 ' HG2' HG13 ' A' ' 919' ' ' ILE . 34.7 mmt180 71.33 20.5 4.96 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.745 174.737 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 921' ' ' SER . . . . . 0.429 ' HA ' ' OD2' ' A' 1040 ' ' ASP . 23.0 t 77.05 105.97 0.08 Allowed 'General case' 0 CA--C 1.513 -0.474 0 O-C-N 124.155 0.91 . . . . 0.0 110.293 -178.571 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.406 ' CG ' ' H ' ' A' ' 923' ' ' ASP . 51.5 t30 -61.41 172.1 1.25 Allowed 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 114.675 -1.148 . . . . 0.0 108.968 173.043 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.684 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 38.8 t70 -83.99 -87.22 0.11 Allowed 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -159.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.433 ' HA ' ' HG2' ' A' ' 927' ' ' GLU . 35.0 mmtp -56.74 -27.96 60.27 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -171.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.643 HG22 HD21 ' A' 1036 ' ' LEU . 32.2 m -62.93 -30.95 50.82 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-O 121.365 0.602 . . . . 0.0 110.322 178.325 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.684 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -77.38 -30.69 53.84 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.696 178.479 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . 0.603 ' O ' HG23 ' A' ' 930' ' ' THR . 7.7 pt-20 -76.4 -24.0 54.06 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 119.096 -1.042 . . . . 0.0 110.785 176.582 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -71.41 -29.94 65.49 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 171.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.6 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 86.9 t -80.35 -30.07 12.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.236 175.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.603 HG23 ' O ' ' A' ' 927' ' ' GLU . 2.8 t -65.81 -33.73 76.54 Favored 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 118.215 -1.394 . . . . 0.0 108.257 171.24 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -74.01 -53.51 7.02 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-N 115.366 -0.834 . . . . 0.0 113.572 176.341 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.6 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.2 pp -64.38 -48.37 75.75 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -177.16 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.448 HG23 HG11 ' A' ' 929' ' ' VAL . 54.6 t -69.35 -31.78 50.86 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.319 0 CA-C-O 120.755 0.312 . . . . 0.0 110.852 -175.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.573 ' HD2' ' C ' ' A' ' 934' ' ' LYS . 2.1 tmmm? -56.26 -50.3 71.73 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 175.44 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -57.88 -36.26 72.12 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.154 0.284 . . . . 0.0 111.29 -178.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.792 HG21 ' HB3' ' A' 1025 ' ' ALA . 86.1 t -50.82 -73.9 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.583 178.083 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 28.4 pt -67.25 -35.83 75.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -177.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -67.49 -55.73 12.38 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.733 0.778 . . . . 0.0 110.77 -174.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.562 ' HA ' ' HD2' ' A' ' 942' ' ' LYS . 1.3 mpt? -73.47 -23.9 60.13 Favored 'General case' 0 N--CA 1.438 -1.067 0 C-N-CA 119.776 -0.77 . . . . 0.0 108.969 -176.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.734 ' HG ' HD12 ' A' 1022 ' ' LEU . 44.5 t -53.16 -46.45 68.89 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.617 -178.809 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 5.7 m -86.82 -4.01 59.13 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 114.996 -1.002 . . . . 0.0 109.813 -175.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.695 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 33.5 mttp -81.01 -0.77 41.08 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 167.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.804 HD13 ' HA ' ' A' 1015 ' ' GLN . 9.6 tt -57.27 -16.58 4.94 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.116 162.511 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.711 ' HB3' ' HD3' ' A' ' 945' ' ' PRO . 34.3 tt0 -61.82 -52.75 66.3 Favored Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -175.517 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.711 ' HD3' ' HB3' ' A' ' 944' ' ' GLN . 50.7 Cg_exo -55.21 121.18 9.44 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 122.085 1.856 . . . . 0.0 112.181 172.281 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.473 ' HB3' ' HD3' ' A' ' 947' ' ' PRO . . . -61.49 -47.4 93.35 Favored Pre-proline 0 CA--C 1.539 0.528 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -176.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.473 ' HD3' ' HB3' ' A' ' 946' ' ' ALA . 52.7 Cg_exo -57.16 132.63 52.47 Favored 'Trans proline' 0 C--N 1.357 1.003 0 C-N-CA 121.823 1.682 . . . . 0.0 111.692 176.404 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.592 ' HB3' HG13 ' A' 1009 ' ' VAL . 1.9 Cg_endo -46.15 131.61 14.43 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 123.51 2.807 . . . . 0.0 114.384 -173.157 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 0.53 ' C ' ' H ' ' A' ' 951' ' ' TYR . 4.6 tt0 -70.26 -12.55 61.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.115 -0.948 . . . . 0.0 108.865 168.148 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.59 ' HB2' ' HG2' ' A' ' 953' ' ' PRO . 45.8 mm-40 75.98 -22.85 0.26 Allowed 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 114.364 -1.289 . . . . 0.0 109.772 -172.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.716 ' HB3' ' HG3' ' A' 1002 ' ' MET . 21.0 m-85 55.86 -54.91 0.02 OUTLIER 'General case' 0 C--O 1.221 -0.396 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 178.531 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 0.888 HG11 ' HD3' ' A' ' 953' ' ' PRO . 3.4 p -52.22 -36.81 36.05 Favored Pre-proline 0 CA--C 1.55 0.959 0 CA-C-N 118.506 0.594 . . . . 0.0 112.557 175.045 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 0.888 ' HD3' HG11 ' A' ' 952' ' ' VAL . 37.3 Cg_exo -53.47 -40.01 80.11 Favored 'Trans proline' 0 C--N 1.358 1.045 0 C-N-CA 121.699 1.599 . . . . 0.0 112.208 169.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.65 ' O ' HG23 ' A' ' 958' ' ' VAL . 8.5 ttt -76.33 -48.86 18.56 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.005 177.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.704 HG13 ' HA ' ' A' ' 952' ' ' VAL . 0.4 OUTLIER -54.05 -31.42 21.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.545 173.736 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 5.5 tttm -65.52 -40.97 93.61 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.064 170.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . 0.552 ' HG2' ' O ' ' A' ' 954' ' ' MET . 14.5 pt-20 -79.38 -42.95 24.4 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 120.393 -0.523 . . . . 0.0 111.023 -176.2 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 954' ' ' MET . 2.2 t -66.26 -38.26 81.49 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.821 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 173.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . 0.426 ' O ' ' HG2' ' A' ' 963' ' ' ARG . . . -58.49 -38.88 92.16 Favored Glycine 0 N--CA 1.434 -1.462 0 N-CA-C 110.813 -0.915 . . . . 0.0 110.813 176.15 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . 0.607 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 25.3 tp -69.14 -35.82 76.77 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 120.766 0.317 . . . . 0.0 110.818 174.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -72.29 -43.31 64.43 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.135 0.493 . . . . 0.0 111.643 -176.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.866 HD11 ' HG ' ' A' ' 995' ' ' LEU . 4.4 pp -86.33 -16.7 36.61 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.968 -176.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.607 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 0.5 OUTLIER -75.42 -32.79 60.83 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 119.064 -1.054 . . . . 0.0 109.939 164.239 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 964' ' ' THR . . . . . 0.568 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 59.1 m -64.55 -34.44 78.25 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 175.169 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.474 HD21 HD22 ' A' 1035 ' ' LEU . 26.9 tp -62.78 -41.51 99.28 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.776 173.328 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.732 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.0 tt -70.06 -36.68 75.16 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.049 -175.327 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -72.45 -38.13 68.37 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.306 178.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 7.9 p -66.07 -41.01 91.33 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 118.644 0.656 . . . . 0.0 110.005 175.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.525 HG12 HG23 ' A' ' 984' ' ' ILE . 74.4 t -68.25 -39.11 80.58 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.526 173.631 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.816 ' HB2' HE22 ' A' ' 988' ' ' GLN . 13.1 t70 -66.53 -39.68 88.75 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 122.228 1.014 . . . . 0.0 108.77 -177.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.57 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 28.7 tt0 -70.69 -30.58 67.19 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 114.488 -1.233 . . . . 0.0 110.335 178.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 70.2 m -66.26 -17.74 64.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.272 173.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.604 ' HA ' HD13 ' A' ' 984' ' ' ILE . 10.5 tt -69.41 -51.81 16.17 Favored Pre-proline 0 CA--C 1.53 0.187 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.776 -176.085 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.57 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 94.9 Cg_endo -87.42 2.04 6.9 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 121.178 1.252 . . . . 0.0 113.45 174.426 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.436 HG22 ' O ' ' A' ' 971' ' ' GLU . 25.1 t -85.79 -42.27 15.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.253 172.678 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -106.67 111.75 63.82 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.249 -178.247 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -78.37 -141.93 0.02 OUTLIER 'Trans proline' 0 CA--C 1.532 0.382 0 C-N-CA 123.422 2.748 . . . . 0.0 111.967 178.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . 0.716 ' O ' ' HB3' ' A' 1046 ' ' MET . . . 67.74 16.13 9.72 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.881 173.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.445 ' HB2' ' O ' ' A' ' 978' ' ' ALA . 48.5 m 78.18 11.24 1.88 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.328 0.651 . . . . 0.0 112.471 179.534 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.621 ' OG1' ' HA ' ' A' 1043 ' ' ARG . 85.5 m -64.66 -21.94 66.85 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.147 0.499 . . . . 0.0 110.778 177.58 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -50.79 -27.36 7.11 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 178.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . 0.563 ' HA ' ' HG2' ' A' ' 985' ' ' GLU . 0.0 OUTLIER -83.11 -21.87 33.55 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 119.481 1.037 . . . . 0.0 111.149 -176.127 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.433 ' HG2' ' HB3' ' A' 1042 ' ' ALA . 1.4 mp0 -77.03 -38.7 52.32 Favored 'General case' 0 CA--C 1.499 -0.981 0 CA-C-O 121.764 0.792 . . . . 0.0 109.143 168.552 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.808 HG12 HG12 ' A' 1039 ' ' ILE . 73.8 mt -68.17 -36.28 74.63 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.18 0 CA-C-N 114.145 -1.389 . . . . 0.0 109.503 -176.354 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . 0.767 ' O ' ' HD3' ' A' ' 989' ' ' LYS . 13.3 pt-20 -74.29 -40.8 62.03 Favored 'General case' 0 N--CA 1.439 -0.988 0 C-N-CA 118.159 -1.416 . . . . 0.0 109.426 -178.557 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 986' ' ' MET . . . . . 0.516 ' O ' ' HB2' ' A' ' 989' ' ' LYS . 2.1 tmt? -68.63 -40.0 80.5 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.56 -174.428 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.993 ' HB2' ' HB2' ' A' 1035 ' ' LEU . . . -71.88 -45.78 60.09 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.571 -174.104 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.816 HE22 ' HB2' ' A' ' 970' ' ' ASP . 4.4 pt20 -60.31 -23.89 64.56 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.808 175.284 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . 0.796 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 2.6 mptp? -72.55 -39.05 67.78 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.986 0.898 . . . . 0.0 111.05 171.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.584 ' HB3' ' O ' ' A' ' 987' ' ' ALA . 18.6 tp -54.32 -59.66 4.38 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.414 -1.267 . . . . 0.0 111.853 179.135 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.519 ' HB2' HD13 ' A' 1035 ' ' LEU . 0.4 OUTLIER -59.96 -33.06 71.41 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.745 0.783 . . . . 0.0 109.417 177.722 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . 0.796 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 22.7 t-20 -52.03 -52.57 50.01 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 113.911 -1.495 . . . . 0.0 111.438 179.569 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 2.6 p -77.59 -31.61 53.12 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.673 0.619 . . . . 0.0 112.673 -178.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -68.47 -40.51 80.99 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 119.729 -0.789 . . . . 0.0 111.189 176.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.866 ' HG ' HD11 ' A' ' 962' ' ' LEU . 0.9 OUTLIER -57.09 -36.65 70.84 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.066 0.546 . . . . 0.0 109.935 166.843 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -66.65 -30.39 70.63 Favored 'General case' 0 C--N 1.312 -1.052 0 C-N-CA 118.985 -1.086 . . . . 0.0 110.903 174.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -75.42 -38.33 59.86 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.853 -0.53 . . . . 0.0 110.678 174.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.866 HD12 ' HB1' ' A' 1025 ' ' ALA . 1.7 tp -56.23 -44.85 80.0 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 120.968 0.413 . . . . 0.0 110.843 178.546 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.508 ' O ' ' HB2' ' A' 1003 ' ' LYS . 77.8 mt -61.21 -43.97 97.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.084 -176.493 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 32.0 m-80 -58.64 -37.49 76.06 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.251 0.548 . . . . 0.0 111.915 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.501 ' O ' ' HB3' ' A' 1017 ' ' TYR . 33.6 mmtp -79.1 -40.92 29.88 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 122.291 1.043 . . . . 0.0 108.656 -176.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.716 ' HG3' ' HB3' ' A' ' 951' ' ' TYR . 9.0 tpp -61.15 -30.09 70.18 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 113.693 -1.594 . . . . 0.0 109.461 176.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.56 ' O ' ' HG3' ' A' 1006 ' ' GLN . 4.8 tptm -75.41 -53.54 8.54 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 114.928 -1.033 . . . . 0.0 111.696 -166.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.728 ' HB3' HD21 ' A' 1013 ' ' LEU . 7.3 mp -76.61 -12.43 60.01 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.149 -178.593 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1005 ' ' ALA . . . . . 0.653 ' HB3' ' HB3' ' A' 1017 ' ' TYR . . . -67.91 -42.63 80.81 Favored 'General case' 0 C--O 1.212 -0.874 0 C-N-CA 119.525 -0.87 . . . . 0.0 109.153 177.034 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.882 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -74.77 -33.16 62.25 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 119.024 -0.512 . . . . 0.0 111.668 170.3 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.637 ' HA ' HE21 ' A' 1007 ' ' GLN . 0.0 OUTLIER -47.53 -53.37 14.62 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.116 0.484 . . . . 0.0 110.388 175.609 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.88 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 40.1 m-85 -119.6 40.35 3.4 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.277 -0.569 . . . . 0.0 110.407 175.249 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 1.106 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 14.8 p -51.62 -22.29 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 121.382 0.611 . . . . 0.0 110.632 173.733 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1010 ' ' MET . . . . . 0.425 ' N ' HG12 ' A' 1009 ' ' VAL . 20.0 mmt -41.16 -38.18 1.03 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.242 -1.345 . . . . 0.0 111.706 175.486 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -174.47 -81.77 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 174.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 16.6 p -53.43 -73.52 0.04 OUTLIER 'General case' 0 C--O 1.241 0.649 0 CA-C-N 115.12 -0.945 . . . . 0.0 113.051 -166.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.88 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 3.2 mp -46.1 -42.17 13.27 Favored 'General case' 0 CA--C 1.501 -0.921 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -179.502 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 1.106 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -57.33 -46.37 83.33 Favored 'General case' 0 N--CA 1.438 -1.035 0 O-C-N 123.753 0.658 . . . . 0.0 111.616 -166.552 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A 1015 ' ' GLN . . . . . 0.804 ' HA ' HD13 ' A' ' 943' ' ' ILE . 47.2 mt-30 -72.52 -34.46 67.6 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 121.013 0.435 . . . . 0.0 110.103 -174.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -71.17 -53.25 15.11 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.856 0.836 . . . . 0.0 110.466 176.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.711 ' CE2' ' HG ' ' A' 1013 ' ' LEU . 7.1 m-85 -67.77 -38.82 83.92 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.618 -1.174 . . . . 0.0 113.95 -172.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.573 ' HZ2' ' HE1' ' A' ' 951' ' ' TYR . 24.0 tptm -80.03 -29.88 39.42 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.91 -176.216 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1019 ' ' LYS . . . . . 0.708 ' HB3' ' O ' ' A' 1015 ' ' GLN . 1.5 tmtt? -76.21 -40.32 52.51 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.73 176.552 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1020 ' ' GLN . . . . . 0.424 ' N ' ' HD3' ' A' 1019 ' ' LYS . 25.4 mt-30 -63.9 -28.48 69.86 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.731 162.84 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.698 ' HG2' HD11 ' A' ' 998' ' ' LEU . 1.6 ttp -65.61 -47.11 76.77 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 176.622 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1022 ' ' LEU . . . . . 0.734 HD12 ' HG ' ' A' ' 940' ' ' SER . 0.0 OUTLIER -79.19 -8.96 59.42 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 119.165 -1.014 . . . . 0.0 109.767 -179.249 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 92.2 m -77.0 -44.03 32.5 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 172.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.465 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.88 -21.1 47.96 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-O 121.383 0.611 . . . . 0.0 109.659 175.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.866 ' HB1' HD12 ' A' ' 998' ' ' LEU . . . -83.94 -24.01 30.88 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.128 170.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.523 ' HB2' ' O ' ' A' 1022 ' ' LEU . 1.9 t60 -77.96 -22.66 49.15 Favored 'General case' 0 C--O 1.216 -0.658 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 165.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1027 ' ' ALA . . . . . 0.459 ' HB1' ' O ' ' A' 1024 ' ' ALA . . . -69.6 -42.39 74.47 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 123.094 0.558 . . . . 0.0 109.768 162.378 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.655 HD23 ' N ' ' A' ' 995' ' ' LEU . 34.7 mt -57.25 -49.48 75.93 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 169.696 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -58.05 -43.23 86.77 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 174.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.459 ' O ' ' HB2' ' A' 1033 ' ' LYS . 2.8 t -67.72 -51.01 55.23 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.234 0 CA-C-O 121.287 0.565 . . . . 0.0 110.394 -176.1 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.583 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 18.0 m-20 -76.6 -27.31 55.73 Favored 'General case' 0 C--O 1.213 -0.821 0 CA-C-N 115.475 -0.784 . . . . 0.0 112.024 -176.424 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.644 ' HA ' HD23 ' A' 1035 ' ' LEU . . . -61.47 -40.7 95.47 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 167.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.459 ' HB2' ' O ' ' A' 1030 ' ' VAL . 94.3 mttt -62.86 -39.72 95.27 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.444 0.64 . . . . 0.0 109.72 171.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.583 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 46.6 t30 -76.26 -54.67 6.45 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.856 -170.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.993 ' HB2' ' HB2' ' A' ' 987' ' ' ALA . 0.6 OUTLIER -61.71 -42.99 99.69 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 118.782 -0.628 . . . . 0.0 110.953 -173.307 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.648 ' H ' HD21 ' A' 1035 ' ' LEU . 4.6 pp -70.04 -39.87 75.46 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 116.472 -2.091 . . . . 0.0 109.628 -178.67 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.503 ' N ' HD12 ' A' 1036 ' ' LEU . 38.2 t70 -53.23 -43.33 67.21 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 122.098 0.951 . . . . 0.0 110.83 173.249 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.538 ' HB ' ' O ' ' A' 1035 ' ' LEU . 9.7 t -50.83 -48.82 27.99 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.585 0 CA-C-N 114.061 -1.427 . . . . 0.0 111.299 172.29 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.808 HG12 HG12 ' A' ' 984' ' ' ILE . 2.7 mp -74.95 -34.05 31.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 118.45 0.568 . . . . 0.0 110.912 178.36 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 1.026 ' HB3' ' HA ' ' A' ' 919' ' ' ILE . 83.5 m-20 -51.39 -53.9 31.94 Favored 'General case' 0 C--O 1.246 0.88 0 CA-C-O 122.403 1.097 . . . . 0.0 109.237 172.165 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -76.78 -32.14 57.48 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 115.122 -0.945 . . . . 0.0 110.9 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.658 ' HB1' ' HA ' ' A' 1039 ' ' ILE . . . -54.82 -50.84 67.6 Favored 'General case' 0 CA--C 1.501 -0.922 0 C-N-CA 123.389 0.676 . . . . 0.0 111.62 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.655 ' HD3' ' N ' ' A' 1044 ' ' LEU . 0.0 OUTLIER -61.94 -37.66 85.54 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.723 -176.622 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.655 ' N ' ' HD3' ' A' 1043 ' ' ARG . 15.4 mt -76.02 -41.95 49.4 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.967 178.316 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.598 ' N ' ' HD2' ' A' 1053 ' ' HIS . 31.9 ttpt -55.53 -49.61 72.18 Favored 'General case' 0 C--O 1.215 -0.743 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.091 179.226 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.716 ' HB3' ' O ' ' A' ' 978' ' ' ALA . 18.0 mmt -64.85 -37.02 86.24 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.841 -0.618 . . . . 0.0 112.105 -176.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.65 HG12 ' O ' ' A' 1043 ' ' ARG . 24.8 mm -48.34 -44.32 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.727 172.32 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 48.8 m -148.71 63.28 1.07 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.053 -176.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -64.35 -15.71 60.89 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -174.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 20.3 p -77.41 1.84 17.83 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 120.657 0.265 . . . . 0.0 111.38 177.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 -152.06 138.21 11.65 Favored Pre-proline 0 C--N 1.331 -0.197 0 CA-C-O 120.829 0.347 . . . . 0.0 110.51 174.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -64.25 117.63 4.65 Favored 'Trans proline' 0 CA--C 1.528 0.193 0 C-N-CA 122.517 2.145 . . . . 0.0 112.434 -178.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 1053 ' ' HIS . . . . . 0.598 ' HD2' ' N ' ' A' 1045 ' ' LYS . 0.7 OUTLIER . . . . . 0 N--CA 1.466 0.359 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.578 178.393 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.681 0 N-CA-C 111.951 -0.459 . . . . 0.0 111.951 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 20.4 m -77.94 121.13 83.65 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-O 120.543 0.211 . . . . 0.0 110.728 179.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_exo -67.84 105.36 1.12 Allowed 'Trans proline' 0 N--CA 1.46 -0.441 0 C-N-CA 122.738 2.292 . . . . 0.0 111.34 175.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -83.15 160.44 38.48 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.637 -178.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 2.7 pp -121.37 156.84 25.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.262 0.077 . . . . 0.0 110.992 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 10.0 t 56.64 80.62 0.15 Allowed 'General case' 0 C--O 1.233 0.217 0 O-C-N 123.923 0.764 . . . . 0.0 110.893 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 78.69 11.86 84.82 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.511 -176.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . -89.79 134.72 12.53 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.033 -178.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . 81.69 9.92 84.95 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.633 177.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . 134.16 -109.7 0.81 Allowed Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.246 179.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . 0.682 ' H ' HD22 ' A' 1044 ' ' LEU . . . 64.61 -124.5 29.27 Favored Glycine 0 CA--C 1.521 0.413 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.849 -177.223 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 919' ' ' ILE . . . . . 0.573 ' HA ' ' HB3' ' A' 1040 ' ' ASP . 0.1 OUTLIER -75.16 122.97 29.94 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.49 0 C-N-CA 124.035 0.934 . . . . 0.0 111.058 -176.165 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . . . . . . . . . 36.1 ttp180 -173.13 -28.28 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 15.1 t -139.06 78.1 1.65 Allowed 'General case' 0 C--O 1.237 0.407 0 N-CA-C 113.588 0.959 . . . . 0.0 113.588 -167.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.521 ' O ' HG23 ' A' ' 925' ' ' VAL . 41.1 t-20 -179.48 56.55 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 168.816 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.634 ' HB2' ' CE1' ' A' ' 926' ' ' TYR . 2.0 p30 -72.37 14.77 0.21 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 114.217 1.192 . . . . 0.0 114.217 -174.716 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.568 ' HB3' HG22 ' A' ' 968' ' ' THR . 51.2 mmtt -76.74 -42.49 40.92 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 120.556 -1.34 . . . . 0.0 111.249 172.393 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.658 ' CG2' ' HB2' ' A' 1036 ' ' LEU . 17.0 m -62.04 -35.06 66.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.365 0.602 . . . . 0.0 110.8 -178.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.634 ' CE1' ' HB2' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -77.5 -27.16 51.78 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 118.598 -0.715 . . . . 0.0 111.863 177.383 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . 0.497 ' O ' HG21 ' A' ' 930' ' ' THR . 6.6 pt-20 -75.75 -23.81 56.03 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 120.482 1.492 . . . . 0.0 109.784 178.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -76.36 -29.14 57.07 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 121.347 0.594 . . . . 0.0 110.19 172.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.619 HG22 HD21 ' A' 1036 ' ' LEU . 82.0 t -82.15 -31.99 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.729 175.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.497 HG21 ' O ' ' A' ' 927' ' ' GLU . 5.8 t -62.47 -29.34 70.46 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 120.349 1.432 . . . . 0.0 107.873 171.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -70.32 -52.22 18.41 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-N 114.452 -1.249 . . . . 0.0 113.17 171.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.576 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.0 pp -62.16 -48.31 80.66 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 117.648 0.724 . . . . 0.0 112.792 -178.03 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.692 ' O ' HG22 ' A' ' 936' ' ' VAL . 56.7 t -60.81 -41.83 90.06 Favored 'Isoleucine or valine' 0 C--O 1.239 0.535 0 CA-C-O 121.777 0.799 . . . . 0.0 109.703 -177.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -53.72 -43.3 68.92 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.7 -1.136 . . . . 0.0 110.322 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -67.89 -31.64 71.57 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -176.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.692 HG22 ' O ' ' A' ' 933' ' ' VAL . 2.9 m -61.59 -56.95 14.45 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.271 0 C-N-CA 121.004 -0.278 . . . . 0.0 111.048 -174.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.434 ' N ' HG23 ' A' ' 936' ' ' VAL . 7.1 pt -78.52 -40.32 24.3 Favored 'Isoleucine or valine' 0 C--O 1.25 1.118 0 CA-C-O 121.12 0.486 . . . . 0.0 111.257 -178.478 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -65.55 -49.21 69.75 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.696 -171.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.693 ' O ' HG22 ' A' ' 943' ' ' ILE . 26.2 mmt -71.92 -26.18 62.2 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.6 -179.074 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 940' ' ' SER . . . . . . . . . . . . . 5.2 m -50.86 -43.13 59.33 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-O 121.218 0.533 . . . . 0.0 111.421 -176.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 941' ' ' SER . . . . . 0.632 ' HA ' ' HG3' ' A' ' 945' ' ' PRO . 42.6 m -105.59 -15.11 15.07 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 178.73 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . . . . . . . . . 6.6 tmtm? -85.18 -53.61 5.14 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 120.161 -0.616 . . . . 0.0 111.696 -172.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.693 HG22 ' O ' ' A' ' 939' ' ' MET . 10.8 tp -62.71 -0.14 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.924 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 178.541 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.697 ' HB3' ' HD2' ' A' ' 947' ' ' PRO . 47.4 mt-30 99.49 100.28 0.01 OUTLIER Pre-proline 0 N--CA 1.477 0.915 0 C-N-CA 124.927 1.291 . . . . 0.0 112.559 166.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.632 ' HG3' ' HA ' ' A' ' 941' ' ' SER . 80.8 Cg_endo -91.09 40.26 0.35 Allowed 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 123.784 2.989 . . . . 0.0 111.942 178.488 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.84 ' HB2' ' HD3' ' A' ' 947' ' ' PRO . . . -136.24 -51.83 0.02 OUTLIER Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.519 177.625 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.84 ' HD3' ' HB2' ' A' ' 946' ' ' ALA . 1.0 OUTLIER -85.95 171.39 8.1 Favored 'Trans proline' 0 N--CA 1.454 -0.811 0 C-N-CA 122.262 1.974 . . . . 0.0 108.62 160.87 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.605 ' CA ' HG21 ' A' 1009 ' ' VAL . 13.9 Cg_endo -64.21 116.21 3.6 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 120.91 1.074 . . . . 0.0 112.755 177.634 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 0.547 ' C ' ' H ' ' A' ' 951' ' ' TYR . 50.7 mt-10 -57.75 -19.61 28.95 Favored 'General case' 0 C--N 1.333 -0.127 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 165.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.668 ' HB3' ' HG2' ' A' ' 953' ' ' PRO . 21.2 tp10 73.12 -10.86 0.95 Allowed 'General case' 0 C--N 1.345 0.401 0 CA-C-N 114.302 -1.317 . . . . 0.0 108.85 -170.478 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.795 ' CE1' ' HD3' ' A' 1018 ' ' LYS . 39.0 m-85 53.01 -54.11 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 125.632 1.573 . . . . 0.0 114.397 -178.223 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 0.835 HG22 ' HE1' ' A' 1002 ' ' MET . 22.3 t -43.66 -48.45 19.72 Favored Pre-proline 0 C--N 1.322 -0.606 0 C-N-CA 122.793 0.437 . . . . 0.0 111.98 174.291 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 0.668 ' HG2' ' HB3' ' A' ' 950' ' ' GLU . 13.8 Cg_exo -47.6 -49.26 13.71 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 122.861 2.374 . . . . 0.0 113.995 178.303 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.622 ' HG3' ' O ' ' A' ' 951' ' ' TYR . 4.5 ppp? -76.43 -32.26 58.35 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.212 0.529 . . . . 0.0 110.54 179.297 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.5 ' HA ' HG11 ' A' ' 958' ' ' VAL . 78.5 t -57.42 -35.3 49.0 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.374 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.327 168.156 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.489 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 9.9 tmtt? -65.71 -32.25 73.7 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.626 0.25 . . . . 0.0 111.122 173.489 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -77.99 -45.45 23.74 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.831 0.348 . . . . 0.0 110.993 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.5 HG11 ' HA ' ' A' ' 955' ' ' VAL . 13.3 p -76.4 -31.95 21.21 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.19 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.069 178.386 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . 0.471 ' O ' ' HG2' ' A' ' 963' ' ' ARG . . . -61.21 -38.39 95.57 Favored Glycine 0 N--CA 1.446 -0.685 0 N-CA-C 110.867 -0.893 . . . . 0.0 110.867 173.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . 0.482 HD12 HH11 ' A' ' 963' ' ' ARG . 15.5 tp -64.26 -42.79 96.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.929 0.395 . . . . 0.0 110.506 175.285 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -73.28 -34.61 65.87 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.087 0.47 . . . . 0.0 111.936 -176.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.835 HD13 HD22 ' A' ' 995' ' ' LEU . 3.6 pp -80.83 -30.34 35.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.83 -179.092 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.482 HH11 HD12 ' A' ' 960' ' ' LEU . 9.8 ptp85 -72.71 -33.8 66.68 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 119.629 -0.828 . . . . 0.0 110.943 170.538 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 964' ' ' THR . . . . . 0.454 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 17.6 m -66.57 -33.52 75.85 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 119.603 -0.839 . . . . 0.0 108.974 176.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.483 ' O ' HG23 ' A' ' 969' ' ' VAL . 17.2 tp -60.84 -49.45 77.44 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.558 0.694 . . . . 0.0 109.612 170.306 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.558 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.4 tt -55.26 -45.34 76.1 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 114.459 -1.246 . . . . 0.0 109.735 -178.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -66.42 -42.01 88.39 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.007 -0.997 . . . . 0.0 112.131 178.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.568 HG22 ' HB3' ' A' ' 924' ' ' LYS . 0.8 OUTLIER -61.85 -34.91 76.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 119.193 0.906 . . . . 0.0 110.817 175.838 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.962 HG13 HG22 ' A' ' 984' ' ' ILE . 52.7 t -73.38 -42.03 57.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.916 175.54 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.947 ' HB2' HE22 ' A' ' 988' ' ' GLN . 31.4 t70 -69.9 -40.02 75.86 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 122.111 0.957 . . . . 0.0 109.228 -175.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.604 ' O ' HG22 ' A' ' 975' ' ' VAL . 9.1 tp10 -66.69 -31.89 72.84 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.63 -1.168 . . . . 0.0 109.483 177.036 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.652 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 27.3 m -68.76 -17.35 64.02 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.256 174.681 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.733 ' HB2' HG23 ' A' ' 984' ' ' ILE . 9.0 tt -64.39 -51.94 57.07 Favored Pre-proline 0 C--O 1.226 -0.134 0 C-N-CA 120.451 -0.499 . . . . 0.0 109.969 -178.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.732 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 6.3 Cg_exo -80.99 -4.0 12.5 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 121.515 1.477 . . . . 0.0 113.262 171.571 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.652 ' HB ' ' HA ' ' A' ' 972' ' ' SER . 24.6 t -73.07 -49.76 36.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.204 172.206 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.519 ' HA ' ' HD3' ' A' ' 977' ' ' PRO . 3.9 mm? -80.81 125.51 80.04 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.254 -178.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . 0.519 ' HD3' ' HA ' ' A' ' 976' ' ' LEU . 2.2 Cg_endo -83.38 0.31 9.54 Favored 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 123.452 2.768 . . . . 0.0 112.164 179.02 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -99.13 -174.92 2.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.431 179.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.596 ' HB2' ' SD ' ' A' 1046 ' ' MET . 27.4 m -77.5 20.95 0.29 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.895 0.332 . . . . 0.0 111.895 -178.276 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.773 ' HG1' ' HA ' ' A' 1043 ' ' ARG . 20.6 m -64.08 -14.2 52.88 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 121.382 0.611 . . . . 0.0 110.308 177.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.613 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 11.6 m170 -50.88 -39.71 54.63 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 115.061 -0.972 . . . . 0.0 111.722 177.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . 0.422 ' HE ' ' HB3' ' A' ' 982' ' ' ARG . 5.6 ptp180 -83.41 -20.71 33.67 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.629 -0.428 . . . . 0.0 112.116 -173.03 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.698 ' CG ' ' HB2' ' A' 1053 ' ' HIS . 1.3 mp0 -71.44 -34.7 70.51 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-O 121.614 0.721 . . . . 0.0 109.275 167.58 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.962 HG22 HG13 ' A' ' 969' ' ' VAL . 58.1 mt -72.24 -30.52 35.84 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-N 114.662 -1.154 . . . . 0.0 108.895 179.282 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . 0.613 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 35.5 mt-10 -65.41 -52.46 53.22 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.569 174.199 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 51.9 tpp -70.83 -42.52 70.09 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.913 -171.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.634 ' HB3' ' HB3' ' A' 1035 ' ' LEU . . . -74.21 -50.69 18.09 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.45 -172.263 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.947 HE22 ' HB2' ' A' ' 970' ' ' ASP . 2.7 pt20 -65.48 -22.2 66.71 Favored 'General case' 0 C--O 1.226 -0.151 0 CA-C-O 121.617 0.723 . . . . 0.0 109.204 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . 0.726 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 9.0 ttmm -73.47 -44.42 58.01 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 114.786 -1.097 . . . . 0.0 112.018 171.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.674 ' HB3' HD23 ' A' 1035 ' ' LEU . 15.6 tp -57.39 -58.36 8.62 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 119.569 -0.852 . . . . 0.0 111.705 -179.173 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.514 ' HB3' HD22 ' A' 1035 ' ' LEU . 3.2 pp -57.86 -29.62 65.15 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.38 0.609 . . . . 0.0 110.358 177.82 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . 0.726 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 44.9 t-20 -55.55 -55.91 26.41 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.637 -1.165 . . . . 0.0 110.986 175.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 46.2 m -73.01 -32.98 65.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.997 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . 0.713 ' C ' HD23 ' A' ' 998' ' ' LEU . 2.6 m-20 -55.08 -62.5 1.62 Allowed 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.903 174.412 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.835 HD22 HD13 ' A' ' 962' ' ' LEU . 18.0 tp -48.2 -30.06 4.32 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 123.291 0.37 . . . . 0.0 111.165 175.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -69.74 -37.87 76.63 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 119.556 -0.858 . . . . 0.0 111.764 178.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -78.26 -39.55 39.81 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.523 0.677 . . . . 0.0 109.937 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 1.038 HD21 ' HG ' ' A' 1028 ' ' LEU . 0.0 OUTLIER -58.18 -34.18 70.05 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.086 179.746 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.807 HG21 ' HE3' ' A' 1002 ' ' MET . 44.1 mt -67.1 -37.74 79.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 CA-C-N 115.11 -0.95 . . . . 0.0 111.78 172.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.56 -34.77 74.64 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.365 0.602 . . . . 0.0 111.668 179.159 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.715 ' HD2' ' OE1' ' A' 1020 ' ' GLN . 42.8 mmtm -82.61 -41.34 19.63 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.418 0.628 . . . . 0.0 110.904 -175.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.835 ' HE1' HG22 ' A' ' 952' ' ' VAL . 0.0 OUTLIER -61.25 -25.95 67.43 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 122.248 1.023 . . . . 0.0 108.642 175.326 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.594 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 26.8 tptt -71.83 -54.07 11.29 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 113.913 -1.494 . . . . 0.0 110.458 -167.338 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.796 ' HB3' HD21 ' A' 1013 ' ' LEU . 8.7 mp -73.65 -13.48 61.0 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.671 -179.424 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1005 ' ' ALA . . . . . 0.738 ' HB3' ' HB3' ' A' 1017 ' ' TYR . . . -68.97 -44.98 71.82 Favored 'General case' 0 C--N 1.319 -0.747 0 C-N-CA 119.533 -0.867 . . . . 0.0 109.983 178.087 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.861 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 1.0 OUTLIER -74.44 -28.57 61.11 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 121.891 -0.506 . . . . 0.0 111.265 173.406 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.933 ' HA ' HE21 ' A' 1007 ' ' GLN . 0.0 OUTLIER -50.16 -57.54 7.51 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.277 0.56 . . . . 0.0 110.25 173.995 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 1.035 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 24.2 m-85 -107.16 35.06 3.17 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.984 175.355 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 1.012 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 11.2 p -45.39 -29.11 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.494 0 O-C-N 123.536 0.522 . . . . 0.0 110.954 174.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1010 ' ' MET . . . . . 0.407 ' N ' HG11 ' A' 1009 ' ' VAL . 25.8 ttp -40.47 -45.78 2.31 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.52 -1.218 . . . . 0.0 111.599 178.745 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1011 ' ' THR . . . . . 0.403 ' HG1' ' C ' ' A' 1010 ' ' MET . 28.1 m -161.53 -82.37 0.04 OUTLIER 'General case' 0 C--O 1.245 0.853 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 176.367 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 11.2 p -55.75 -71.64 0.08 Allowed 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.067 -0.97 . . . . 0.0 113.115 -164.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 1.035 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 6.5 mp -51.84 -38.0 54.18 Favored 'General case' 0 CA--C 1.506 -0.736 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -178.207 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 1.012 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -55.19 -53.54 54.76 Favored 'General case' 0 N--CA 1.442 -0.837 0 O-C-N 123.423 0.452 . . . . 0.0 111.599 -168.264 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A 1015 ' ' GLN . . . . . 0.465 HE21 ' HB3' ' A' 1015 ' ' GLN . 1.3 pt20 -73.45 -36.55 65.91 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.569 -175.677 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1016 ' ' GLU . . . . . 0.445 ' HG2' ' NE2' ' A' 1020 ' ' GLN . 36.5 tt0 -68.27 -57.63 5.67 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.566 178.775 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.741 ' CE1' ' HG ' ' A' 1013 ' ' LEU . 7.3 m-85 -62.03 -33.15 73.82 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 113.696 0.999 . . . . 0.0 113.696 -176.324 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.795 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 35.0 tptt -80.24 -32.12 38.43 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.582 -176.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1019 ' ' LYS . . . . . 0.45 ' HA ' ' HD2' ' A' 1019 ' ' LYS . 0.2 OUTLIER -74.59 -35.37 63.0 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 176.347 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A 1020 ' ' GLN . . . . . 0.715 ' OE1' ' HD2' ' A' 1001 ' ' LYS . 77.5 mt-30 -56.59 -41.16 76.52 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.718 158.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.536 ' HB3' ' HD2' ' A' 1018 ' ' LYS . 1.5 tmt? -65.99 -51.8 55.12 Favored 'General case' 0 C--O 1.219 -0.544 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -172.468 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.84 -18.5 53.91 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 119.676 -0.81 . . . . 0.0 110.394 -172.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 34.6 m -84.17 -27.02 28.36 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 175.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.732 ' HB2' ' CD1' ' A' ' 998' ' ' LEU . . . -81.36 -28.14 34.59 Favored 'General case' 0 C--O 1.212 -0.904 0 CA-C-N 115.454 -0.793 . . . . 0.0 109.596 172.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.556 ' HA ' ' HB2' ' A' 1028 ' ' LEU . . . -83.38 -19.6 35.76 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 169.399 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.522 ' O ' HG21 ' A' 1030 ' ' VAL . 32.7 t-80 -75.12 -21.75 58.65 Favored 'General case' 0 C--O 1.213 -0.863 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 161.522 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1027 ' ' ALA . . . . . 0.665 ' HB1' ' O ' ' A' 1024 ' ' ALA . . . -74.32 -39.46 62.84 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.33 0.652 . . . . 0.0 110.098 166.464 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 1.038 ' HG ' HD21 ' A' ' 998' ' ' LEU . 23.0 mt -55.92 -49.59 73.03 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 164.037 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1029 ' ' ALA . . . . . 0.509 ' CB ' HG22 ' A' ' 933' ' ' VAL . . . -60.21 -38.79 84.4 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 112.64 0.607 . . . . 0.0 112.64 177.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.522 HG21 ' O ' ' A' 1026 ' ' HIS . 11.3 t -75.89 -51.46 20.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.358 0.599 . . . . 0.0 110.995 -175.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.581 ' O ' HD21 ' A' 1035 ' ' LEU . 6.6 m-20 -75.39 -33.59 61.02 Favored 'General case' 0 C--O 1.212 -0.907 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.149 -176.384 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.424 ' HB1' HD23 ' A' ' 965' ' ' LEU . . . -70.88 -24.99 62.6 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.559 -0.456 . . . . 0.0 109.938 174.333 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.489 ' HB3' ' O ' ' A' 1030 ' ' VAL . 50.6 tttm -63.38 -52.2 62.64 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 167.4 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.48 ' O ' HG21 ' A' 1038 ' ' VAL . 52.5 t30 -63.51 -50.12 70.84 Favored 'General case' 0 C--O 1.209 -1.038 0 CA-C-N 114.599 -1.182 . . . . 0.0 111.48 -177.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.674 HD23 ' HB3' ' A' ' 990' ' ' LEU . 0.0 OUTLIER -59.29 -42.07 90.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 119.395 -0.336 . . . . 0.0 110.498 -178.067 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.658 ' HB2' ' CG2' ' A' ' 925' ' ' VAL . 3.2 pp -69.69 -41.26 75.66 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 117.549 -1.66 . . . . 0.0 109.295 179.712 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 14.1 t70 -56.3 -40.0 73.64 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 114.37 -1.287 . . . . 0.0 109.786 175.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.52 ' HB ' ' O ' ' A' 1035 ' ' LEU . 6.6 t -53.47 -48.34 58.0 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.091 0 CA-C-N 113.822 -1.536 . . . . 0.0 111.053 174.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.633 ' HA ' ' HB2' ' A' 1042 ' ' ALA . 2.0 mp -74.27 -33.96 35.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 118.792 0.723 . . . . 0.0 111.044 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.573 ' HB3' ' HA ' ' A' ' 919' ' ' ILE . 0.5 OUTLIER -62.06 -49.87 74.23 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.21 0.529 . . . . 0.0 110.084 174.353 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.846 ' HB2' ' HE2' ' A' 1053 ' ' HIS . 36.7 mt-30 -63.7 -40.71 97.47 Favored 'General case' 0 C--O 1.213 -0.862 0 C-N-CA 120.334 -0.546 . . . . 0.0 109.612 172.488 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.633 ' HB2' ' HA ' ' A' 1039 ' ' ILE . . . -53.3 -52.83 57.85 Favored 'General case' 0 CA--C 1.494 -1.205 0 C-N-CA 123.619 0.768 . . . . 0.0 112.115 -175.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.773 ' HA ' ' HG1' ' A' ' 980' ' ' THR . 0.1 OUTLIER -61.93 -44.12 97.42 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.034 -174.83 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.682 HD22 ' H ' ' A' ' 918' ' ' GLY . 3.7 tt -80.07 -27.78 39.27 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 121.484 0.659 . . . . 0.0 110.291 -175.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.597 ' HG2' ' HG3' ' A' 1049 ' ' GLN . 0.3 OUTLIER -77.39 -41.24 40.84 Favored 'General case' 0 C--O 1.215 -0.73 0 N-CA-C 108.598 -0.889 . . . . 0.0 108.598 -179.964 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.596 ' SD ' ' HB2' ' A' ' 979' ' ' SER . 7.1 mmt -65.07 -31.52 72.77 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.207 175.125 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.669 HG12 ' O ' ' A' 1043 ' ' ARG . 19.0 mm -52.94 -50.7 42.8 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.935 168.745 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 34.5 t -132.45 64.51 1.6 Allowed 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 119.851 -0.74 . . . . 0.0 112.18 -177.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1049 ' ' GLN . . . . . 0.597 ' HG3' ' HG2' ' A' 1045 ' ' LYS . 10.9 mm100 -149.34 -170.63 3.68 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 114.819 -1.082 . . . . 0.0 109.47 167.833 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 8.2 t -144.58 25.0 1.52 Allowed 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 171.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 77.7 mtp180 -140.79 147.21 47.51 Favored Pre-proline 0 N--CA 1.453 -0.285 0 CA-C-N 114.747 -1.115 . . . . 0.0 109.618 -177.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 1052 ' ' PRO . . . . . 0.423 ' HA ' ' HZ2' ' A' 1045 ' ' LYS . 57.7 Cg_endo -73.52 168.28 25.15 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 122.047 1.831 . . . . 0.0 111.224 173.128 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 1053 ' ' HIS . . . . . 0.846 ' HE2' ' HB2' ' A' 1041 ' ' GLN . 3.2 t-80 . . . . . 0 C--N 1.324 -0.527 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.043 -167.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.748 0 N-CA-C 111.944 -0.463 . . . . 0.0 111.944 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 909' ' ' SER . . . . . 0.641 ' O ' ' HB2' ' A' ' 913' ' ' SER . 16.2 m -109.75 136.51 20.33 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 -178.33 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -48.43 -45.09 27.96 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 123.839 3.026 . . . . 0.0 113.058 -176.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -62.25 115.54 8.13 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.722 -0.752 . . . . 0.0 111.733 175.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 912' ' ' ILE . . . . . 0.436 HG22 ' O ' ' A' ' 912' ' ' ILE . 20.2 mt 67.86 25.98 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-O 121.695 0.759 . . . . 0.0 110.586 -178.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 913' ' ' SER . . . . . 0.641 ' HB2' ' O ' ' A' ' 909' ' ' SER . 27.1 t -81.8 -23.45 36.54 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.261 0.553 . . . . 0.0 110.515 176.524 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 162.65 84.43 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.978 -0.63 . . . . 0.0 111.534 -178.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . -76.24 115.78 4.55 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.563 -0.827 . . . . 0.0 111.53 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . -79.04 59.8 4.25 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 121.022 -0.609 . . . . 0.0 111.79 -179.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . 92.04 -165.79 29.44 Favored Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 121.186 -0.531 . . . . 0.0 112.057 -178.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -94.76 -70.48 1.09 Allowed Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.539 -0.838 . . . . 0.0 111.945 178.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 919' ' ' ILE . . . . . 0.588 HG22 HD13 ' A' 1044 ' ' LEU . 0.1 OUTLIER -65.8 151.5 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.996 0 C-N-CA 123.51 0.724 . . . . 0.0 111.584 178.838 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.553 ' H ' ' CG ' ' A' 1040 ' ' ASP . 22.2 ptt180 45.3 71.5 0.27 Allowed 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 126.237 1.815 . . . . 0.0 112.328 -167.424 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 15.9 t -136.52 3.14 2.76 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.417 -1.265 . . . . 0.0 109.289 173.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -142.31 61.99 1.43 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.349 -177.761 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.694 ' O ' ' HD2' ' A' ' 926' ' ' TYR . 4.3 m-20 -70.65 -2.06 13.21 Favored 'General case' 0 C--O 1.217 -0.655 0 N-CA-C 113.702 1.001 . . . . 0.0 113.702 -169.093 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . . . . . . . . . 2.0 tppp? -57.68 -33.75 68.67 Favored 'General case' 0 C--N 1.316 -0.855 0 O-C-N 121.19 -0.944 . . . . 0.0 111.38 -175.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.711 HG22 HD23 ' A' 1036 ' ' LEU . 26.9 m -64.15 -29.34 47.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.316 0.579 . . . . 0.0 111.092 176.043 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.694 ' HD2' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -70.51 -32.93 70.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.441 -178.628 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . 0.777 ' HA ' ' HB ' ' A' ' 930' ' ' THR . 10.8 pt-20 -76.91 -24.22 52.47 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 118.951 -1.1 . . . . 0.0 111.004 176.059 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -69.14 -31.08 69.5 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 172.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.66 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 43.7 t -80.45 -30.76 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.516 173.174 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.777 ' HB ' ' HA ' ' A' ' 927' ' ' GLU . 6.2 m -56.09 -43.32 77.94 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 166.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -69.54 -52.9 18.91 Favored Glycine 0 CA--C 1.531 1.074 0 CA-C-N 114.744 -1.116 . . . . 0.0 113.941 175.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.66 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.9 pp -65.78 -45.88 80.83 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 117.508 0.654 . . . . 0.0 112.763 -174.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 56.0 t -66.05 -36.43 77.45 Favored 'Isoleucine or valine' 0 C--O 1.239 0.509 0 CA-C-O 121.21 0.529 . . . . 0.0 110.636 -177.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.5 ' O ' ' HB3' ' A' ' 938' ' ' GLU . 60.9 tttt -63.79 -31.88 73.2 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.574 179.15 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.612 ' O ' ' HB2' ' A' ' 939' ' ' MET . . . -66.27 -40.88 90.43 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 121.946 -0.472 . . . . 0.0 110.724 175.124 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.801 HG23 ' HB2' ' A' 1025 ' ' ALA . 54.1 t -50.38 -76.73 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.342 -177.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.423 HG13 ' N ' ' A' ' 938' ' ' GLU . 25.0 pt -80.35 -45.29 22.15 Favored 'Isoleucine or valine' 0 C--O 1.244 0.776 0 CA-C-O 121.191 0.52 . . . . 0.0 112.188 -173.539 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.5 ' HB3' ' O ' ' A' ' 934' ' ' LYS . 31.7 tt0 -67.92 -47.36 68.97 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-O 121.267 0.556 . . . . 0.0 109.665 -169.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.678 ' SD ' ' HE1' ' A' ' 954' ' ' MET . 63.6 mtt -74.46 -23.94 58.97 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.814 178.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.649 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 29.1 p -50.61 -40.85 53.87 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.578 0.704 . . . . 0.0 110.512 -176.632 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 8.8 m -104.67 -21.27 13.42 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.641 -179.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.444 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 45.6 tttp -83.85 -48.3 10.19 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -167.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.563 HG12 ' O ' ' A' ' 939' ' ' MET . 24.9 pt -73.77 1.5 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 N-CA-C 113.774 1.028 . . . . 0.0 113.774 178.347 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.443 ' N ' ' CD ' ' A' ' 945' ' ' PRO . 23.1 tp60 -83.19 -1.16 0.05 OUTLIER Pre-proline 0 CA--C 1.576 1.944 0 N-CA-C 116.276 1.954 . . . . 0.0 116.276 -174.153 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.444 ' HD3' ' O ' ' A' ' 942' ' ' LYS . 39.9 Cg_exo -60.75 -25.21 80.63 Favored 'Trans proline' 0 C--N 1.369 1.63 0 CA-C-N 123.131 2.154 . . . . 0.0 112.561 174.562 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . . . . . . . . . . . -73.96 165.66 51.28 Favored Pre-proline 0 C--N 1.326 -0.419 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 173.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.994 ' HB2' ' HD3' ' A' ' 948' ' ' PRO . 52.6 Cg_exo -49.87 -57.77 2.12 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 121.418 1.412 . . . . 0.0 111.446 177.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.994 ' HD3' ' HB2' ' A' ' 947' ' ' PRO . 90.9 Cg_endo -106.36 166.1 0.13 Allowed 'Trans proline' 0 N--CA 1.443 -1.458 0 C-N-CA 122.32 2.013 . . . . 0.0 112.038 165.84 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 0.525 ' HB2' ' CE1' ' A' ' 951' ' ' TYR . 55.3 mt-10 -72.92 -5.21 36.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.605 0.717 . . . . 0.0 109.695 169.761 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.882 ' HB3' ' HG2' ' A' ' 953' ' ' PRO . 32.2 mt-10 62.88 58.87 1.45 Allowed 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 114.179 -1.373 . . . . 0.0 108.388 -172.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.996 ' HB3' ' HG2' ' A' 1002 ' ' MET . 24.9 m-85 -52.75 -43.3 65.66 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 113.336 -1.756 . . . . 0.0 113.424 -178.708 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 0.686 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 64.4 t -60.54 -53.14 67.46 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 110.466 -0.198 . . . . 0.0 110.466 175.398 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 0.882 ' HG2' ' HB3' ' A' ' 950' ' ' GLU . 17.3 Cg_exo -48.55 -34.5 26.61 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 122.315 2.01 . . . . 0.0 113.03 167.169 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.678 ' HE1' ' SD ' ' A' ' 939' ' ' MET . 34.3 tpp -73.26 -31.99 64.42 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.145 177.049 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.621 HG23 ' HE2' ' A' 1002 ' ' MET . 89.0 t -52.33 -39.53 28.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 169.62 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.516 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 8.0 tttt -67.31 -37.36 83.21 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.692 174.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -78.68 -46.82 18.24 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.992 0.368 . . . . 0.0 111.992 -173.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.552 HG12 HD23 ' A' ' 998' ' ' LEU . 12.5 p -86.63 -24.87 6.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 -178.206 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -65.25 -27.13 72.05 Favored Glycine 0 N--CA 1.445 -0.754 0 N-CA-C 110.24 -1.144 . . . . 0.0 110.24 171.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . 0.543 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 10.3 tt -76.92 -35.14 57.54 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.253 -0.473 . . . . 0.0 109.957 175.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -71.17 -42.09 69.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.306 -175.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.846 HD12 HD23 ' A' ' 991' ' ' LEU . 0.5 OUTLIER -67.41 -42.83 82.62 Favored 'General case' 0 C--O 1.217 -0.628 0 CA-C-O 118.853 -0.594 . . . . 0.0 111.056 170.757 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.543 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 29.2 ptt180 -64.87 -31.55 72.84 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 119.912 1.233 . . . . 0.0 110.381 -179.067 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 34.2 m -68.79 -33.99 74.79 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.495 HD23 HD22 ' A' 1035 ' ' LEU . 22.0 tp -70.92 -36.27 72.6 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.581 -1.19 . . . . 0.0 109.556 176.027 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.587 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.5 tt -71.77 -39.5 69.92 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 114.828 -1.078 . . . . 0.0 108.399 -175.312 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -74.05 -28.05 61.22 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 114.986 -1.006 . . . . 0.0 112.155 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.496 ' OG1' HG12 ' A' ' 925' ' ' VAL . 5.2 p -74.46 -41.05 61.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 118.475 0.579 . . . . 0.0 110.164 175.324 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.878 HG12 HG23 ' A' ' 984' ' ' ILE . 60.8 t -68.73 -36.48 74.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.564 172.251 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.736 ' HB2' HE22 ' A' ' 988' ' ' GLN . 24.1 t70 -70.87 -37.37 73.07 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.626 0.727 . . . . 0.0 109.175 179.652 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.607 ' O ' HG22 ' A' ' 975' ' ' VAL . 14.0 tp10 -65.88 -32.85 74.6 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.418 176.434 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 69.8 m -69.04 -17.59 63.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.055 175.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.705 ' HB2' HG21 ' A' ' 984' ' ' ILE . 9.2 tt -67.68 -51.42 30.79 Favored Pre-proline 0 CA--C 1.538 0.505 0 CA-C-O 119.543 -0.265 . . . . 0.0 110.43 -178.184 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.445 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 90.2 Cg_endo -82.9 2.07 8.72 Favored 'Trans proline' 0 C--N 1.356 0.932 0 C-N-CA 121.359 1.373 . . . . 0.0 112.955 170.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.607 HG22 ' O ' ' A' ' 971' ' ' GLU . 26.0 t -67.9 -43.79 85.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 166.675 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . . . . . . . . . 36.5 tp -139.6 94.11 9.47 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.518 174.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -77.77 34.17 0.47 Allowed 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 123.367 2.711 . . . . 0.0 113.163 -173.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . 0.717 ' O ' ' HB3' ' A' ' 981' ' ' HIS . . . -104.73 -148.98 0.41 Allowed 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.269 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.762 ' HB2' ' SD ' ' A' 1046 ' ' MET . 53.7 m -74.23 3.96 6.43 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 980' ' ' THR . . . . . . . . . . . . . 89.7 m -76.38 -29.42 57.12 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 167.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.717 ' HB3' ' O ' ' A' ' 978' ' ' ALA . 0.3 OUTLIER -58.12 -33.43 69.14 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 114.152 -1.386 . . . . 0.0 111.669 -179.861 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -84.25 -21.02 31.28 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 120.29 -0.564 . . . . 0.0 112.404 -176.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.491 ' HG3' HG11 ' A' 1038 ' ' VAL . 0.3 OUTLIER -73.14 -33.62 65.62 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 168.382 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.878 HG23 HG12 ' A' ' 969' ' ' VAL . 52.6 mt -68.66 -31.99 53.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.213 176.812 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . 0.556 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 46.2 mt-10 -62.69 -53.48 53.8 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.348 0.594 . . . . 0.0 109.751 175.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 89.8 mtp -69.84 -43.45 71.9 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.557 -171.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 1.017 ' HB3' ' HB2' ' A' 1035 ' ' LEU . . . -67.78 -51.03 53.64 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.062 -0.972 . . . . 0.0 112.636 -171.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.736 HE22 ' HB2' ' A' ' 970' ' ' ASP . 3.7 pt20 -63.52 -28.39 69.92 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 119.815 -0.754 . . . . 0.0 111.232 -179.33 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . 0.725 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 90.9 mttt -70.04 -40.95 74.84 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.59 0.709 . . . . 0.0 111.492 172.46 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.603 HD22 ' HB3' ' A' 1035 ' ' LEU . 14.2 tp -49.6 -60.81 2.53 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 114.799 -1.092 . . . . 0.0 113.013 -176.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.846 HD23 HD12 ' A' ' 962' ' ' LEU . 5.1 tt -69.14 -27.45 65.57 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.239 0.542 . . . . 0.0 109.547 -179.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . 0.725 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 33.1 t-20 -51.08 -50.67 58.27 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.355 177.371 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 14.6 m -76.85 -33.32 57.9 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -65.31 -40.82 94.28 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 120.499 -0.481 . . . . 0.0 111.872 177.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.57 ' HA ' ' HB3' ' A' ' 998' ' ' LEU . 6.3 tt -71.28 -14.33 62.18 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 174.16 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -76.51 -26.27 55.09 Favored 'General case' 0 C--N 1.315 -0.893 0 C-N-CA 119.633 -0.827 . . . . 0.0 110.023 167.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.64 ' O ' ' HG2' ' A' 1001 ' ' LYS . 5.4 mm-40 -74.4 -43.75 54.98 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 173.223 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.788 HD13 ' HE1' ' A' 1021 ' ' MET . 0.1 OUTLIER -55.08 -46.45 75.44 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.162 -0.926 . . . . 0.0 111.205 -178.657 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.535 ' HA ' ' HE1' ' A' 1002 ' ' MET . 95.1 mt -64.97 -42.66 95.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.666 -176.292 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -60.82 -41.62 96.08 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.174 0.511 . . . . 0.0 111.829 -178.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.857 ' HB3' ' HG3' ' A' 1020 ' ' GLN . 59.8 mmtt -73.86 -42.86 60.19 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 122.63 1.205 . . . . 0.0 108.457 -176.168 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.996 ' HG2' ' HB3' ' A' ' 951' ' ' TYR . 31.6 ttp -62.09 -28.57 69.71 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 113.101 -1.863 . . . . 0.0 109.307 179.499 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 8.7 tptm -69.43 -52.66 24.74 Favored 'General case' 0 N--CA 1.439 -0.999 0 CA-C-N 114.17 -1.377 . . . . 0.0 110.726 -169.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.603 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 93.1 mt -74.7 -13.24 60.59 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.443 -179.103 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1005 ' ' ALA . . . . . 0.527 ' HB2' ' CB ' ' A' 1017 ' ' TYR . . . -66.72 -46.95 73.86 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 119.585 -0.846 . . . . 0.0 109.797 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.946 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 3.5 pp0? -70.61 -31.41 68.37 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 118.942 -0.551 . . . . 0.0 112.145 171.003 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.564 ' HG3' HD21 ' A' 1004 ' ' LEU . 18.2 mm-40 -48.76 -51.1 30.83 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.149 0.499 . . . . 0.0 111.287 178.321 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.88 ' HB2' ' HG ' ' A' 1013 ' ' LEU . 89.2 m-85 -121.87 43.13 2.93 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 120.279 -0.569 . . . . 0.0 109.861 172.033 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.961 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 7.7 p -51.71 -19.9 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.515 -0.4 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.81 172.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 87.6 mmm -32.09 -53.61 0.29 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.055 -1.43 . . . . 0.0 111.065 170.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 23.9 m -161.66 -80.77 0.04 OUTLIER 'General case' 0 C--O 1.246 0.878 0 CA-C-O 121.188 0.518 . . . . 0.0 112.265 176.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 3.2 p -55.51 -65.45 0.59 Allowed 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.256 -0.883 . . . . 0.0 113.224 -167.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.88 ' HG ' ' HB2' ' A' 1008 ' ' TYR . 1.9 mm? -44.81 -45.38 10.06 Favored 'General case' 0 CA--C 1.508 -0.649 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 178.155 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 0.961 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -59.58 -48.13 82.87 Favored 'General case' 0 N--CA 1.442 -0.843 0 C-N-CA 119.985 -0.686 . . . . 0.0 110.941 -164.984 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -70.44 -40.42 73.77 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.639 -174.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -73.89 -41.04 62.72 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.286 0.565 . . . . 0.0 111.558 -177.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.737 ' CE1' HD11 ' A' 1013 ' ' LEU . 19.2 m-85 -81.1 -28.97 34.98 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 122.019 0.914 . . . . 0.0 112.442 -170.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.652 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 38.0 tptt -78.71 -28.4 45.08 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 113.933 -1.485 . . . . 0.0 110.29 178.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -71.86 -56.86 4.97 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.398 176.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1020 ' ' GLN . . . . . 0.857 ' HG3' ' HB3' ' A' 1001 ' ' LYS . 10.3 pt20 -53.69 -26.21 21.72 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 119.708 -0.187 . . . . 0.0 110.799 166.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.788 ' HE1' HD13 ' A' ' 998' ' ' LEU . 2.1 tmt? -66.51 -51.75 53.3 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 118.207 0.458 . . . . 0.0 110.62 173.705 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1022 ' ' LEU . . . . . 0.761 ' HA ' ' HB1' ' A' 1025 ' ' ALA . 0.2 OUTLIER -88.63 -1.76 58.24 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 119.205 -0.998 . . . . 0.0 109.84 -175.234 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A 1023 ' ' THR . . . . . 0.424 ' HB ' ' HA ' ' A' 1020 ' ' GLN . 33.1 m -87.1 -39.15 15.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.447 171.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.527 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -76.92 -21.24 55.16 Favored 'General case' 0 C--O 1.222 -0.356 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 170.636 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.801 ' HB2' HG23 ' A' ' 936' ' ' VAL . . . -84.52 -25.44 28.79 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.169 169.624 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.599 ' O ' HG22 ' A' 1030 ' ' VAL . 4.1 t60 -74.17 -26.82 60.52 Favored 'General case' 0 C--O 1.217 -0.639 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 167.045 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1027 ' ' ALA . . . . . 0.489 ' HB2' ' O ' ' A' 1024 ' ' ALA . . . -68.01 -42.46 80.67 Favored 'General case' 0 C--N 1.321 -0.654 0 C-N-CA 123.454 0.701 . . . . 0.0 110.327 164.318 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.626 HD11 HD21 ' A' ' 998' ' ' LEU . 20.3 mt -57.08 -46.61 82.39 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 170.463 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -58.07 -41.75 84.04 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 111.711 0.263 . . . . 0.0 111.711 173.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.599 HG22 ' O ' ' A' 1026 ' ' HIS . 19.3 t -67.8 -51.79 46.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 121.276 0.56 . . . . 0.0 110.952 -175.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.495 ' OD1' HD23 ' A' ' 990' ' ' LEU . 12.9 m-20 -76.64 -28.9 56.21 Favored 'General case' 0 C--O 1.217 -0.611 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.882 -175.833 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.569 ' HB2' HG21 ' A' ' 929' ' ' VAL . . . -59.38 -38.29 80.14 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 168.729 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 65.2 tttp -65.45 -47.42 76.2 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.748 0.785 . . . . 0.0 109.621 172.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.453 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 38.2 t30 -68.13 -52.38 35.5 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 114.319 -1.31 . . . . 0.0 112.202 -172.076 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 1.017 ' HB2' ' HB3' ' A' ' 987' ' ' ALA . 3.8 pp -60.67 -37.05 80.27 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 -176.166 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.711 HD23 HG22 ' A' ' 925' ' ' VAL . 0.3 OUTLIER -68.17 -46.38 70.9 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 117.521 -1.672 . . . . 0.0 109.638 176.077 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 19.1 t70 -49.66 -39.15 35.28 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 122.238 1.018 . . . . 0.0 110.299 176.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.491 HG11 ' HG3' ' A' ' 983' ' ' GLU . 19.0 t -58.35 -45.25 89.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 113.665 -1.607 . . . . 0.0 112.38 175.716 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.637 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 2.0 mp -78.32 -31.59 16.23 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 CA-C-N 118.599 0.636 . . . . 0.0 110.722 177.504 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.585 ' HB3' ' HB ' ' A' ' 919' ' ' ILE . 27.0 m-20 -58.42 -40.58 82.9 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-O 120.945 0.403 . . . . 0.0 110.377 172.289 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -76.12 -37.94 57.48 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.642 0.258 . . . . 0.0 110.689 172.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.637 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -54.48 -46.36 73.37 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.908 -179.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.627 ' HG2' ' O ' ' A' 1039 ' ' ILE . 11.5 ptm180 -71.97 -42.53 66.41 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.205 -176.662 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.695 HD22 ' HE2' ' A' 1053 ' ' HIS . 3.3 tt -61.07 -39.14 88.75 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 177.402 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.586 ' HD2' ' HG2' ' A' 1046 ' ' MET . 2.7 tmmm? -60.87 -32.74 72.17 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.855 -179.449 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.762 ' SD ' ' HB2' ' A' ' 979' ' ' SER . 35.5 mmm -94.79 -26.75 16.1 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 113.588 0.958 . . . . 0.0 113.588 -176.686 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.447 HG12 ' O ' ' A' 1043 ' ' ARG . 43.8 mm -83.31 -43.56 18.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.137 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1048 ' ' SER . . . . . 0.516 ' C ' ' H ' ' A' 1050 ' ' SER . 21.6 t -75.83 -56.9 4.23 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 175.564 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 44.8 tt0 68.49 -29.21 0.16 Allowed 'General case' 0 N--CA 1.471 0.622 0 O-C-N 123.525 0.516 . . . . 0.0 112.1 177.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1050 ' ' SER . . . . . 0.516 ' H ' ' C ' ' A' 1048 ' ' SER . 31.5 t -68.05 100.77 1.03 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 170.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 20.5 ttp180 63.13 85.17 0.17 Allowed Pre-proline 0 C--N 1.33 -0.241 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 -174.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -79.64 156.02 24.41 Favored 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 122.957 2.438 . . . . 0.0 113.98 -170.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 1053 ' ' HIS . . . . . 0.695 ' HE2' HD22 ' A' 1044 ' ' LEU . 86.5 m-70 . . . . . 0 C--N 1.327 -0.374 0 CA-C-N 115.081 -0.963 . . . . 0.0 109.032 173.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.756 0 N-CA-C 111.856 -0.498 . . . . 0.0 111.856 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 909' ' ' SER . . . . . 0.759 ' HB2' ' HD3' ' A' ' 910' ' ' PRO . 19.8 m -77.3 -54.86 1.42 Allowed Pre-proline 0 CA--C 1.538 0.495 0 CA-C-N 116.809 0.305 . . . . 0.0 111.111 178.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 910' ' ' PRO . . . . . 0.759 ' HD3' ' HB2' ' A' ' 909' ' ' SER . 3.2 Cg_endo -86.13 99.15 0.58 Allowed 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 122.304 2.003 . . . . 0.0 111.375 174.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -105.67 -42.53 1.69 Allowed Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.054 -179.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 45.9 mm -120.31 -45.84 2.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.075 0.464 . . . . 0.0 109.958 177.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 5.4 p -75.78 110.37 10.15 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.872 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 115.08 -168.2 12.51 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.003 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 130.81 -3.69 5.7 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.184 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . 136.15 67.57 0.06 OUTLIER Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 111.451 -0.66 . . . . 0.0 111.451 -176.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . 116.3 -65.88 0.31 Allowed Glycine 0 N--CA 1.449 -0.451 0 N-CA-C 111.432 -0.667 . . . . 0.0 111.432 -175.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . 0.795 ' H ' HD11 ' A' 1044 ' ' LEU . . . 83.49 128.1 1.38 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 121.083 -0.579 . . . . 0.0 112.449 178.077 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 919' ' ' ILE . . . . . 0.512 ' HB ' ' N ' ' A' 1041 ' ' GLN . 0.0 OUTLIER -56.13 153.19 1.94 Allowed 'Isoleucine or valine' 0 N--CA 1.424 -1.734 0 CA-C-O 121.378 0.609 . . . . 0.0 112.029 176.645 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.6 ' H ' ' HB3' ' A' 1040 ' ' ASP . 5.3 tmm_? 83.43 90.56 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 113.717 -1.583 . . . . 0.0 108.428 -176.518 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 1.7 m -117.76 29.79 7.63 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.923 -1.035 . . . . 0.0 111.323 -173.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 7.6 t30 63.42 87.5 0.11 Allowed 'General case' 0 N--CA 1.469 0.524 0 O-C-N 123.468 0.48 . . . . 0.0 109.868 -178.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.513 ' HB3' HG23 ' A' ' 925' ' ' VAL . 2.2 t70 -131.95 138.74 48.45 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 115.338 1.607 . . . . 0.0 115.338 -166.14 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -55.2 -30.74 60.54 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 112.724 -2.035 . . . . 0.0 112.553 173.183 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.513 HG22 ' HB2' ' A' 1036 ' ' LEU . 28.6 m -55.19 -41.41 60.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-N 117.959 0.345 . . . . 0.0 111.312 -179.695 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.601 ' HA ' ' HB ' ' A' ' 929' ' ' VAL . 0.2 OUTLIER -79.26 -20.25 48.57 Favored 'General case' 0 CA--C 1.504 -0.801 0 O-C-N 122.105 -0.372 . . . . 0.0 111.003 179.583 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.73 -24.07 45.08 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 118.09 -1.444 . . . . 0.0 112.541 171.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -70.9 -26.78 63.37 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 167.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.636 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 53.7 t -74.99 -32.22 26.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 114.223 -1.353 . . . . 0.0 110.419 174.67 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.507 ' O ' ' HB2' ' A' ' 934' ' ' LYS . 9.7 m -59.82 -42.99 94.75 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 119.032 0.833 . . . . 0.0 108.986 170.584 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -69.58 -52.46 20.85 Favored Glycine 0 CA--C 1.528 0.86 0 CA-C-N 115.242 -0.89 . . . . 0.0 113.557 178.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.636 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.9 pp -65.73 -49.39 68.61 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -176.097 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.547 HG21 ' HA ' ' A' 1029 ' ' ALA . 54.0 t -66.86 -40.85 86.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-O 120.872 0.368 . . . . 0.0 111.186 -173.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.651 ' O ' ' HG2' ' A' ' 938' ' ' GLU . 0.1 OUTLIER -58.3 -47.08 84.81 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.206 179.984 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -57.13 -43.19 82.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.19 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.835 HG22 ' HB1' ' A' 1025 ' ' ALA . 70.9 t -43.53 -68.32 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.892 177.731 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 13.7 pt -71.11 -49.69 47.18 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 N-CA-C 112.802 0.668 . . . . 0.0 112.802 -176.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.838 ' O ' ' HB3' ' A' ' 942' ' ' LYS . 11.6 pt-20 -73.06 -34.93 66.57 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 119.779 -0.768 . . . . 0.0 111.295 -169.142 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.548 ' HA ' HG22 ' A' ' 943' ' ' ILE . 62.5 mtt -74.33 -36.74 63.68 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 118.388 -1.325 . . . . 0.0 109.356 177.537 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.647 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 44.8 t -49.43 -54.73 16.03 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 114.609 -1.178 . . . . 0.0 113.082 -168.522 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 23.5 m -125.23 -18.26 5.44 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.608 -173.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.838 ' HB3' ' O ' ' A' ' 938' ' ' GLU . 1.5 tttp -83.45 -63.18 1.4 Allowed 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 119.83 -0.748 . . . . 0.0 110.644 -179.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.831 HG23 ' HG2' ' A' ' 950' ' ' GLU . 4.9 tp -74.76 -14.21 15.74 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 -172.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.505 ' NE2' ' HH ' ' A' ' 951' ' ' TYR . 5.8 tp60 -55.74 106.95 0.74 Allowed Pre-proline 0 N--CA 1.469 0.501 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 173.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.465 ' HB2' ' HD2' ' A' ' 947' ' ' PRO . 73.7 Cg_endo -99.34 -159.4 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.098 0 C-N-CA 123.614 2.876 . . . . 0.0 112.861 -174.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.7 ' HB2' ' HD3' ' A' ' 947' ' ' PRO . . . -69.74 -50.32 18.32 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.616 174.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.7 ' HD3' ' HB2' ' A' ' 946' ' ' ALA . 17.3 Cg_exo -68.74 107.73 1.73 Allowed 'Trans proline' 0 C--N 1.361 1.19 0 C-N-CA 121.833 1.689 . . . . 0.0 110.129 167.863 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 947' ' ' PRO . 9.1 Cg_exo -70.35 -176.29 1.6 Allowed 'Trans proline' 0 N--CA 1.464 -0.245 0 C-N-CA 122.993 2.462 . . . . 0.0 114.388 -168.395 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 0.628 ' HB3' ' CB ' ' A' 1006 ' ' GLN . 7.5 pt-20 42.36 89.73 0.01 OUTLIER 'General case' 0 CA--C 1.507 -0.709 0 CA-C-N 113.674 -1.603 . . . . 0.0 114.832 -174.445 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.831 ' HG2' HG23 ' A' ' 943' ' ' ILE . 0.1 OUTLIER -92.3 16.49 11.5 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 150.775 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.569 ' HB3' ' CG ' ' A' 1002 ' ' MET . 0.3 OUTLIER -72.21 -62.79 1.31 Allowed 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.989 -173.77 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 0.631 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 59.0 t -53.7 -48.23 94.02 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.867 170.762 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 0.631 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 81.7 Cg_exo -53.07 -34.16 66.72 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 121.917 1.744 . . . . 0.0 112.499 172.547 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.496 ' O ' HG11 ' A' ' 958' ' ' VAL . 6.9 tpt -76.19 -31.43 58.46 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.065 177.641 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.833 HG23 ' HE3' ' A' 1002 ' ' MET . 75.4 t -53.39 -44.05 53.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 173.666 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 6.1 tmtt? -67.81 -34.01 75.91 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.828 -1.078 . . . . 0.0 112.055 175.009 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . 0.495 ' HB2' ' HA ' ' A' ' 954' ' ' MET . 25.3 mm-40 -77.63 -46.87 20.76 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -175.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.496 HG11 ' O ' ' A' ' 954' ' ' MET . 12.0 p -80.17 -31.86 13.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -59.35 -40.1 95.58 Favored Glycine 0 N--CA 1.444 -0.767 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 175.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . 0.517 HD11 ' HD3' ' A' ' 963' ' ' ARG . 23.7 tp -67.1 -33.6 75.83 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.66 -0.27 . . . . 0.0 111.112 176.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -80.38 -59.33 2.74 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.829 0.347 . . . . 0.0 110.696 -176.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.973 HD11 HD21 ' A' ' 995' ' ' LEU . 3.3 pp -50.76 -35.27 30.8 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.547 -0.751 . . . . 0.0 112.512 172.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.534 ' N ' HD13 ' A' ' 962' ' ' LEU . 12.2 ptm180 -71.67 -38.77 70.6 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 119.958 1.254 . . . . 0.0 110.825 174.24 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 41.7 m -62.89 -34.42 77.35 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 176.188 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.893 HD23 HD22 ' A' ' 991' ' ' LEU . 26.3 tp -66.84 -45.31 78.65 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 114.845 -1.071 . . . . 0.0 111.021 176.044 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.619 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.4 tt -66.98 -36.14 81.53 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 -176.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . 0.4 ' O ' ' HB2' ' A' ' 971' ' ' GLU . . . -72.66 -34.44 67.25 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 115.168 -0.923 . . . . 0.0 112.15 178.336 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 1.9 p -67.71 -37.63 82.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 119.031 0.832 . . . . 0.0 109.9 174.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.581 HG12 HG23 ' A' ' 984' ' ' ILE . 84.6 t -69.29 -40.6 80.43 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.535 172.518 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.547 ' HB2' HE22 ' A' ' 988' ' ' GLN . 18.9 t70 -68.17 -39.67 82.51 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.876 0.846 . . . . 0.0 109.216 -178.26 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.598 ' O ' HG22 ' A' ' 975' ' ' VAL . 6.8 tp10 -61.78 -36.56 81.44 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.553 -1.203 . . . . 0.0 109.135 176.082 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.451 ' HB2' ' O ' ' A' ' 969' ' ' VAL . 71.5 m -65.66 -19.56 65.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.361 176.23 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.635 ' HA ' HD13 ' A' ' 984' ' ' ILE . 51.7 tp -66.75 -52.31 34.29 Favored Pre-proline 0 CA--C 1.53 0.187 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.539 -174.145 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.603 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 95.7 Cg_endo -85.37 2.65 7.67 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 121.055 1.17 . . . . 0.0 112.996 172.148 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.598 HG22 ' O ' ' A' ' 971' ' ' GLU . 33.8 t -71.33 -50.81 38.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 166.564 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.586 ' HG ' HG11 ' A' ' 975' ' ' VAL . 96.8 mt -126.1 82.44 65.09 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.924 177.495 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -83.0 27.27 0.61 Allowed 'Trans proline' 0 N--CA 1.462 -0.372 0 C-N-CA 123.706 2.938 . . . . 0.0 112.864 -174.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -131.42 101.16 5.41 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.375 0.131 . . . . 0.0 111.03 -178.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.657 ' HB2' ' SD ' ' A' 1046 ' ' MET . 55.5 m 68.92 -47.68 0.57 Allowed 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.294 1.038 . . . . 0.0 112.843 175.066 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.493 HG22 ' HB3' ' A' 1042 ' ' ALA . 65.4 m -56.0 -25.69 45.3 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 169.554 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -55.19 -35.87 65.3 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 113.772 -1.558 . . . . 0.0 111.264 176.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . 0.594 ' HA ' ' HG2' ' A' ' 985' ' ' GLU . 1.5 ptp180 -82.99 -19.79 36.36 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.408 -0.517 . . . . 0.0 111.124 -178.276 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.513 ' HG3' HG13 ' A' 1038 ' ' VAL . 1.2 mp0 -77.17 -33.64 56.5 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 119.69 -0.804 . . . . 0.0 109.126 171.178 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.696 ' HA ' HD13 ' A' 1039 ' ' ILE . 67.9 mt -71.87 -34.78 52.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 CA-C-N 114.952 -1.022 . . . . 0.0 109.909 179.34 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . 0.594 ' HG2' ' HA ' ' A' ' 982' ' ' ARG . 10.7 pt-20 -70.21 -44.96 67.56 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.697 0.76 . . . . 0.0 109.563 -179.252 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 986' ' ' MET . . . . . 0.524 ' HA ' ' HD3' ' A' ' 989' ' ' LYS . 66.3 mtt -73.63 -42.92 60.79 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 114.786 -1.097 . . . . 0.0 111.715 -172.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.842 ' HB3' ' HB2' ' A' 1035 ' ' LEU . . . -68.24 -51.37 46.03 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.809 -173.824 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.619 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 3.5 pt20 -61.44 -24.32 66.47 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 120.497 -0.481 . . . . 0.0 110.754 177.727 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . 0.655 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 0.0 OUTLIER -76.12 -38.86 56.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.011 0.434 . . . . 0.0 111.181 173.842 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 12.3 tp -53.24 -59.74 4.18 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.692 -0.686 . . . . 0.0 112.107 178.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.893 HD22 HD23 ' A' ' 965' ' ' LEU . 9.9 tp -57.82 -38.5 75.72 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-O 121.529 0.68 . . . . 0.0 109.711 177.682 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . 0.655 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 42.4 t-20 -49.34 -51.32 35.26 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 113.895 -1.502 . . . . 0.0 111.549 -176.396 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 993' ' ' SER . . . . . 0.439 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 28.7 t -78.17 -31.53 49.68 Favored 'General case' 0 C--N 1.319 -0.717 0 C-N-CA 120.163 -0.615 . . . . 0.0 111.969 179.267 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . 0.405 ' O ' ' HB2' ' A' ' 997' ' ' GLU . 0.1 OUTLIER -71.32 -34.6 70.72 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 119.146 -1.021 . . . . 0.0 111.76 -179.925 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.973 HD21 HD11 ' A' ' 962' ' ' LEU . 3.0 pp -71.71 -16.95 62.25 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 171.22 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -78.59 -27.0 45.58 Favored 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 119.981 -0.688 . . . . 0.0 109.898 167.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' ' 993' ' ' SER . 5.0 mm-40 -72.15 -45.29 61.09 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 173.012 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.81 HD12 ' HB2' ' A' 1025 ' ' ALA . 0.1 OUTLIER -56.17 -48.03 77.12 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.941 -176.074 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.586 ' O ' ' HB2' ' A' 1003 ' ' LYS . 91.6 mt -66.75 -40.59 86.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.265 -175.329 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 16.7 m-80 -62.04 -40.15 94.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.344 0.592 . . . . 0.0 111.709 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.842 ' HD3' ' HG2' ' A' 1020 ' ' GLN . 86.6 mttt -79.84 -40.84 27.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 122.097 0.951 . . . . 0.0 109.288 -175.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.833 ' HE3' HG23 ' A' ' 955' ' ' VAL . 22.5 ttp -61.06 -26.38 67.6 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.232 -1.349 . . . . 0.0 109.637 175.18 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.586 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 11.5 tptp -74.12 -54.96 6.69 Favored 'General case' 0 N--CA 1.438 -1.037 0 CA-C-N 114.894 -1.048 . . . . 0.0 111.551 -171.43 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.74 ' HA ' ' HB2' ' A' 1007 ' ' GLN . 7.6 mp -68.05 -13.73 62.43 Favored 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 120.305 -0.558 . . . . 0.0 110.73 179.389 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1005 ' ' ALA . . . . . 0.826 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -69.86 -42.2 73.84 Favored 'General case' 0 C--O 1.213 -0.841 0 C-N-CA 119.768 -0.773 . . . . 0.0 109.326 176.075 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.965 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -77.35 -34.57 55.09 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 119.063 -0.494 . . . . 0.0 111.754 171.224 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.74 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 14.7 mm100 -46.14 -49.01 17.26 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.399 0.618 . . . . 0.0 110.637 175.107 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.542 ' HB2' HD23 ' A' 1013 ' ' LEU . 60.0 m-85 -126.99 46.28 2.54 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.602 0.715 . . . . 0.0 110.584 172.738 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 1.117 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 10.7 p -54.05 -18.53 2.45 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.352 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.219 170.255 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 84.5 mtp -49.32 -38.17 26.82 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 113.796 -1.547 . . . . 0.0 111.731 174.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1011 ' ' THR . . . . . 0.406 ' O ' ' HB3' ' A' 1014 ' ' GLN . 0.0 OUTLIER -162.55 -102.82 0.02 OUTLIER 'General case' 0 C--O 1.245 0.862 0 N-CA-C 114.976 1.473 . . . . 0.0 114.976 179.729 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 19.7 m -57.7 -60.52 3.56 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.906 -164.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.707 ' HG ' ' CE2' ' A' 1017 ' ' TYR . 3.1 mp -45.85 -43.09 13.21 Favored 'General case' 0 CA--C 1.506 -0.734 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 177.08 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 1.117 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.99 -50.21 69.57 Favored 'General case' 0 N--CA 1.443 -0.822 0 O-C-N 123.752 0.658 . . . . 0.0 111.879 -168.972 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A 1015 ' ' GLN . . . . . 0.679 ' O ' ' HB3' ' A' 1019 ' ' LYS . 12.8 mm100 -70.26 -41.62 73.25 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.433 -174.383 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1016 ' ' GLU . . . . . 0.447 ' O ' ' HD3' ' A' 1019 ' ' LYS . 30.2 tt0 -69.3 -55.04 11.65 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.338 0.59 . . . . 0.0 110.833 178.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.826 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 9.9 m-85 -60.08 -38.8 83.98 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -176.602 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.561 ' HA ' ' HB3' ' A' 1021 ' ' MET . 23.5 tptm -81.21 -30.45 34.26 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.539 -178.406 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1019 ' ' LYS . . . . . 0.679 ' HB3' ' O ' ' A' 1015 ' ' GLN . 0.1 OUTLIER -73.34 -39.04 65.53 Favored 'General case' 0 C--O 1.222 -0.36 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 175.17 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A 1020 ' ' GLN . . . . . 0.842 ' HG2' ' HD3' ' A' 1001 ' ' LYS . 10.3 tt0 -63.66 -32.41 73.88 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.424 165.24 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.561 ' HB3' ' HA ' ' A' 1018 ' ' LYS . 2.0 tmt? -64.25 -51.12 65.19 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 177.538 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1022 ' ' LEU . . . . . 0.614 ' HB3' ' HG ' ' A' ' 940' ' ' SER . 0.0 OUTLIER -81.82 -6.82 59.4 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 119.343 -0.943 . . . . 0.0 109.919 -175.005 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 62.8 m -87.33 -36.75 17.66 Favored 'General case' 0 C--O 1.223 -0.313 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 173.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.507 ' O ' ' HB2' ' A' 1027 ' ' ALA . . . -79.08 -22.72 44.88 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 172.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.835 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -86.14 -22.44 27.05 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.113 169.612 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.58 ' O ' HG23 ' A' 1030 ' ' VAL . 83.7 t60 -76.43 -25.0 53.99 Favored 'General case' 0 C--O 1.214 -0.792 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 165.319 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1027 ' ' ALA . . . . . 0.507 ' HB2' ' O ' ' A' 1024 ' ' ALA . . . -69.14 -41.09 77.77 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 123.783 0.833 . . . . 0.0 109.959 163.332 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.67 ' CD1' HD22 ' A' ' 998' ' ' LEU . 18.0 mt -60.44 -45.58 93.14 Favored 'General case' 0 C--N 1.314 -0.95 0 C-N-CA 119.933 -0.707 . . . . 0.0 109.259 170.072 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1029 ' ' ALA . . . . . 0.547 ' HA ' HG21 ' A' ' 933' ' ' VAL . . . -57.55 -42.91 83.93 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.41 0.148 . . . . 0.0 111.274 173.41 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.58 HG23 ' O ' ' A' 1026 ' ' HIS . 12.3 t -67.4 -52.16 44.84 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 CA-C-O 121.652 0.739 . . . . 0.0 110.648 -177.781 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.453 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 38.8 m-20 -77.34 -29.39 53.44 Favored 'General case' 0 C--O 1.216 -0.681 0 CA-C-N 114.742 -1.117 . . . . 0.0 112.207 -174.51 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.97 ' HA ' HD22 ' A' 1035 ' ' LEU . . . -71.82 -29.9 64.92 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 170.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.411 ' O ' ' HG ' ' A' 1036 ' ' LEU . 87.9 tttt -65.68 -49.36 68.86 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.823 0.821 . . . . 0.0 109.18 168.304 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.49 ' O ' ' HB3' ' A' 1037 ' ' ASP . 10.6 t30 -68.74 -44.3 74.08 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 114.383 -1.28 . . . . 0.0 112.8 -174.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.97 HD22 ' HA ' ' A' 1032 ' ' ALA . 0.2 OUTLIER -64.52 -37.63 88.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 118.039 0.382 . . . . 0.0 110.099 -176.75 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.649 ' H ' HD23 ' A' 1035 ' ' LEU . 4.0 pp -72.03 -41.57 67.37 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 117.25 -1.78 . . . . 0.0 108.888 178.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.49 ' HB3' ' O ' ' A' 1034 ' ' ASN . 7.6 t70 -49.85 -46.23 51.18 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 114.272 -1.331 . . . . 0.0 110.117 172.479 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.513 HG13 ' HG3' ' A' ' 983' ' ' GLU . 15.5 t -54.51 -47.28 71.42 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.643 0 CA-C-N 114.004 -1.453 . . . . 0.0 111.822 174.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.696 HD13 ' HA ' ' A' ' 984' ' ' ILE . 1.4 mp -77.77 -35.68 21.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 118.775 0.716 . . . . 0.0 112.076 179.338 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.746 ' HA ' ' HE ' ' A' 1043 ' ' ARG . 1.9 m-20 -59.23 -45.9 89.92 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-O 120.73 0.3 . . . . 0.0 110.832 173.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.512 ' N ' ' HB ' ' A' ' 919' ' ' ILE . 0.0 OUTLIER -77.73 -26.33 49.91 Favored 'General case' 0 N--CA 1.432 -1.353 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 176.294 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.692 ' HA ' ' CD2' ' A' 1053 ' ' HIS . . . -54.29 -48.45 71.24 Favored 'General case' 0 CA--C 1.505 -0.773 0 C-N-CA 122.997 0.519 . . . . 0.0 111.804 175.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.746 ' HE ' ' HA ' ' A' 1040 ' ' ASP . 3.2 ptt180 -70.61 -40.5 73.15 Favored 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 120.432 -0.507 . . . . 0.0 109.75 -177.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.795 HD11 ' H ' ' A' ' 918' ' ' GLY . 12.3 tp -57.21 -47.0 82.38 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.104 173.608 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.426 ' HB3' ' CD2' ' A' 1053 ' ' HIS . 1.1 tmtt? -71.81 -35.79 70.07 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 123.571 0.749 . . . . 0.0 109.636 -175.188 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.657 ' SD ' ' HB2' ' A' ' 979' ' ' SER . 1.2 tmm? -64.11 -36.02 82.67 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 120.173 -0.611 . . . . 0.0 111.027 175.599 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.433 HG12 ' O ' ' A' 1043 ' ' ARG . 49.0 mm -82.39 -43.39 19.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.522 0.201 . . . . 0.0 111.293 179.395 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 30.0 t -65.08 -30.11 71.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.388 -176.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 49.7 mm-40 -81.48 -95.75 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.353 177.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 40.6 t 179.28 -56.53 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 -173.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1051 ' ' ARG . . . . . 0.788 ' HB2' ' HD3' ' A' 1052 ' ' PRO . 83.9 mtm180 -136.07 -64.04 0.02 OUTLIER Pre-proline 0 C--O 1.219 -0.511 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.896 -178.714 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1052 ' ' PRO . . . . . 0.788 ' HD3' ' HB2' ' A' 1051 ' ' ARG . 94.7 Cg_endo -88.48 138.11 3.74 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 121.765 1.643 . . . . 0.0 113.91 -172.458 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 1053 ' ' HIS . . . . . 0.692 ' CD2' ' HA ' ' A' 1042 ' ' ALA . 3.2 t-80 . . . . . 0 C--N 1.325 -0.464 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 170.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.787 0 N-CA-C 111.663 -0.575 . . . . 0.0 111.663 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 11.0 p -132.88 150.13 74.81 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 116.76 0.28 . . . . 0.0 110.412 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -60.32 -43.05 36.95 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.441 2.094 . . . . 0.0 111.647 176.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . 93.88 92.22 1.6 Allowed Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.82 175.218 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 34.3 pt -129.5 141.12 47.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 175.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 14.7 m -101.22 -42.1 6.47 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.133 0.492 . . . . 0.0 109.933 179.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . -77.89 67.72 2.91 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.652 -0.703 . . . . 0.0 111.926 178.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . -83.0 88.61 1.49 Allowed Glycine 0 N--CA 1.444 -0.799 0 N-CA-C 111.603 -0.599 . . . . 0.0 111.603 178.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . -59.59 107.15 1.15 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 121.343 -0.456 . . . . 0.0 112.303 178.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . 166.33 -129.39 1.92 Allowed Glycine 0 N--CA 1.445 -0.731 0 N-CA-C 111.044 -0.822 . . . . 0.0 111.044 -178.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -119.15 -65.01 0.29 Allowed Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 120.63 -0.795 . . . . 0.0 111.786 178.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 919' ' ' ILE . . . . . 0.793 HG21 ' HB2' ' A' 1044 ' ' LEU . 46.5 mm -108.09 30.93 1.02 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 CA-C-O 122.431 1.11 . . . . 0.0 109.635 -177.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.439 ' HB2' ' O ' ' A' ' 919' ' ' ILE . 8.0 mpt_? 77.66 54.22 0.03 OUTLIER 'General case' 0 C--O 1.234 0.253 0 CA-C-N 114.292 -1.322 . . . . 0.0 113.397 168.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 14.7 m -128.36 89.13 2.85 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.908 0.385 . . . . 0.0 110.248 169.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.576 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 2.1 t-20 -84.85 -59.76 2.25 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 177.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.658 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 4.7 m-20 46.49 -174.42 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 116.594 2.072 . . . . 0.0 116.594 166.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.464 ' HA ' ' HG2' ' A' ' 927' ' ' GLU . 12.2 mmtp -57.36 -23.27 47.95 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 113.659 -1.609 . . . . 0.0 112.2 177.514 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.609 HG21 HD23 ' A' 1036 ' ' LEU . 33.9 m -62.22 -29.86 47.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 176.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.658 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -77.02 -32.95 57.42 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 118.854 -0.594 . . . . 0.0 111.651 176.535 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . 0.931 ' HA ' ' HB ' ' A' ' 930' ' ' THR . 4.1 pt-20 -75.64 -25.59 56.98 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.833 1.197 . . . . 0.0 111.268 176.808 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.594 ' OD1' ' HB ' ' A' ' 964' ' ' THR . 69.8 m-80 -75.63 -26.89 58.15 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 119.338 0.972 . . . . 0.0 110.582 173.013 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.698 HG22 ' HB2' ' A' 1032 ' ' ALA . 98.4 t -75.15 -30.1 22.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 167.189 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.931 ' HB ' ' HA ' ' A' ' 927' ' ' GLU . 0.9 OUTLIER -63.26 -42.85 99.2 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 169.907 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -72.56 -54.02 7.97 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 120.667 -0.778 . . . . 0.0 113.585 176.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.641 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.8 pp -62.33 -48.47 79.67 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -176.577 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 79.7 t -67.28 -39.89 83.82 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 CA-C-O 121.103 0.477 . . . . 0.0 110.913 -175.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.62 ' HB2' ' O ' ' A' ' 930' ' ' THR . 0.2 OUTLIER -62.07 -35.38 78.47 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.683 179.036 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -64.16 -42.18 96.86 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.832 176.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.697 HG21 ' HB1' ' A' 1025 ' ' ALA . 49.6 t -49.76 -85.01 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 C-N-CA 123.36 0.664 . . . . 0.0 112.218 -179.114 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.448 ' O ' ' HB2' ' A' ' 940' ' ' SER . 15.8 pt -61.61 -42.47 94.24 Favored 'Isoleucine or valine' 0 C--O 1.248 1.005 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -173.03 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.505 ' HB3' ' O ' ' A' ' 934' ' ' LYS . 23.9 tp10 -61.5 -53.2 59.61 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.271 -172.504 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.458 ' HA ' HG12 ' A' ' 943' ' ' ILE . 78.4 mtp -71.3 -26.55 62.91 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.36 -177.076 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.561 ' HA ' ' OE1' ' A' ' 949' ' ' GLU . 6.9 m -51.4 -49.73 61.01 Favored 'General case' 0 CA--C 1.514 -0.441 0 O-C-N 124.238 0.961 . . . . 0.0 112.122 -172.45 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 7.4 m -104.1 -30.73 10.05 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.215 -174.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 938' ' ' GLU . 0.0 OUTLIER -85.96 -46.7 10.3 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 118.622 -1.231 . . . . 0.0 112.111 -164.614 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.458 HG12 ' HA ' ' A' ' 939' ' ' MET . 32.6 mm -50.28 -39.31 16.53 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 -175.358 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.61 ' HG2' ' HA ' ' A' ' 949' ' ' GLU . 0.0 OUTLIER -139.29 110.26 7.62 Favored Pre-proline 0 C--N 1.321 -0.654 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 -169.434 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -96.86 2.6 1.78 Allowed 'Trans proline' 0 N--CA 1.45 -1.051 0 C-N-CA 123.454 2.769 . . . . 0.0 111.669 169.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.504 ' HB1' ' HD3' ' A' ' 947' ' ' PRO . . . -158.62 -53.48 0.01 OUTLIER Pre-proline 0 CA--C 1.536 0.417 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.83 -176.364 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.603 ' O ' ' HB2' ' A' ' 944' ' ' GLN . 86.7 Cg_endo -79.67 -177.47 3.87 Favored 'Trans proline' 0 C--N 1.359 1.1 0 C-N-CA 122.094 1.862 . . . . 0.0 111.476 177.165 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.705 ' HB3' ' HB2' ' A' 1006 ' ' GLN . 49.0 Cg_endo -70.83 160.21 50.12 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 121.986 1.791 . . . . 0.0 112.118 173.595 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 0.61 ' HA ' ' HG2' ' A' ' 944' ' ' GLN . 38.2 tt0 -69.19 -2.38 10.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.017 -178.203 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.495 ' HB3' ' HG2' ' A' ' 953' ' ' PRO . 49.2 mt-10 53.89 43.13 31.33 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 -163.387 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 1.105 ' HA ' ' HB3' ' A' ' 954' ' ' MET . 0.4 OUTLIER -75.64 -15.03 60.38 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.081 -0.648 . . . . 0.0 111.975 -167.785 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 0.666 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 56.8 t -64.42 -52.41 53.49 Favored Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 166.332 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 0.666 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 25.6 Cg_exo -50.01 -37.81 47.88 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 121.845 1.696 . . . . 0.0 112.474 162.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 1.105 ' HB3' ' HA ' ' A' ' 951' ' ' TYR . 3.6 tpt -64.96 -32.73 74.59 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 122.764 0.426 . . . . 0.0 110.825 174.359 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.609 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 87.9 t -53.75 -41.65 48.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 169.336 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.506 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 8.9 tmtt? -67.78 -32.04 72.35 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.482 176.071 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -78.0 -48.06 17.07 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.967 0.413 . . . . 0.0 111.597 -175.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.541 ' O ' ' HG ' ' A' ' 962' ' ' LEU . 12.5 p -84.99 -35.52 10.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.279 -178.453 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -62.26 -41.25 99.73 Favored Glycine 0 N--CA 1.448 -0.546 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 179.182 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . 0.557 ' O ' ' HG3' ' A' ' 963' ' ' ARG . 24.9 tp -71.75 -31.2 66.41 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.667 -0.123 . . . . 0.0 110.667 178.039 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -73.7 -60.83 2.07 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.968 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 1.049 HD13 HD23 ' A' ' 995' ' ' LEU . 4.0 pp -50.64 -35.35 30.11 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 172.039 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.597 ' N ' HD12 ' A' ' 962' ' ' LEU . 0.0 OUTLIER -71.09 -36.21 72.11 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 120.173 1.351 . . . . 0.0 111.022 175.2 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 964' ' ' THR . . . . . 0.594 ' HB ' ' OD1' ' A' ' 928' ' ' ASN . 17.6 m -71.56 -27.0 62.86 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.281 -0.567 . . . . 0.0 109.498 177.563 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.627 HD22 HD23 ' A' ' 991' ' ' LEU . 36.8 tp -65.65 -45.55 82.54 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-O 122.103 0.954 . . . . 0.0 109.566 169.303 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.709 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 9.2 tt -65.54 -37.25 86.19 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 114.484 -1.235 . . . . 0.0 108.664 -176.084 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . 0.58 ' O ' ' HB2' ' A' ' 971' ' ' GLU . . . -75.53 -29.47 59.44 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.492 179.277 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 1.1 p -72.03 -36.48 69.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 118.497 0.59 . . . . 0.0 110.029 174.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.696 HG23 HD23 ' A' 1035 ' ' LEU . 96.9 t -72.43 -39.25 62.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.311 171.677 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.899 ' HB2' HE22 ' A' ' 988' ' ' GLN . 26.1 t70 -65.9 -38.15 87.98 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 122.19 0.995 . . . . 0.0 108.435 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.676 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 4.9 tp10 -63.56 -37.0 85.67 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.045 -1.434 . . . . 0.0 109.496 176.376 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.46 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 24.1 m -63.26 -17.97 63.07 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.559 175.596 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.782 ' HA ' HD12 ' A' ' 984' ' ' ILE . 8.4 tt -68.88 -52.62 16.73 Favored Pre-proline 0 CA--C 1.535 0.372 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.265 -177.199 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.733 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 1.8 Cg_endo -87.8 -14.3 3.65 Favored 'Trans proline' 0 C--N 1.358 1.036 0 C-N-CA 121.667 1.578 . . . . 0.0 113.676 174.409 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.493 HG21 ' O ' ' A' ' 971' ' ' GLU . 13.7 t -62.37 -44.75 99.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 173.035 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.441 HD22 ' HB3' ' A' 1043 ' ' ARG . 10.0 mp -80.44 152.94 73.6 Favored Pre-proline 0 C--N 1.323 -0.552 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 171.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_exo -39.19 -64.71 0.2 Allowed 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 123.517 2.811 . . . . 0.0 113.919 -175.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . 178.6 -34.24 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.251 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.261 -179.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.443 ' HB3' ' CE ' ' A' 1046 ' ' MET . 1.5 m -44.84 -49.74 10.66 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.181 -177.093 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.676 ' HG1' ' HA ' ' A' 1043 ' ' ARG . 16.1 m -73.33 -5.82 42.11 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -171.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -50.27 -36.26 30.62 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 -171.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . 0.58 ' HA ' ' HG2' ' A' ' 985' ' ' GLU . 7.0 ptp180 -83.2 -22.36 33.19 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 118.986 -1.085 . . . . 0.0 112.142 -168.74 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.519 ' OE2' HG12 ' A' 1038 ' ' VAL . 2.0 mt-10 -80.03 -35.74 36.81 Favored 'General case' 0 CA--C 1.501 -0.931 0 C-N-CA 119.39 -0.924 . . . . 0.0 109.734 171.095 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.782 HD12 ' HA ' ' A' ' 973' ' ' LEU . 48.7 mt -64.97 -37.44 80.25 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-N 114.795 -1.093 . . . . 0.0 108.927 178.863 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . 0.58 ' HG2' ' HA ' ' A' ' 982' ' ' ARG . 11.3 pt-20 -74.09 -38.52 63.85 Favored 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 118.317 -1.353 . . . . 0.0 110.362 -177.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 986' ' ' MET . . . . . 0.644 ' O ' ' HB3' ' A' ' 989' ' ' LYS . 26.3 ttt -72.22 -37.28 69.24 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.889 -173.746 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.996 ' HB2' ' HB2' ' A' 1035 ' ' LEU . . . -76.34 -49.74 16.08 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.878 -1.056 . . . . 0.0 111.879 -172.528 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.899 HE22 ' HB2' ' A' ' 970' ' ' ASP . 4.7 pt20 -59.73 -26.15 65.41 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.559 0.695 . . . . 0.0 109.629 173.378 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . 0.79 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 7.8 tmtm? -71.11 -39.73 71.9 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.586 -1.188 . . . . 0.0 111.287 172.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 18.2 tp -55.97 -58.36 8.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.569 176.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.627 HD23 HD22 ' A' ' 965' ' ' LEU . 13.0 tp -55.19 -36.07 65.5 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.557 0.694 . . . . 0.0 109.804 177.068 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . 0.79 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 25.4 t-20 -48.86 -52.04 26.43 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 113.751 -1.568 . . . . 0.0 112.119 -177.106 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 32.1 t -74.39 -35.83 63.49 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.33 -36.69 77.2 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 119.246 -0.982 . . . . 0.0 111.829 -178.358 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 1.049 HD23 HD13 ' A' ' 962' ' ' LEU . 3.2 pp -70.45 -23.47 62.72 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 122.808 0.443 . . . . 0.0 110.416 172.294 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -73.44 -28.1 61.78 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 119.527 -0.869 . . . . 0.0 109.978 170.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.757 ' O ' ' HG2' ' A' 1001 ' ' LYS . 17.0 mt-10 -75.25 -41.72 56.74 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 172.091 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.703 ' HB3' ' HA ' ' A' ' 995' ' ' LEU . 0.4 OUTLIER -54.78 -46.76 74.47 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.968 -175.611 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.502 ' HA ' ' HE3' ' A' 1002 ' ' MET . 71.5 mt -66.84 -43.28 89.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.199 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 10.3 m-80 -58.5 -44.89 89.61 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.453 0.644 . . . . 0.0 112.34 -178.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.757 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 28.5 mmtp -74.7 -40.38 61.38 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 122.29 1.043 . . . . 0.0 108.381 -171.624 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.546 ' HG2' ' CG ' ' A' ' 951' ' ' TYR . 16.2 ttp -57.03 -43.89 82.36 Favored 'General case' 0 N--CA 1.428 -1.531 0 CA-C-N 113.894 -1.503 . . . . 0.0 108.419 176.841 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.491 ' C ' ' HH ' ' A' ' 951' ' ' TYR . 1.5 tptm -64.0 -33.0 74.75 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 114.141 -1.391 . . . . 0.0 112.313 -168.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.777 HD12 ' HG3' ' A' 1007 ' ' GLN . 4.2 mm? -84.06 -14.87 49.39 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.007 -0.677 . . . . 0.0 110.948 177.273 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1005 ' ' ALA . . . . . 0.615 ' HB2' ' HA ' ' A' 1014 ' ' GLN . . . -63.45 -50.81 68.26 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 119.391 -0.924 . . . . 0.0 110.55 -177.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 1.014 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 2.2 pp0? -76.99 -24.66 52.23 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 118.979 0.809 . . . . 0.0 110.936 177.328 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.777 ' HG3' HD12 ' A' 1004 ' ' LEU . 18.4 mm-40 -41.75 -40.08 1.91 Allowed 'General case' 0 C--N 1.344 0.336 0 CA-C-O 121.363 0.601 . . . . 0.0 109.795 169.737 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.915 ' HD2' HD22 ' A' 1013 ' ' LEU . 82.7 m-85 -132.1 45.1 2.81 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.631 166.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 1.043 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 7.3 p -49.48 -22.96 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 CA-C-O 121.251 0.548 . . . . 0.0 109.987 171.469 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1010 ' ' MET . . . . . 0.431 ' C ' ' HG1' ' A' 1011 ' ' THR . 21.6 mmt -42.7 -45.83 4.86 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.938 174.043 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1011 ' ' THR . . . . . 0.431 ' HG1' ' C ' ' A' 1010 ' ' MET . 15.9 m -162.23 -84.24 0.03 OUTLIER 'General case' 0 C--O 1.248 0.987 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 176.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1012 ' ' SER . . . . . 0.435 ' O ' ' HG2' ' A' 1015 ' ' GLN . 15.6 m -55.27 -73.41 0.05 Allowed 'General case' 0 C--O 1.234 0.256 0 CA-C-N 114.807 -1.088 . . . . 0.0 112.844 -164.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.915 HD22 ' HD2' ' A' 1008 ' ' TYR . 8.7 mp -47.72 -42.85 26.22 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -177.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 1.043 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -55.8 -45.73 78.16 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.206 -0.598 . . . . 0.0 111.083 -169.403 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A 1015 ' ' GLN . . . . . 0.457 ' O ' ' HD3' ' A' 1019 ' ' LYS . 11.0 pt20 -75.57 -41.04 55.76 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.153 -176.287 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -72.39 -56.33 5.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.328 0.585 . . . . 0.0 110.834 -178.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.691 ' CE2' ' HG ' ' A' 1013 ' ' LEU . 8.7 m-85 -58.03 -39.01 77.32 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.097 -0.956 . . . . 0.0 113.241 -178.12 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.742 ' HG3' ' HE2' ' A' 1021 ' ' MET . 8.4 ttpp -82.17 -24.59 34.91 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.844 -176.557 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1019 ' ' LYS . . . . . 0.457 ' HD3' ' O ' ' A' 1015 ' ' GLN . 4.0 mptp? -71.57 -46.12 60.28 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 171.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -56.19 -31.93 63.9 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 114.867 -1.061 . . . . 0.0 110.986 164.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.742 ' HE2' ' HG3' ' A' 1018 ' ' LYS . 18.2 tmm? -69.21 -53.69 18.66 Favored 'General case' 0 CA--C 1.509 -0.611 0 O-C-N 122.16 -0.337 . . . . 0.0 110.793 176.076 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1022 ' ' LEU . . . . . 0.449 HD22 ' HA ' ' A' 1019 ' ' LYS . 0.3 OUTLIER -80.29 -8.55 59.52 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 119.478 -0.889 . . . . 0.0 109.78 -171.229 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 85.3 m -88.83 -31.43 18.32 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.725 172.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.473 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -79.42 -24.73 42.32 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-O 121.419 0.628 . . . . 0.0 109.444 171.489 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.697 ' HB1' HG21 ' A' ' 936' ' ' VAL . . . -86.44 -24.74 25.55 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.222 170.59 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.54 ' O ' HG21 ' A' 1030 ' ' VAL . 47.0 t-80 -74.6 -26.73 60.1 Favored 'General case' 0 C--O 1.214 -0.765 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 164.533 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1027 ' ' ALA . . . . . 0.464 ' HB2' ' O ' ' A' 1024 ' ' ALA . . . -68.97 -40.72 78.67 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 123.664 0.785 . . . . 0.0 110.118 163.576 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.657 HD22 ' N ' ' A' ' 995' ' ' LEU . 22.6 mt -59.81 -44.69 93.86 Favored 'General case' 0 C--N 1.315 -0.898 0 C-N-CA 119.996 -0.682 . . . . 0.0 109.456 169.638 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -58.46 -43.25 88.8 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.755 0.312 . . . . 0.0 111.383 173.09 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.54 HG21 ' O ' ' A' 1026 ' ' HIS . 13.2 t -67.79 -50.55 59.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.168 0.509 . . . . 0.0 110.747 -177.113 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.557 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 47.0 m-20 -75.32 -28.93 59.85 Favored 'General case' 0 C--O 1.214 -0.804 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.551 -175.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.795 ' HA ' HD11 ' A' 1035 ' ' LEU . . . -64.35 -39.58 94.16 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 168.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.404 ' HE2' ' HB3' ' A' 1033 ' ' LYS . 13.4 ttpt -63.1 -43.94 97.07 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 122.092 0.948 . . . . 0.0 109.25 171.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.557 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 51.2 t30 -72.93 -52.56 14.15 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-N 113.975 -1.466 . . . . 0.0 112.465 -171.47 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.996 ' HB2' ' HB2' ' A' ' 987' ' ' ALA . 0.0 OUTLIER -64.32 -34.95 79.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 119.468 -0.301 . . . . 0.0 110.759 -173.284 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.727 ' H ' HD12 ' A' 1035 ' ' LEU . 4.6 pp -72.97 -36.47 67.11 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 116.88 -1.928 . . . . 0.0 109.673 177.252 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.536 ' HB3' ' O ' ' A' 1034 ' ' ASN . 20.5 t70 -55.24 -43.54 74.68 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 122.336 1.065 . . . . 0.0 110.087 172.637 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.53 ' HB ' ' O ' ' A' 1035 ' ' LEU . 15.2 t -51.95 -58.18 2.69 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.512 0 CA-C-N 113.302 -1.772 . . . . 0.0 111.019 172.854 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.713 HG12 HG12 ' A' ' 984' ' ' ILE . 2.5 mp -67.52 -23.87 30.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 118.188 0.449 . . . . 0.0 111.604 179.371 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.484 ' CG ' ' H ' ' A' ' 919' ' ' ILE . 1.5 t0 -62.3 -48.98 77.48 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.694 0.759 . . . . 0.0 110.285 171.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -72.58 -36.31 68.13 Favored 'General case' 0 C--N 1.31 -1.136 0 O-C-N 122.021 -0.424 . . . . 0.0 109.951 176.183 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.654 ' HB1' ' HA ' ' A' 1039 ' ' ILE . . . -53.02 -48.93 67.18 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 123.462 0.705 . . . . 0.0 112.499 -179.544 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.676 ' HA ' ' HG1' ' A' ' 980' ' ' THR . 9.7 ptp180 -61.07 -51.8 67.62 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.353 179.444 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.793 ' HB2' HG21 ' A' ' 919' ' ' ILE . 3.2 tm? -61.16 -40.08 92.51 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.213 0.53 . . . . 0.0 109.836 179.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.7 ' HE2' ' HB2' ' A' 1053 ' ' HIS . 47.5 mtpt -61.58 -42.67 99.19 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.404 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.443 ' CE ' ' HB3' ' A' ' 979' ' ' SER . 86.3 mmm -74.71 -27.48 60.4 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.538 -0.465 . . . . 0.0 112.102 176.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.64 HG12 ' O ' ' A' 1043 ' ' ARG . 28.8 mm -58.63 -48.34 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-O 121.079 0.466 . . . . 0.0 110.522 175.544 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 47.9 m -145.74 72.26 1.3 Allowed 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.124 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -71.22 127.9 34.13 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 122.211 1.005 . . . . 0.0 111.902 -176.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 70.0 p -133.22 8.65 4.02 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 113.567 -1.652 . . . . 0.0 107.307 171.05 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1051 ' ' ARG . . . . . 0.737 ' HB3' ' HD2' ' A' 1052 ' ' PRO . 52.1 mtp85 -133.01 178.89 1.55 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 113.865 -1.516 . . . . 0.0 109.083 -169.236 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1052 ' ' PRO . . . . . 0.737 ' HD2' ' HB3' ' A' 1051 ' ' ARG . 67.7 Cg_endo -78.08 112.1 3.19 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 121.035 1.157 . . . . 0.0 112.745 176.414 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 1053 ' ' HIS . . . . . 0.7 ' HB2' ' HE2' ' A' 1045 ' ' LYS . 1.1 t-80 . . . . . 0 C--N 1.323 -0.544 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 172.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.748 0 N-CA-C 111.914 -0.475 . . . . 0.0 111.914 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 8.7 t -114.76 113.84 44.57 Favored Pre-proline 0 C--N 1.321 -0.653 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 178.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -77.73 17.3 0.98 Allowed 'Trans proline' 0 CA--C 1.528 0.222 0 C-N-CA 122.956 2.438 . . . . 0.0 112.742 -177.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . 96.81 -176.39 32.11 Favored Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.866 -0.683 . . . . 0.0 111.963 -179.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 22.4 pt -133.12 -175.0 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 179.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 23.1 t -123.93 116.46 22.93 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.051 0.453 . . . . 0.0 110.605 179.117 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . -135.59 155.69 22.36 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.989 179.305 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 155.95 149.51 5.36 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 121.04 -0.6 . . . . 0.0 112.102 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . 151.45 124.39 1.13 Allowed Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.073 -179.517 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . -151.61 159.2 28.14 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.458 178.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . 79.55 170.83 40.65 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 121.263 -0.494 . . . . 0.0 112.929 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 919' ' ' ILE . . . . . 0.603 ' HB ' ' HB3' ' A' 1040 ' ' ASP . 0.1 OUTLIER -80.32 143.75 11.87 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 174.189 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . . . . . . . . . 11.2 ttp180 179.86 -47.26 0.01 OUTLIER 'General case' 0 C--O 1.234 0.28 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -169.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 11.3 m -78.3 6.08 9.05 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 115.548 1.684 . . . . 0.0 115.548 -153.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -106.15 -74.98 0.64 Allowed 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 118.383 -1.327 . . . . 0.0 110.352 178.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.647 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 7.6 t70 75.45 -48.46 0.61 Allowed 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 168.348 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . . . . . . . . . 15.0 tptp -56.98 -31.3 64.91 Favored 'General case' 0 C--N 1.321 -0.646 0 O-C-N 121.583 -0.698 . . . . 0.0 111.779 -177.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.624 ' CG2' ' HB3' ' A' 1036 ' ' LEU . 1.5 p -61.11 -31.83 51.09 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 CA-C-O 121.295 0.569 . . . . 0.0 110.894 174.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.647 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -67.25 -36.64 82.04 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 123.591 0.756 . . . . 0.0 111.882 178.031 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -75.04 -23.41 58.13 Favored 'General case' 0 C--N 1.313 -1.001 0 C-N-CA 118.374 -1.33 . . . . 0.0 110.195 -179.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.445 ' O ' ' HB2' ' A' ' 961' ' ' ALA . 1.6 m120 -69.21 -31.11 69.48 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 173.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.668 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 46.6 t -81.13 -28.87 10.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 114.79 -1.095 . . . . 0.0 110.154 174.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 930' ' ' THR . . . . . . . . . . . . . 22.3 m -55.61 -43.12 75.79 Favored 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 165.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -71.03 -53.13 11.26 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-N 115.318 -0.855 . . . . 0.0 114.087 178.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.668 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.4 pp -62.22 -47.92 82.29 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 117.513 0.657 . . . . 0.0 112.694 -176.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 75.9 t -65.32 -36.12 76.95 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 CA-C-O 121.083 0.468 . . . . 0.0 110.862 -176.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.535 ' HD2' ' C ' ' A' ' 934' ' ' LYS . 0.1 OUTLIER -55.35 -45.39 76.46 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.822 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 939' ' ' MET . . . -63.26 -34.15 77.06 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.625 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.756 HG22 ' HB2' ' A' 1025 ' ' ALA . 59.0 t -54.03 -76.03 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 CA-C-O 121.11 0.481 . . . . 0.0 112.166 -179.391 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 21.0 pt -68.7 -38.63 79.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -175.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.49 ' O ' ' HD3' ' A' ' 942' ' ' LYS . 34.9 tt0 -66.45 -52.22 48.61 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.613 0.72 . . . . 0.0 110.288 -175.174 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.451 ' HA ' ' HB2' ' A' ' 942' ' ' LYS . 23.2 mmt -69.66 -24.35 63.6 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 119.596 -0.842 . . . . 0.0 109.231 -179.048 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.516 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 5.7 p -53.47 -38.45 63.61 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-O 121.187 0.518 . . . . 0.0 110.022 -175.642 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 11.2 m -94.81 -10.5 31.25 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.701 -178.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.49 ' HD3' ' O ' ' A' ' 938' ' ' GLU . 13.7 mptt -80.71 -1.48 42.81 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 177.091 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . . . . . . . . . 37.9 pt -42.05 -33.33 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 165.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.494 ' H ' ' HD2' ' A' ' 945' ' ' PRO . 0.0 OUTLIER -101.88 -54.46 0.14 Allowed Pre-proline 0 CA--C 1.54 0.566 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -171.837 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.494 ' HD2' ' H ' ' A' ' 944' ' ' GLN . 29.2 Cg_endo -62.22 -11.31 21.61 Favored 'Trans proline' 0 C--N 1.36 1.172 0 C-N-CA 122.182 1.922 . . . . 0.0 113.488 -174.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . . . . . . . . . . . -136.98 152.91 74.87 Favored Pre-proline 0 C--N 1.321 -0.667 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 177.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -58.51 162.89 11.53 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.345 2.03 . . . . 0.0 110.839 173.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.686 ' HG3' HG12 ' A' 1009 ' ' VAL . 33.7 Cg_exo -26.69 116.88 0.03 OUTLIER 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 124.666 3.578 . . . . 0.0 113.334 -178.182 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 0.5 ' OE1' ' HE3' ' A' ' 954' ' ' MET . 10.1 mt-10 -54.6 -22.07 12.29 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.672 175.151 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.599 ' HB3' ' HG2' ' A' ' 953' ' ' PRO . 23.2 tt0 69.96 -0.35 2.77 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.659 179.165 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.595 ' CZ ' ' HD3' ' A' 1018 ' ' LYS . 27.4 m-85 47.65 -52.09 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 116.222 1.934 . . . . 0.0 116.222 176.063 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 0.598 ' O ' ' HB ' ' A' ' 955' ' ' VAL . 43.2 t -49.76 -45.56 79.68 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 118.667 0.667 . . . . 0.0 112.041 174.601 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 0.605 ' O ' ' HB3' ' A' ' 956' ' ' LYS . 36.3 Cg_exo -50.01 -44.55 36.91 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 122.089 1.859 . . . . 0.0 112.899 174.162 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.546 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 4.4 ptp -75.32 -29.75 60.12 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 178.158 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.598 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 99.2 t -54.67 -36.5 36.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.145 168.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.605 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 23.2 ttpt -59.07 -43.44 91.77 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.886 171.636 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . 0.503 ' HG2' ' HA ' ' A' ' 954' ' ' MET . 14.6 pt-20 -79.63 -43.41 22.9 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 119.75 -0.78 . . . . 0.0 112.087 -178.133 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.521 HG23 ' HA ' ' A' ' 955' ' ' VAL . 16.7 m -76.52 -33.04 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-O 120.689 0.281 . . . . 0.0 110.904 -179.042 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -68.88 -35.77 80.23 Favored Glycine 0 N--CA 1.436 -1.33 0 N-CA-C 110.474 -1.05 . . . . 0.0 110.474 175.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . 0.594 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 16.5 tp -65.73 -38.33 88.86 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 172.712 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . 0.445 ' HB2' ' O ' ' A' ' 928' ' ' ASN . . . -68.45 -58.46 4.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.647 -0.251 . . . . 0.0 110.757 -177.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.558 HD23 HD23 ' A' ' 995' ' ' LEU . 0.1 OUTLIER -43.54 -49.91 7.32 Favored 'General case' 0 C--O 1.215 -0.748 0 CA-C-O 118.596 -0.716 . . . . 0.0 112.698 167.591 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.594 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 6.4 ptp180 -68.43 -29.0 67.56 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 120.303 1.41 . . . . 0.0 110.805 -179.163 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 964' ' ' THR . . . . . 0.408 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 43.7 m -68.24 -37.99 81.37 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 174.572 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.615 HD12 HD22 ' A' 1035 ' ' LEU . 0.0 OUTLIER -66.28 -40.01 89.79 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.17 174.423 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.407 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.4 tt -67.91 -41.45 82.64 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 114.727 -1.124 . . . . 0.0 108.307 -175.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . 0.565 ' O ' ' HB2' ' A' ' 971' ' ' GLU . . . -72.59 -38.77 67.75 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-N 114.966 -1.015 . . . . 0.0 112.021 -179.508 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 9.8 p -61.92 -40.98 97.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 118.657 0.662 . . . . 0.0 110.3 177.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.966 HG12 HG23 ' A' ' 984' ' ' ILE . 67.7 t -73.94 -38.54 49.99 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.712 174.493 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.863 ' HB2' HE22 ' A' ' 988' ' ' GLN . 12.1 t70 -67.75 -44.38 77.66 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.805 0.812 . . . . 0.0 109.585 -177.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.591 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 0.6 OUTLIER -63.83 -32.5 74.04 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 114.667 -1.152 . . . . 0.0 109.26 177.536 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.629 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 39.8 m -65.3 -18.02 64.98 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.53 175.397 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.761 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 9.7 tt -69.62 -52.65 13.77 Favored Pre-proline 0 CA--C 1.532 0.262 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.087 -179.171 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.761 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 3.0 Cg_exo -80.36 -2.12 11.77 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.627 1.551 . . . . 0.0 113.116 172.54 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.629 ' HB ' ' HA ' ' A' ' 972' ' ' SER . 15.0 t -83.38 -50.66 15.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 110.094 -0.336 . . . . 0.0 110.094 173.585 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.54 HD13 ' HG1' ' A' ' 980' ' ' THR . 97.4 mt -76.41 153.53 83.9 Favored Pre-proline 0 C--N 1.325 -0.476 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 176.787 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -36.05 -64.67 0.16 Allowed 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 123.962 3.108 . . . . 0.0 114.199 -174.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . 176.06 -29.84 0.0 OUTLIER 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 121.342 0.591 . . . . 0.0 110.115 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 979' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -51.27 -50.07 59.97 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.955 -1.02 . . . . 0.0 113.351 -174.078 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.602 HG22 ' HG3' ' A' 1046 ' ' MET . 40.9 p -78.39 9.12 4.17 Favored 'General case' 0 C--N 1.33 -0.258 0 O-C-N 122.162 -0.336 . . . . 0.0 111.75 -171.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.708 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 0.3 OUTLIER -55.56 -34.34 64.65 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.345 -178.65 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . 0.444 HH11 ' HD3' ' A' ' 982' ' ' ARG . 9.5 ptp180 -84.48 -19.21 33.71 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.477 -178.479 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.624 ' HG2' ' HB1' ' A' 1042 ' ' ALA . 0.5 OUTLIER -73.98 -38.85 64.04 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 172.586 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.966 HG23 HG12 ' A' ' 969' ' ' VAL . 65.6 mt -72.01 -29.51 33.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 114.225 -1.352 . . . . 0.0 109.206 179.387 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . 0.708 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 26.6 mt-10 -65.0 -51.63 60.63 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.402 0.62 . . . . 0.0 110.444 174.162 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 25.5 ttt -70.23 -43.28 70.95 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.311 -170.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.986 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -74.54 -50.85 16.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.066 -0.97 . . . . 0.0 112.827 -171.236 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.863 HE22 ' HB2' ' A' ' 970' ' ' ASP . 3.2 pt20 -65.29 -23.04 66.93 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 119.817 -0.753 . . . . 0.0 109.94 179.432 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . 0.773 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 6.8 tttp -74.31 -40.67 62.07 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.327 171.816 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.412 ' HB3' ' O ' ' A' ' 987' ' ' ALA . 27.5 tp -52.19 -59.79 3.97 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.208 178.675 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.636 ' HB2' ' CD2' ' A' 1035 ' ' LEU . 0.3 OUTLIER -66.04 -28.91 69.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.519 0.676 . . . . 0.0 109.789 179.059 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . 0.773 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 23.7 t-20 -52.05 -56.39 14.65 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.436 -1.257 . . . . 0.0 111.485 179.752 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 34.1 t -77.84 -33.99 52.07 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 111.776 0.288 . . . . 0.0 111.776 -178.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . 0.421 ' O ' ' HB3' ' A' ' 997' ' ' GLU . 0.6 OUTLIER -66.99 -36.34 81.95 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 120.176 -0.61 . . . . 0.0 112.354 -179.823 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.61 HD12 HD12 ' A' 1028 ' ' LEU . 8.4 tt -73.7 -17.45 61.13 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 173.041 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -75.29 -26.46 58.76 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 119.77 -0.772 . . . . 0.0 109.77 167.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.421 ' HB3' ' O ' ' A' ' 994' ' ' ASP . 3.8 tp10 -74.51 -40.63 61.67 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 173.14 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.94 HD13 ' HB3' ' A' 1025 ' ' ALA . 2.2 tp -55.91 -46.98 78.25 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.039 0.447 . . . . 0.0 110.747 178.058 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.77 ' HA ' ' SD ' ' A' 1002 ' ' MET . 80.1 mt -68.57 -38.5 79.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.881 -171.093 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -60.59 -46.86 88.65 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.442 0.639 . . . . 0.0 111.254 -177.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.536 ' O ' ' HB3' ' A' 1017 ' ' TYR . 89.7 mttt -84.62 -31.8 24.06 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.962 -173.165 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.77 ' SD ' ' HA ' ' A' ' 999' ' ' ILE . 13.1 ptm -64.29 -27.81 69.29 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 122.099 0.952 . . . . 0.0 108.512 173.47 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.614 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 9.4 tptp -67.26 -54.01 24.73 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 114.145 -1.389 . . . . 0.0 110.352 -171.255 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.622 ' HG ' ' NE2' ' A' 1007 ' ' GLN . 9.1 mp -71.14 -13.8 62.07 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.388 -178.68 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1005 ' ' ALA . . . . . 0.601 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -69.26 -55.15 11.37 Favored 'General case' 0 C--O 1.217 -0.638 0 C-N-CA 119.888 -0.725 . . . . 0.0 110.289 179.554 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.95 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 0.8 OUTLIER -63.88 -24.91 67.93 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 118.871 -0.585 . . . . 0.0 112.467 171.787 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.622 ' NE2' ' HG ' ' A' 1004 ' ' LEU . 19.3 mt-30 -51.98 -50.22 61.73 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.625 0.726 . . . . 0.0 110.07 175.528 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.724 ' HB2' ' HG ' ' A' 1013 ' ' LEU . 76.5 m-85 -124.99 49.74 1.83 Allowed 'General case' 0 N--CA 1.442 -0.835 0 CA-C-O 121.588 0.709 . . . . 0.0 109.617 172.361 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 1.001 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 9.3 p -55.41 -19.27 5.29 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.282 0 CA-C-N 114.157 -1.383 . . . . 0.0 109.678 170.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 65.0 mtt -40.01 -51.31 2.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.55 -1.204 . . . . 0.0 110.655 171.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 41.6 m -162.54 -75.66 0.05 OUTLIER 'General case' 0 C--O 1.239 0.52 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 175.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 13.1 p -55.93 -79.9 0.02 OUTLIER 'General case' 0 C--O 1.248 0.986 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -163.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.724 ' HG ' ' HB2' ' A' 1008 ' ' TYR . 13.0 mt -48.19 -42.62 30.39 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.453 -175.82 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 1.001 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.1 OUTLIER -52.66 -59.15 4.82 Favored 'General case' 0 N--CA 1.437 -1.113 0 O-C-N 123.989 0.806 . . . . 0.0 110.477 -165.73 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A 1015 ' ' GLN . . . . . 0.507 ' O ' ' HD3' ' A' 1019 ' ' LYS . 27.7 mt-30 -65.92 -38.21 88.07 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.651 -169.201 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -70.03 -44.94 68.22 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.468 0.652 . . . . 0.0 110.574 178.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.601 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 13.4 m-85 -71.94 -30.76 65.65 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.758 -176.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.595 ' HD3' ' CZ ' ' A' ' 951' ' ' TYR . 23.4 tptm -78.86 -33.99 45.4 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 114.172 -1.376 . . . . 0.0 109.951 -176.001 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1019 ' ' LYS . . . . . 0.507 ' HD3' ' O ' ' A' 1015 ' ' GLN . 4.6 mptp? -71.1 -44.65 65.21 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 175.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -57.8 -33.01 68.12 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.72 165.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.735 ' HE3' HD11 ' A' ' 998' ' ' LEU . 1.9 tmt? -65.85 -51.5 58.31 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 110.294 -0.262 . . . . 0.0 110.294 179.21 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1022 ' ' LEU . . . . . 0.482 ' HA ' ' HB1' ' A' 1025 ' ' ALA . 0.0 OUTLIER -81.15 -9.69 59.76 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 119.423 -0.911 . . . . 0.0 109.869 -175.713 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 72.7 m -81.97 -41.11 21.22 Favored 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 173.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.495 ' O ' ' HB1' ' A' 1027 ' ' ALA . . . -78.51 -22.13 47.84 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-O 121.139 0.495 . . . . 0.0 109.843 174.733 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.94 ' HB3' HD13 ' A' ' 998' ' ' LEU . . . -85.57 -23.57 27.57 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.216 170.441 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.508 ' O ' HG23 ' A' 1030 ' ' VAL . 22.2 t-80 -76.04 -25.92 56.09 Favored 'General case' 0 C--O 1.214 -0.779 0 C-N-CA 120.164 -0.614 . . . . 0.0 109.422 164.154 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1027 ' ' ALA . . . . . 0.495 ' HB1' ' O ' ' A' 1024 ' ' ALA . . . -66.5 -40.15 89.07 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 162.552 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.61 HD12 HD12 ' A' ' 995' ' ' LEU . 16.6 mt -60.17 -49.16 78.73 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 170.629 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -57.11 -41.02 78.18 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 175.29 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' 1026 ' ' HIS . 10.6 t -71.88 -51.55 30.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.44 0.638 . . . . 0.0 110.794 -176.17 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1031 ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -77.11 -30.12 55.11 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.907 -174.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.512 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -70.7 -32.83 70.2 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 172.342 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 52.5 tttm -62.81 -45.69 91.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.768 0.794 . . . . 0.0 109.37 169.062 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.496 ' O ' ' HB3' ' A' 1037 ' ' ASP . 53.7 t30 -68.14 -50.32 55.35 Favored 'General case' 0 C--O 1.218 -0.595 0 CA-C-N 114.369 -1.287 . . . . 0.0 111.738 -176.408 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.986 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 1.9 pp -62.52 -40.84 98.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 119.084 -0.484 . . . . 0.0 111.047 -171.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.624 ' HB3' ' CG2' ' A' ' 925' ' ' VAL . 3.9 pp -66.26 -42.34 88.63 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 117.66 -1.616 . . . . 0.0 109.587 177.656 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.496 ' HB3' ' O ' ' A' 1034 ' ' ASN . 23.6 t70 -54.47 -38.36 66.29 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-N 113.982 -1.463 . . . . 0.0 110.128 175.663 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.502 ' O ' ' HB1' ' A' 1042 ' ' ALA . 27.3 t -63.93 -36.5 76.95 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.614 0 CA-C-N 114.453 -1.249 . . . . 0.0 112.366 177.078 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.614 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 1.7 mp -86.56 -32.37 6.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 119.04 0.836 . . . . 0.0 111.094 177.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.603 ' HB3' ' HB ' ' A' ' 919' ' ' ILE . 4.0 m-20 -62.9 -41.27 99.38 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 169.599 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.413 ' HB2' ' O ' ' A' 1037 ' ' ASP . 12.0 mt-30 -68.2 -39.25 82.5 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.056 170.204 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.624 ' HB1' ' HG2' ' A' ' 983' ' ' GLU . . . -55.41 -48.75 73.91 Favored 'General case' 0 CA--C 1.49 -1.339 0 C-N-CA 123.066 0.546 . . . . 0.0 110.782 -176.742 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.641 ' HD3' ' N ' ' A' 1044 ' ' LEU . 0.0 OUTLIER -65.01 -34.97 79.7 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.402 -174.08 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.641 ' N ' ' HD3' ' A' 1043 ' ' ARG . 3.1 tm? -78.04 -47.09 19.16 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 121.567 0.698 . . . . 0.0 110.123 179.7 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.521 ' O ' ' HB3' ' A' 1049 ' ' GLN . 31.1 ttpt -56.96 -46.48 82.11 Favored 'General case' 0 C--O 1.214 -0.79 0 C-N-CA 124.752 1.221 . . . . 0.0 111.09 178.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.931 ' HA ' ' HE1' ' A' 1046 ' ' MET . 5.1 mmt -71.77 -24.17 61.71 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.151 -0.968 . . . . 0.0 111.407 -178.417 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.577 HG12 ' O ' ' A' 1043 ' ' ARG . 23.1 mm -67.35 -62.33 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.56 170.21 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 31.7 t -128.39 48.85 2.25 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 119.397 -0.921 . . . . 0.0 112.293 -175.559 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1049 ' ' GLN . . . . . 0.521 ' HB3' ' O ' ' A' 1045 ' ' LYS . 6.3 tp-100 -130.17 -71.58 0.59 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.331 -0.85 . . . . 0.0 108.75 166.012 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 78.8 p 53.8 12.29 0.4 Allowed 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 175.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1051 ' ' ARG . . . . . 0.647 ' HB3' ' HD3' ' A' 1052 ' ' PRO . 1.8 tmt_? -90.96 -61.62 0.21 Allowed Pre-proline 0 C--N 1.327 -0.392 0 O-C-N 122.222 -0.299 . . . . 0.0 110.99 -176.091 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 1052 ' ' PRO . . . . . 0.647 ' HD3' ' HB3' ' A' 1051 ' ' ARG . 1.0 OUTLIER -83.29 23.95 0.78 Allowed 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 122.371 2.047 . . . . 0.0 112.982 -174.18 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 13.6 m-70 . . . . . 0 C--N 1.32 -0.711 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.566 179.68 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.907 0 N-CA-C 112.09 -0.404 . . . . 0.0 112.09 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 16.4 p 50.56 92.08 0.06 OUTLIER Pre-proline 0 N--CA 1.47 0.573 0 C-N-CA 123.672 0.789 . . . . 0.0 112.692 178.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -75.22 48.71 2.12 Favored 'Trans proline' 0 CA--C 1.531 0.371 0 C-N-CA 123.502 2.802 . . . . 0.0 112.739 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -109.71 35.19 5.03 Favored Glycine 0 N--CA 1.448 -0.548 0 N-CA-C 111.562 -0.615 . . . . 0.0 111.562 178.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 56.9 mt -86.53 94.42 4.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.15 0.5 . . . . 0.0 110.685 -177.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 36.8 t -118.03 -71.24 0.75 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.602 -0.727 . . . . 0.0 109.079 175.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . -95.16 -40.31 4.31 Favored Glycine 0 N--CA 1.442 -0.943 0 N-CA-C 110.19 -1.164 . . . . 0.0 110.19 171.431 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 133.32 -119.46 2.35 Favored Glycine 0 N--CA 1.446 -0.666 0 N-CA-C 111.666 -0.574 . . . . 0.0 111.666 177.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . -141.11 84.63 0.21 Allowed Glycine 0 N--CA 1.446 -0.675 0 N-CA-C 111.266 -0.733 . . . . 0.0 111.266 177.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . -161.25 109.94 0.42 Allowed Glycine 0 N--CA 1.445 -0.732 0 C-N-CA 120.51 -0.853 . . . . 0.0 112.799 -177.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . 119.62 119.87 2.82 Favored Glycine 0 CA--C 1.517 0.211 0 C-N-CA 120.593 -0.813 . . . . 0.0 113.438 172.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 919' ' ' ILE . . . . . 0.617 HD11 ' HB3' ' A' 1040 ' ' ASP . 6.6 pt -68.07 142.13 16.78 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.955 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 175.691 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.559 ' HG3' ' NH1' ' A' 1043 ' ' ARG . 5.5 ptm180 -164.27 124.18 2.03 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.027 0.442 . . . . 0.0 111.956 -177.714 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 9.9 t -116.35 -169.2 1.57 Allowed 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 171.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . 0.566 ' OD1' ' HE3' ' A' ' 924' ' ' LYS . 15.0 t-20 -77.58 -126.29 0.01 OUTLIER 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 176.245 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.836 ' HA ' ' CD1' ' A' ' 926' ' ' TYR . 4.1 p30 -149.06 2.98 0.59 Allowed 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 120.884 0.374 . . . . 0.0 111.251 174.069 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.566 ' HE3' ' OD1' ' A' ' 922' ' ' ASN . 16.4 mmtp -76.3 -44.68 35.88 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -174.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.623 HG22 HD22 ' A' 1036 ' ' LEU . 20.7 m -57.87 -29.12 34.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.709 0.766 . . . . 0.0 110.352 -179.73 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.836 ' CD1' ' HA ' ' A' ' 923' ' ' ASP . 14.3 m-85 -72.94 -39.78 65.93 Favored 'General case' 0 CA--C 1.483 -1.603 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.582 175.503 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . 0.529 ' HA ' ' OG1' ' A' ' 930' ' ' THR . 9.3 pt-20 -74.38 -22.29 59.26 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 117.749 -1.58 . . . . 0.0 109.982 -176.406 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -75.05 -32.04 61.43 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.038 -0.726 . . . . 0.0 109.038 172.095 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.675 HG21 ' HB2' ' A' 1032 ' ' ALA . 85.4 t -81.13 -29.79 11.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.244 175.536 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.529 ' OG1' ' HA ' ' A' ' 927' ' ' GLU . 66.5 p -68.82 -29.28 67.58 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 169.351 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -70.19 -53.26 14.6 Favored Glycine 0 CA--C 1.529 0.958 0 CA-C-N 115.113 -0.949 . . . . 0.0 113.14 172.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.646 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.6 pp -65.28 -49.32 70.0 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -178.453 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.431 HG23 ' HA ' ' A' 1029 ' ' ALA . 88.6 t -64.27 -41.18 91.58 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-O 121.069 0.461 . . . . 0.0 110.238 -176.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . . . . . . . . . 1.4 ttpt -54.73 -39.92 68.74 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.133 -0.939 . . . . 0.0 109.958 177.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . 0.423 ' HB1' HG13 ' A' ' 958' ' ' VAL . . . -66.72 -39.95 88.21 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.613 0.227 . . . . 0.0 111.613 -178.541 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.693 HG23 ' HB3' ' A' 1025 ' ' ALA . 59.7 t -47.46 -68.32 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 O-C-N 123.81 0.694 . . . . 0.0 111.3 179.506 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 26.5 pt -65.45 -37.29 79.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.905 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -58.89 -56.55 20.81 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.57 0.7 . . . . 0.0 110.747 -172.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.554 ' HB3' ' OE2' ' A' ' 949' ' ' GLU . 13.3 mmt -76.52 -25.82 54.56 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.52 -0.763 . . . . 0.0 110.394 -177.076 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.545 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 76.9 p -52.98 -41.55 64.69 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.447 0.642 . . . . 0.0 110.995 -169.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 8.7 p -104.44 -19.22 14.11 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 114.907 -1.042 . . . . 0.0 112.203 -177.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -82.73 -3.78 56.97 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 119.949 -0.7 . . . . 0.0 110.214 -177.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.546 HD11 ' HG2' ' A' 1018 ' ' LYS . 47.3 pt -50.69 -47.01 28.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.921 162.274 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.533 ' N ' HG13 ' A' ' 943' ' ' ILE . 3.7 pt20 50.51 170.66 0.03 OUTLIER Pre-proline 0 N--CA 1.475 0.778 0 C-N-CA 125.095 1.358 . . . . 0.0 113.232 177.19 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -67.84 86.82 0.37 Allowed 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 121.953 1.768 . . . . 0.0 110.747 168.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.576 ' HB2' ' HD2' ' A' ' 947' ' ' PRO . . . -162.03 179.1 1.36 Allowed Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.652 -175.258 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.576 ' HD2' ' HB2' ' A' ' 946' ' ' ALA . 54.3 Cg_exo -54.04 149.7 34.17 Favored 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 122.283 1.989 . . . . 0.0 111.883 172.616 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.598 ' HA ' HG21 ' A' 1009 ' ' VAL . 3.0 Cg_endo -47.52 135.79 20.86 Favored 'Trans proline' 0 CA--C 1.517 -0.364 0 C-N-CA 123.513 2.808 . . . . 0.0 113.948 -176.015 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 0.564 ' HB3' ' CD1' ' A' ' 951' ' ' TYR . 13.5 tt0 -58.72 -23.31 59.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.072 -0.967 . . . . 0.0 108.477 167.164 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.562 ' HB2' ' HG2' ' A' ' 953' ' ' PRO . 46.1 mt-10 74.59 -7.92 1.61 Allowed 'General case' 0 C--N 1.344 0.366 0 CA-C-N 114.368 -1.287 . . . . 0.0 109.592 -171.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.968 ' HB3' ' HG3' ' A' 1002 ' ' MET . 22.9 m-85 50.17 -53.4 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.063 1.745 . . . . 0.0 115.509 176.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 0.644 ' O ' ' HB ' ' A' ' 955' ' ' VAL . 61.4 t -43.87 -46.12 19.63 Favored Pre-proline 0 C--N 1.32 -0.709 0 C-N-CA 122.868 0.467 . . . . 0.0 111.65 172.297 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 0.562 ' HG2' ' HB2' ' A' ' 950' ' ' GLU . 14.1 Cg_exo -45.5 -51.07 8.47 Favored 'Trans proline' 0 CA--C 1.544 0.987 0 C-N-CA 122.434 2.089 . . . . 0.0 113.59 173.591 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.451 ' HE2' HG12 ' A' ' 958' ' ' VAL . 6.8 ptm -69.56 -30.96 68.87 Favored 'General case' 0 N--CA 1.463 0.199 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 177.615 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.644 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 73.5 t -54.13 -36.68 32.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.778 171.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.535 ' HD3' ' HA ' ' A' ' 953' ' ' PRO . 2.4 mptp? -59.22 -41.63 89.09 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 119.097 -0.477 . . . . 0.0 111.371 171.179 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -77.54 -39.6 45.41 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 118.929 -1.108 . . . . 0.0 111.378 -177.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.64 HG21 ' HA ' ' A' ' 955' ' ' VAL . 24.3 m -73.97 -35.33 41.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 O-C-N 122.208 -0.308 . . . . 0.0 111.2 179.716 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -66.07 -34.96 89.87 Favored Glycine 0 N--CA 1.44 -1.082 0 N-CA-C 110.672 -0.971 . . . . 0.0 110.672 177.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . 0.526 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 9.4 tt -71.29 -33.11 69.43 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.127 -0.537 . . . . 0.0 109.803 176.007 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -73.83 -37.8 64.74 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.513 -176.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.862 HD12 HD22 ' A' ' 991' ' ' LEU . 0.2 OUTLIER -66.5 -49.38 66.76 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-O 119.303 -0.38 . . . . 0.0 110.638 171.792 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.526 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 12.7 ptm180 -64.24 -30.29 71.35 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 118.856 0.753 . . . . 0.0 111.042 -177.416 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 38.7 m -69.14 -33.89 74.15 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 176.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.459 ' CD1' ' HB ' ' A' ' 925' ' ' VAL . 31.9 tp -71.34 -39.87 71.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 122.053 0.93 . . . . 0.0 109.669 175.176 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.508 ' HG ' HE21 ' A' ' 988' ' ' GLN . 10.4 tt -63.18 -43.94 96.82 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 114.505 -1.225 . . . . 0.0 108.812 -177.251 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -70.19 -38.61 75.38 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 114.787 -1.097 . . . . 0.0 111.977 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 3.2 p -65.46 -44.17 88.03 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.544 177.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.848 HG13 HG23 ' A' ' 984' ' ' ILE . 61.2 t -68.35 -36.41 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.246 175.134 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.811 ' HB2' HE22 ' A' ' 988' ' ' GLN . 8.1 t70 -69.38 -41.96 75.8 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 122.24 1.019 . . . . 0.0 109.031 -179.547 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.619 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 39.1 tt0 -73.24 -22.31 60.44 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 114.482 -1.236 . . . . 0.0 109.476 -179.324 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.711 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 58.7 m -72.9 -15.97 61.57 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.925 172.324 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.744 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 8.1 tt -64.08 -50.65 67.8 Favored Pre-proline 0 C--N 1.329 -0.302 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 175.717 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.744 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 13.2 Cg_exo -72.34 -11.85 27.01 Favored 'Trans proline' 0 C--N 1.355 0.916 0 C-N-CA 121.705 1.603 . . . . 0.0 113.396 169.766 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.711 ' HB ' ' HA ' ' A' ' 972' ' ' SER . 45.9 t -76.35 -52.1 18.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 O-C-N 122.034 -0.416 . . . . 0.0 110.269 174.112 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.802 HD11 ' HB3' ' A' 1043 ' ' ARG . 83.0 mt -97.7 107.18 38.28 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.814 178.396 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -70.82 -178.92 3.0 Favored 'Trans proline' 0 N--CA 1.463 -0.292 0 C-N-CA 122.533 2.155 . . . . 0.0 112.653 -175.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . 65.87 -149.83 0.23 Allowed 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.882 176.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 979' ' ' SER . . . . . . . . . . . . . 17.8 m -83.42 32.46 0.46 Allowed 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 -169.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.468 ' OG1' ' HG2' ' A' 1046 ' ' MET . 88.4 m -80.4 -20.06 44.85 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.104 0.478 . . . . 0.0 110.369 172.332 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.469 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 14.1 p80 -50.36 -57.37 8.09 Favored 'General case' 0 C--O 1.219 -0.517 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 -176.118 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 5.5 ptp180 -56.23 -22.65 30.9 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 113.974 1.101 . . . . 0.0 113.974 -176.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.515 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 2.6 mp0 -77.08 -38.21 52.92 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 119.11 0.868 . . . . 0.0 109.97 174.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.848 HG23 HG13 ' A' ' 969' ' ' VAL . 32.7 mt -71.11 -30.68 41.91 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.935 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.096 177.408 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . 0.469 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 42.7 mt-10 -66.88 -51.77 51.45 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.437 177.511 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 986' ' ' MET . . . . . 0.417 ' O ' ' HB3' ' A' ' 989' ' ' LYS . 68.5 mtt -70.79 -42.08 70.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 114.64 -1.163 . . . . 0.0 111.468 -175.387 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 1.048 ' HB2' ' HB2' ' A' 1035 ' ' LEU . . . -69.4 -51.64 34.61 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.457 -0.792 . . . . 0.0 112.225 -170.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.811 HE22 ' HB2' ' A' ' 970' ' ' ASP . 3.7 pt20 -62.87 -21.82 66.26 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.375 177.661 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . 0.766 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 12.0 ttmt -70.29 -42.36 72.14 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.565 171.34 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 2.6 mp -55.35 -53.9 50.42 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.862 HD22 HD12 ' A' ' 962' ' ' LEU . 2.3 tt -67.88 -25.7 65.65 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 178.5 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . 0.766 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 25.3 t-20 -53.17 -56.74 14.0 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.29 178.532 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 3.8 p -79.14 -34.07 43.61 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -177.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.07 -41.99 97.13 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.335 -0.546 . . . . 0.0 111.407 178.301 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.622 ' N ' HD22 ' A' 1028 ' ' LEU . 2.3 tm? -64.03 -23.88 67.5 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 122.576 0.35 . . . . 0.0 110.184 173.16 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -70.91 -32.74 69.77 Favored 'General case' 0 C--N 1.313 -0.994 0 C-N-CA 119.274 -0.971 . . . . 0.0 110.835 169.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.511 ' O ' ' HG2' ' A' 1001 ' ' LYS . 74.1 mm-40 -76.29 -38.09 56.59 Favored 'General case' 0 CA--C 1.512 -0.505 0 O-C-N 121.858 -0.526 . . . . 0.0 110.1 177.279 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.628 HD23 ' SD ' ' A' 1021 ' ' MET . 1.1 tm? -56.24 -47.13 79.09 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.339 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.606 ' O ' ' HB2' ' A' 1003 ' ' LYS . 72.7 mt -65.71 -31.82 55.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.728 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -62.67 -38.82 91.85 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.872 0.368 . . . . 0.0 111.676 176.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.511 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 54.8 mmtt -77.5 -43.02 33.51 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 122.529 1.157 . . . . 0.0 108.46 -177.519 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.968 ' HG3' ' HB3' ' A' ' 951' ' ' TYR . 12.0 tpp -57.8 -29.96 65.32 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 113.482 -1.69 . . . . 0.0 109.2 177.532 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.606 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 15.7 tptt -73.28 -55.11 6.86 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 114.162 -1.381 . . . . 0.0 111.037 -167.155 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.839 ' HB3' HD23 ' A' 1013 ' ' LEU . 3.9 mm? -71.4 -13.66 61.92 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.32 -178.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1005 ' ' ALA . . . . . 0.707 ' HB1' ' HB3' ' A' 1017 ' ' TYR . . . -69.86 -45.22 68.23 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 119.366 -0.933 . . . . 0.0 109.477 179.705 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.942 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 3.4 pp0? -75.75 -26.73 57.67 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 120.071 -0.652 . . . . 0.0 111.718 172.362 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.666 ' HG3' HD11 ' A' 1004 ' ' LEU . 21.9 mm-40 -52.0 -54.61 27.79 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.152 0.501 . . . . 0.0 110.581 174.271 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.768 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 72.1 m-85 -114.98 41.15 2.46 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.229 -0.588 . . . . 0.0 109.96 173.573 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 1.064 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 14.7 p -49.41 -22.16 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.603 172.389 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 20.6 mmt -30.96 -57.13 0.22 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.202 173.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 97.9 m -164.98 -72.32 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 O-C-N 123.122 0.263 . . . . 0.0 111.646 173.034 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 32.5 t -50.8 -74.92 0.03 OUTLIER 'General case' 0 C--O 1.24 0.595 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.8 -169.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.839 HD23 ' HB3' ' A' 1004 ' ' LEU . 7.6 mp -50.46 -39.08 46.89 Favored 'General case' 0 CA--C 1.504 -0.812 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -178.235 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 1.064 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.62 -49.25 70.94 Favored 'General case' 0 N--CA 1.442 -0.838 0 O-C-N 123.505 0.503 . . . . 0.0 111.465 -168.186 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A 1015 ' ' GLN . . . . . 0.426 ' O ' ' HD3' ' A' 1019 ' ' LYS . 12.1 pt20 -74.67 -38.8 62.33 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.607 -176.466 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 53.5 tt0 -66.75 -53.75 30.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.583 0.706 . . . . 0.0 110.592 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.707 ' HB3' ' HB1' ' A' 1005 ' ' ALA . 5.9 m-85 -65.67 -34.32 77.94 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.73 -1.123 . . . . 0.0 113.651 -174.177 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.546 ' HG2' HD11 ' A' ' 943' ' ' ILE . 51.4 tptt -80.32 -29.19 38.06 Favored 'General case' 0 N--CA 1.461 0.102 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.199 -177.7 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1019 ' ' LYS . . . . . 0.426 ' HD3' ' O ' ' A' 1015 ' ' GLN . 3.4 mptp? -72.52 -50.73 23.77 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 173.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -54.4 -31.84 55.87 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.086 166.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.628 ' SD ' HD23 ' A' ' 998' ' ' LEU . 10.9 tmm? -65.51 -52.32 53.53 Favored 'General case' 0 C--O 1.217 -0.651 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 174.092 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1022 ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' 1022 ' ' LEU . 0.0 OUTLIER -74.08 -12.17 60.53 Favored 'General case' 0 C--O 1.218 -0.591 0 C-N-CA 119.258 -0.977 . . . . 0.0 109.806 -176.762 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 92.5 m -82.21 -41.86 19.74 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.205 175.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.547 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.12 -22.04 49.44 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-O 120.972 0.415 . . . . 0.0 109.937 174.134 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.693 ' HB3' HG23 ' A' ' 936' ' ' VAL . . . -84.7 -22.05 29.91 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.929 169.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.507 ' O ' HG22 ' A' 1030 ' ' VAL . 47.6 t60 -76.55 -25.62 54.26 Favored 'General case' 0 C--O 1.213 -0.854 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 164.587 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1027 ' ' ALA . . . . . 0.438 ' HB2' ' O ' ' A' 1024 ' ' ALA . . . -69.52 -41.4 76.07 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 122.746 0.419 . . . . 0.0 110.168 163.59 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.622 HD22 ' N ' ' A' ' 995' ' ' LEU . 21.0 mt -60.33 -46.56 89.46 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 170.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1029 ' ' ALA . . . . . 0.431 ' HA ' HG23 ' A' ' 933' ' ' VAL . . . -57.57 -43.04 84.22 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 123.192 0.308 . . . . 0.0 111.456 173.306 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.507 HG22 ' O ' ' A' 1026 ' ' HIS . 4.9 t -66.55 -50.74 64.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-O 120.916 0.389 . . . . 0.0 110.47 -176.663 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.663 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 14.0 m-20 -75.02 -29.1 60.72 Favored 'General case' 0 C--O 1.212 -0.871 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.212 -176.475 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.675 ' HB2' HG21 ' A' ' 929' ' ' VAL . . . -58.97 -45.82 89.58 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 168.438 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 56.1 tttm -65.29 -41.98 93.57 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.768 0.794 . . . . 0.0 109.877 175.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.663 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 38.9 t30 -70.5 -53.76 14.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.002 -1.454 . . . . 0.0 112.09 -172.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 1.048 ' HB2' ' HB2' ' A' ' 987' ' ' ALA . 2.5 pp -62.79 -38.57 91.19 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 119.332 -0.366 . . . . 0.0 110.599 -174.878 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.623 HD22 HG22 ' A' ' 925' ' ' VAL . 4.3 pp -71.43 -36.4 71.27 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 116.933 -1.907 . . . . 0.0 109.734 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.602 ' N ' HD13 ' A' 1036 ' ' LEU . 11.5 t70 -57.92 -39.76 78.77 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.749 174.291 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.633 HG11 ' HE1' ' A' 1053 ' ' HIS . 13.1 t -55.86 -33.49 34.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 114.124 -1.398 . . . . 0.0 111.578 173.807 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.592 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 1.9 mp -86.44 -33.94 7.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 117.944 0.338 . . . . 0.0 111.486 175.19 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.617 ' HB3' HD11 ' A' ' 919' ' ' ILE . 1.0 OUTLIER -53.18 -49.45 66.64 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 166.424 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.539 ' HA ' HG21 ' A' ' 919' ' ' ILE . 36.2 mt-30 -69.2 -39.92 78.35 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.371 -0.832 . . . . 0.0 111.205 175.223 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.592 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -54.63 -49.28 70.89 Favored 'General case' 0 CA--C 1.497 -1.081 0 C-N-CA 122.932 0.493 . . . . 0.0 111.782 -175.637 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.802 ' HB3' HD11 ' A' ' 976' ' ' LEU . 0.0 OUTLIER -63.68 -38.52 91.42 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.818 -178.319 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.558 ' N ' ' HD3' ' A' 1043 ' ' ARG . 56.4 tp -70.05 -38.82 75.91 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 121.768 0.794 . . . . 0.0 109.566 178.56 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.691 ' HD2' ' HA ' ' A' 1052 ' ' PRO . 10.4 tttp -59.01 -62.48 1.85 Allowed 'General case' 0 N--CA 1.437 -1.105 0 CA-C-N 114.341 -1.3 . . . . 0.0 110.563 -178.603 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.468 ' HG2' ' OG1' ' A' ' 980' ' ' THR . 0.0 OUTLIER -67.48 -22.99 65.44 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.134 -169.318 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.435 HG12 ' O ' ' A' 1043 ' ' ARG . 17.9 mm -65.05 -54.06 33.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.51 172.658 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 6.2 t -138.91 52.41 1.78 Allowed 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 119.747 -0.781 . . . . 0.0 111.682 -175.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1049 ' ' GLN . . . . . 0.554 ' HB2' ' O ' ' A' 1045 ' ' LYS . 73.5 mt-30 -143.08 143.23 31.77 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.916 172.697 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 26.7 t -98.46 1.89 47.18 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 174.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 12.3 mmt85 -131.51 152.93 81.32 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.236 -178.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1052 ' ' PRO . . . . . 0.691 ' HA ' ' HD2' ' A' 1045 ' ' LYS . 3.0 Cg_exo -73.93 131.91 16.25 Favored 'Trans proline' 0 N--CA 1.455 -0.791 0 C-N-CA 122.447 2.098 . . . . 0.0 110.702 168.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 1053 ' ' HIS . . . . . 0.633 ' HE1' HG11 ' A' 1038 ' ' VAL . 4.3 p80 . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 114.59 -1.186 . . . . 0.0 111.692 -176.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.719 0 N-CA-C 112.171 -0.372 . . . . 0.0 112.171 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 909' ' ' SER . . . . . 0.778 ' HB2' ' HD3' ' A' ' 910' ' ' PRO . 45.4 m -85.8 -61.69 0.26 Allowed Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 122.752 -0.264 . . . . 0.0 111.599 179.681 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 910' ' ' PRO . . . . . 0.778 ' HD3' ' HB2' ' A' ' 909' ' ' SER . 21.0 Cg_exo -65.48 -48.5 3.2 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 122.312 2.008 . . . . 0.0 113.177 -173.381 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -72.43 -30.86 63.98 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.722 -0.752 . . . . 0.0 113.125 -173.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 912' ' ' ILE . . . . . 0.408 ' O ' HG21 ' A' ' 912' ' ' ILE . 11.1 mt -105.22 11.7 8.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 121.233 0.539 . . . . 0.0 110.688 -175.799 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 913' ' ' SER . . . . . 0.517 ' HB2' ' O ' ' A' ' 909' ' ' SER . 13.2 t -72.84 -35.63 67.3 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.939 0.399 . . . . 0.0 110.124 178.814 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 175.16 171.41 39.17 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 120.983 -0.627 . . . . 0.0 111.702 179.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 915' ' ' GLY . . . . . 0.434 ' HA2' ' HD3' ' A' ' 920' ' ' ARG . . . 84.33 -69.94 3.24 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 121.032 -0.604 . . . . 0.0 112.027 177.405 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . 58.31 -108.57 1.53 Allowed Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.023 -177.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . -109.41 80.34 0.27 Allowed Glycine 0 N--CA 1.444 -0.833 0 N-CA-C 111.437 -0.665 . . . . 0.0 111.437 177.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . 0.625 ' HA2' HD11 ' A' 1044 ' ' LEU . . . -172.89 164.27 36.29 Favored Glycine 0 N--CA 1.446 -0.658 0 N-CA-C 111.717 -0.553 . . . . 0.0 111.717 -177.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 919' ' ' ILE . . . . . 0.674 HG21 ' CG ' ' A' 1040 ' ' ASP . 73.7 mt -69.93 80.97 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-O 121.824 0.821 . . . . 0.0 109.678 177.066 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . 0.434 ' HD3' ' HA2' ' A' ' 915' ' ' GLY . 68.3 ttt180 -158.46 86.74 0.87 Allowed 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.85 -1.068 . . . . 0.0 108.404 178.384 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 26.0 m -141.8 86.04 1.97 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.506 -177.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -111.98 43.14 1.62 Allowed 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 106.649 -1.611 . . . . 0.0 106.649 169.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.569 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 12.8 m-20 -84.06 -162.28 0.63 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 113.782 -1.554 . . . . 0.0 111.11 -175.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.77 ' HB3' HG22 ' A' ' 968' ' ' THR . 16.8 tppt? -54.98 -26.1 34.42 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -175.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.533 ' O ' HG21 ' A' ' 929' ' ' VAL . 29.0 m -61.7 -29.8 46.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-O 121.079 0.466 . . . . 0.0 110.304 177.291 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.569 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -78.2 -26.28 47.46 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 176.356 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -76.02 -25.7 55.95 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.035 174.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.566 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 5.1 m120 -77.29 -29.84 53.94 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 121.663 0.744 . . . . 0.0 109.032 173.712 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.664 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 81.8 t -76.68 -29.48 18.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.329 174.642 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 930' ' ' THR . . . . . 0.426 ' O ' ' HB3' ' A' ' 934' ' ' LYS . 36.1 m -60.49 -39.98 89.64 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 170.217 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -72.32 -53.25 9.11 Favored Glycine 0 CA--C 1.524 0.629 0 CA-C-N 115.103 -0.953 . . . . 0.0 113.708 178.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.664 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.8 pp -65.05 -47.61 76.76 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -175.667 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . 0.41 HG21 ' CB ' ' A' 1029 ' ' ALA . 73.6 t -63.25 -42.9 98.12 Favored 'Isoleucine or valine' 0 C--O 1.24 0.582 0 CA-C-O 121.407 0.622 . . . . 0.0 110.52 -177.797 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.748 ' O ' ' HB2' ' A' ' 938' ' ' GLU . 16.0 ttpt -60.51 -40.22 90.62 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.655 178.449 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -58.59 -46.59 86.63 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.499 -0.48 . . . . 0.0 111.083 175.174 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.838 HG21 ' HB3' ' A' 1025 ' ' ALA . 57.8 t -45.05 -83.65 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 123.274 0.63 . . . . 0.0 112.386 -179.075 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 19.4 pt -64.6 -43.41 96.73 Favored 'Isoleucine or valine' 0 C--O 1.248 0.997 0 N-CA-C 112.316 0.488 . . . . 0.0 112.316 -173.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.748 ' HB2' ' O ' ' A' ' 934' ' ' LYS . 6.2 mm-40 -67.84 -51.29 50.17 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.855 -169.576 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.532 ' O ' HG23 ' A' ' 943' ' ' ILE . 30.8 ttm -72.78 -27.81 62.22 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 120.093 -0.643 . . . . 0.0 109.686 -175.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 940' ' ' SER . . . . . . . . . . . . . 2.8 m -51.34 -53.41 36.43 Favored 'General case' 0 C--N 1.346 0.441 0 O-C-N 123.97 0.793 . . . . 0.0 112.501 -174.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 14.6 t -104.31 -23.53 13.21 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.705 -175.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.706 ' HB3' ' O ' ' A' ' 938' ' ' GLU . 0.3 OUTLIER -85.05 -56.96 3.29 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.118 -0.633 . . . . 0.0 112.285 -164.935 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.583 HG21 ' HG3' ' A' ' 944' ' ' GLN . 11.5 tt -60.88 -11.26 3.89 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -177.218 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.616 ' HG2' ' HB2' ' A' ' 949' ' ' GLU . 17.6 mt-30 -113.93 97.7 45.61 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.074 -176.325 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -75.64 -37.28 1.79 Allowed 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.287 1.991 . . . . 0.0 111.765 176.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . 0.673 ' HB3' ' HD3' ' A' ' 947' ' ' PRO . . . -160.77 -53.0 0.01 OUTLIER Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.03 -178.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.673 ' HD3' ' HB3' ' A' ' 946' ' ' ALA . 12.4 Cg_exo -70.52 154.17 64.93 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 121.963 1.775 . . . . 0.0 112.065 178.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . 0.604 ' HB3' HG12 ' A' 1009 ' ' VAL . 5.6 Cg_endo -52.45 141.0 52.78 Favored 'Trans proline' 0 CA--C 1.512 -0.592 0 C-N-CA 123.132 2.555 . . . . 0.0 112.699 176.674 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 0.68 ' HB3' ' CD1' ' A' ' 951' ' ' TYR . 5.3 tt0 -72.11 -18.75 61.88 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.604 172.417 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.558 ' HB2' ' HG2' ' A' ' 953' ' ' PRO . 19.6 mm-40 80.28 -14.87 0.8 Allowed 'General case' 0 C--N 1.347 0.487 0 O-C-N 124.328 1.017 . . . . 0.0 109.679 -165.289 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.889 ' HB3' ' HG3' ' A' 1002 ' ' MET . 20.6 m-30 54.04 -38.19 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 115.789 1.774 . . . . 0.0 115.789 176.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 0.498 ' HA ' ' HB ' ' A' ' 955' ' ' VAL . 45.4 t -54.79 -40.6 84.9 Favored Pre-proline 0 C--N 1.32 -0.688 0 O-C-N 122.076 -0.39 . . . . 0.0 111.019 168.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 0.69 ' HA ' ' HD2' ' A' ' 956' ' ' LYS . 8.2 Cg_exo -44.57 -51.32 7.25 Favored 'Trans proline' 0 C--N 1.357 0.985 0 C-N-CA 122.468 2.112 . . . . 0.0 112.836 170.927 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.799 ' HG2' ' HE1' ' A' 1002 ' ' MET . 0.4 OUTLIER -62.66 -41.76 99.24 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.884 172.144 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.498 ' HB ' ' HA ' ' A' ' 952' ' ' VAL . 54.9 t -52.4 -36.88 22.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.886 176.342 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . 0.69 ' HD2' ' HA ' ' A' ' 953' ' ' PRO . 59.6 mttt -66.12 -41.89 89.92 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 111.599 0.222 . . . . 0.0 111.599 173.15 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -77.32 -44.82 28.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.754 0.311 . . . . 0.0 111.356 -172.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.539 ' O ' ' HG ' ' A' ' 962' ' ' LEU . 14.4 p -75.1 -34.47 31.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 176.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -64.44 -43.72 96.32 Favored Glycine 0 N--CA 1.448 -0.56 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 177.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . 0.562 HD13 ' HD2' ' A' ' 963' ' ' ARG . 16.3 tp -63.14 -38.47 91.31 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.925 -0.137 . . . . 0.0 110.678 175.23 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -69.84 -60.02 2.57 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 120.898 0.38 . . . . 0.0 111.012 -177.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.859 HD13 HD23 ' A' ' 995' ' ' LEU . 4.1 pp -56.54 -29.66 62.19 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 173.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.562 ' HD2' HD13 ' A' ' 960' ' ' LEU . 9.9 ptp180 -73.77 -36.39 65.08 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 120.195 1.361 . . . . 0.0 110.637 172.027 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 32.2 m -62.72 -33.52 75.29 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 174.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.566 ' HA ' ' OD1' ' A' ' 928' ' ' ASN . 25.8 tp -61.65 -54.35 44.0 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.487 174.132 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.759 ' HG ' ' NE2' ' A' ' 988' ' ' GLN . 8.0 tt -54.95 -41.04 70.6 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.185 -1.37 . . . . 0.0 109.38 178.826 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -68.8 -35.07 76.57 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.034 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.77 HG22 ' HB3' ' A' ' 924' ' ' LYS . 23.2 m -73.17 -39.21 65.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 118.809 0.731 . . . . 0.0 110.675 177.305 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.738 HG11 HG22 ' A' ' 984' ' ' ILE . 27.1 t -67.31 -36.67 77.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 CA-C-O 120.726 0.298 . . . . 0.0 110.519 173.255 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -68.63 -42.37 78.14 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 179.217 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.657 ' O ' HG23 ' A' ' 975' ' ' VAL . 31.7 tp10 -68.34 -24.8 64.86 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 113.857 -1.52 . . . . 0.0 109.69 179.738 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 58.8 m -73.54 -17.59 61.19 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.366 177.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.682 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 35.0 tp -67.72 -52.81 24.25 Favored Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 119.741 -0.783 . . . . 0.0 110.284 172.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.682 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 19.2 Cg_exo -70.14 -11.31 30.1 Favored 'Trans proline' 0 C--N 1.358 1.041 0 C-N-CA 121.404 1.403 . . . . 0.0 113.502 172.905 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.657 HG23 ' O ' ' A' ' 971' ' ' GLU . 38.8 t -66.15 -55.36 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 173.228 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.55 ' HB3' ' HE3' ' A' 1046 ' ' MET . 18.0 tp -133.78 87.36 36.07 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 175.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -79.91 39.26 0.81 Allowed 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 123.772 2.982 . . . . 0.0 113.119 -171.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . 0.714 ' HB3' ' SD ' ' A' 1046 ' ' MET . . . -86.26 47.61 1.49 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.951 0.405 . . . . 0.0 110.944 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.474 ' HB2' ' CE1' ' A' 1053 ' ' HIS . 59.4 m 67.77 17.82 9.76 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 177.159 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.824 ' HB ' ' SD ' ' A' 1046 ' ' MET . 6.0 t -76.81 1.61 16.86 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.856 177.457 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.495 ' O ' ' HG2' ' A' ' 985' ' ' GLU . 1.9 p80 -49.69 -49.14 48.82 Favored 'General case' 0 C--O 1.208 -1.101 0 O-C-N 123.224 0.327 . . . . 0.0 110.984 -177.675 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . 0.404 ' HA ' ' HB2' ' A' ' 985' ' ' GLU . 0.1 OUTLIER -52.65 -21.42 3.95 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 179.426 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.607 ' HG2' ' HB1' ' A' 1042 ' ' ALA . 0.3 OUTLIER -80.08 -49.53 11.63 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 118.747 0.703 . . . . 0.0 111.45 171.071 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.738 HG22 HG11 ' A' ' 969' ' ' VAL . 2.9 mp -63.52 -30.94 51.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 178.174 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 981' ' ' HIS . 70.4 mm-40 -58.9 -46.17 88.52 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.083 175.718 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 24.6 mmt -73.13 -42.74 62.56 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.205 -176.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 0.847 ' HB2' ' HB2' ' A' 1035 ' ' LEU . . . -65.65 -49.32 69.09 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 114.713 -1.131 . . . . 0.0 111.971 -176.384 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.768 ' O ' ' HB2' ' A' ' 992' ' ' ASN . 12.8 mm100 -56.02 -40.81 73.98 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.035 177.533 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . 0.602 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 0.0 OUTLIER -72.35 -39.2 68.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.297 -178.784 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.594 HD22 ' HB3' ' A' 1035 ' ' LEU . 26.7 tp -55.0 -59.12 5.18 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.921 179.702 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.612 ' HB3' ' CD2' ' A' 1035 ' ' LEU . 3.2 pp -63.08 -31.62 72.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.868 0.842 . . . . 0.0 109.741 179.007 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . 0.768 ' HB2' ' O ' ' A' ' 988' ' ' GLN . 20.6 t-20 -53.58 -57.33 11.13 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 113.564 -1.653 . . . . 0.0 112.747 -174.589 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 25.0 m -79.71 -25.34 41.2 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 -177.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -72.58 -38.03 68.01 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 119.346 -0.941 . . . . 0.0 111.404 177.714 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.859 HD23 HD13 ' A' ' 962' ' ' LEU . 0.5 OUTLIER -66.91 -24.25 66.07 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.132 171.033 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -78.19 -26.3 47.52 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 119.47 -0.892 . . . . 0.0 109.708 172.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . 0.513 ' O ' ' HG2' ' A' 1001 ' ' LYS . 6.8 tp10 -74.41 -42.69 58.79 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 173.636 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.753 HD22 HD13 ' A' 1028 ' ' LEU . 0.0 OUTLIER -56.99 -47.25 81.27 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.649 -178.89 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.638 ' O ' ' HB2' ' A' 1003 ' ' LYS . 82.6 mt -66.64 -39.26 83.38 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.332 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.246 -174.532 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 21.2 m-80 -62.18 -36.75 82.84 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.072 0.463 . . . . 0.0 111.633 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.513 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 72.3 mmtt -78.28 -40.61 36.41 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 122.133 0.968 . . . . 0.0 109.422 -177.42 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.889 ' HG3' ' HB3' ' A' ' 951' ' ' TYR . 5.0 tpt -63.86 -27.32 69.08 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.28 -1.327 . . . . 0.0 109.049 178.168 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.638 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 12.4 tptp -73.28 -53.09 11.71 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.031 -1.44 . . . . 0.0 110.506 -167.4 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.6 ' HA ' ' HB2' ' A' 1007 ' ' GLN . 7.2 mp -77.4 -12.03 59.91 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.142 179.545 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1005 ' ' ALA . . . . . 0.695 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -67.56 -40.74 84.93 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 119.526 -0.87 . . . . 0.0 109.526 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.761 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.3 pp0? -75.04 -32.72 61.63 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 119.115 -0.469 . . . . 0.0 111.69 169.56 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.6 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 10.6 mm-40 -46.37 -49.51 17.76 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.04 0.447 . . . . 0.0 110.588 175.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.87 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 49.7 m-85 -126.86 48.3 2.2 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 119.844 -0.743 . . . . 0.0 110.542 171.246 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 0.926 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 11.9 p -50.94 -21.54 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.593 167.711 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1010 ' ' MET . . . . . 0.416 ' N ' HG11 ' A' 1009 ' ' VAL . 87.8 mtp -37.9 -49.35 1.22 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.161 -1.382 . . . . 0.0 111.574 172.509 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -171.76 -81.8 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 177.338 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 2.5 m -49.89 -71.46 0.06 Allowed 'General case' 0 C--O 1.246 0.911 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.829 -168.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.87 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 4.8 mp -46.56 -42.82 16.45 Favored 'General case' 0 CA--C 1.498 -1.047 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 179.539 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 0.926 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.82 -58.01 9.26 Favored 'General case' 0 N--CA 1.438 -1.048 0 C-N-CA 119.827 -0.749 . . . . 0.0 110.769 -166.833 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A 1015 ' ' GLN . . . . . 0.628 ' O ' ' HB3' ' A' 1019 ' ' LYS . 40.3 mt-30 -67.83 -34.79 77.42 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.02 -169.452 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1016 ' ' GLU . . . . . 0.454 ' OE2' ' HE3' ' A' 1019 ' ' LYS . 18.4 tp10 -73.96 -41.64 61.68 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.307 -0.557 . . . . 0.0 111.142 177.517 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.695 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 6.1 m-85 -75.14 -34.4 61.64 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.93 0.871 . . . . 0.0 111.834 -173.927 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.507 ' HB2' ' NE2' ' A' 1014 ' ' GLN . 13.7 tptm -79.79 -40.86 27.7 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 113.414 -1.721 . . . . 0.0 110.825 -175.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1019 ' ' LYS . . . . . 0.628 ' HB3' ' O ' ' A' 1015 ' ' GLN . 0.0 OUTLIER -71.38 -35.19 71.0 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -179.58 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A 1020 ' ' GLN . . . . . 0.597 ' N ' ' HD3' ' A' 1019 ' ' LYS . 9.4 tt0 -69.99 -30.25 67.53 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.098 -1.41 . . . . 0.0 110.49 167.328 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.757 ' HG3' ' SD ' ' A' 1002 ' ' MET . 14.8 tmm? -69.02 -54.03 17.32 Favored 'General case' 0 CA--C 1.507 -0.702 0 C-N-CA 120.977 -0.289 . . . . 0.0 111.034 -179.616 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1022 ' ' LEU . . . . . 0.628 ' HA ' ' HB2' ' A' 1025 ' ' ALA . 0.2 OUTLIER -83.63 -2.72 56.72 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 119.485 -0.886 . . . . 0.0 109.462 -172.43 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 46.1 m -86.11 -34.09 20.73 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 168.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.526 ' O ' ' HB2' ' A' 1027 ' ' ALA . . . -79.09 -22.6 45.0 Favored 'General case' 0 C--O 1.221 -0.425 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 173.015 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.838 ' HB3' HG21 ' A' ' 936' ' ' VAL . . . -85.9 -26.56 25.52 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.005 169.567 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.51 ' O ' HG22 ' A' 1030 ' ' VAL . 12.9 t60 -70.86 -30.7 67.17 Favored 'General case' 0 C--O 1.215 -0.762 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 165.234 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1027 ' ' ALA . . . . . 0.526 ' HB2' ' O ' ' A' 1024 ' ' ALA . . . -64.91 -42.46 94.71 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 123.975 0.91 . . . . 0.0 110.755 163.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.753 HD13 HD22 ' A' ' 998' ' ' LEU . 30.2 mt -58.13 -46.69 85.18 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 119.923 -0.711 . . . . 0.0 109.472 171.507 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1029 ' ' ALA . . . . . 0.41 ' CB ' HG21 ' A' ' 933' ' ' VAL . . . -59.09 -43.51 91.83 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 173.565 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.566 ' O ' ' HB3' ' A' 1033 ' ' LYS . 12.2 t -68.01 -51.23 51.4 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.211 0 CA-C-O 121.675 0.75 . . . . 0.0 110.863 -176.54 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1031 ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -76.76 -29.5 56.14 Favored 'General case' 0 C--O 1.214 -0.814 0 CA-C-N 115.056 -0.974 . . . . 0.0 112.158 -175.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.595 ' HA ' ' CD2' ' A' 1035 ' ' LEU . . . -71.28 -27.67 63.59 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.509 -0.476 . . . . 0.0 109.741 171.413 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.566 ' HB3' ' O ' ' A' 1030 ' ' VAL . 84.9 tttt -65.54 -45.92 81.57 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 122.091 0.948 . . . . 0.0 109.22 168.287 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.597 ' O ' ' HB3' ' A' 1037 ' ' ASP . 56.4 t30 -70.87 -46.61 62.32 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 113.967 -1.469 . . . . 0.0 112.599 -176.026 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 0.847 ' HB2' ' HB2' ' A' ' 987' ' ' ALA . 4.0 pp -63.9 -36.38 83.76 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 122.156 -0.34 . . . . 0.0 110.627 -177.128 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.458 HD12 ' N ' ' A' 1037 ' ' ASP . 4.7 pp -72.36 -35.87 68.62 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 117.282 -1.767 . . . . 0.0 109.745 178.173 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.661 ' HA ' ' OD2' ' A' 1040 ' ' ASP . 19.3 t70 -54.88 -30.93 59.18 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 122.999 1.38 . . . . 0.0 110.585 168.716 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.514 ' HB ' ' O ' ' A' 1035 ' ' LEU . 14.3 t -73.57 -36.96 48.94 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.54 177.479 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.708 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 2.0 mp -79.31 -26.05 12.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 C-N-CA 121.123 -0.231 . . . . 0.0 111.573 172.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.674 ' CG ' HG21 ' A' ' 919' ' ' ILE . 0.2 OUTLIER -59.93 -44.69 94.19 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 171.48 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A 1041 ' ' GLN . . . . . 0.408 ' N ' ' OD1' ' A' 1040 ' ' ASP . 12.4 mt-30 -76.55 -31.22 57.45 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.718 174.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.708 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -56.29 -55.97 26.84 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 120.973 0.416 . . . . 0.0 111.818 -179.275 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.669 ' HA ' ' CE ' ' A' 1046 ' ' MET . 11.8 ptm180 -65.73 -34.52 78.38 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.535 -176.045 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.625 HD11 ' HA2' ' A' ' 918' ' ' GLY . 49.5 tp -63.62 -52.34 61.26 Favored 'General case' 0 C--O 1.216 -0.707 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.772 171.705 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.736 ' O ' ' HB2' ' A' 1049 ' ' GLN . 25.8 mtpt -58.58 -42.98 89.24 Favored 'General case' 0 C--O 1.215 -0.718 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -172.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.824 ' SD ' ' HB ' ' A' ' 980' ' ' THR . 0.3 OUTLIER -71.79 -26.38 62.4 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.376 -0.529 . . . . 0.0 111.974 -179.063 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A 1047 ' ' ILE . . . . . 0.512 HG12 ' O ' ' A' 1043 ' ' ARG . 44.9 mm -87.52 -43.7 15.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 121.347 0.594 . . . . 0.0 111.011 176.872 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 27.6 t -84.0 -15.81 46.34 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.114 -0.948 . . . . 0.0 112.473 -171.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1049 ' ' GLN . . . . . 0.736 ' HB2' ' O ' ' A' 1045 ' ' LYS . 14.4 tp60 -51.4 126.0 15.92 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.762 0.791 . . . . 0.0 111.82 -164.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 8.2 m -62.89 -23.56 67.4 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.007 -1.451 . . . . 0.0 110.506 178.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -79.64 141.92 56.69 Favored Pre-proline 0 N--CA 1.449 -0.495 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.9 178.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -48.83 114.06 1.11 Allowed 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 123.072 2.514 . . . . 0.0 111.798 175.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 1053 ' ' HIS . . . . . 0.474 ' CE1' ' HB2' ' A' ' 979' ' ' SER . 36.5 t60 . . . . . 0 C--N 1.321 -0.631 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.42 -173.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.724 0 N-CA-C 111.98 -0.448 . . . . 0.0 111.98 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 35.6 m 57.63 81.76 0.25 Allowed Pre-proline 0 CA--C 1.533 0.293 0 CA-C-O 121.001 0.429 . . . . 0.0 111.167 -178.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -77.18 55.47 5.06 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 123.394 2.73 . . . . 0.0 112.584 -177.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . 123.77 -75.77 0.38 Allowed Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.515 178.268 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 58.8 mt -115.18 -48.91 4.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 120.524 0.202 . . . . 0.0 110.868 -176.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 29.1 t 72.26 160.2 0.22 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.624 -178.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 125.35 5.08 6.77 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.221 -178.632 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 85.77 -95.81 2.04 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 121.022 -0.609 . . . . 0.0 112.255 179.225 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . -152.98 -156.72 7.7 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 121.108 -0.567 . . . . 0.0 111.966 -178.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . -96.84 -49.84 1.88 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.125 178.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 918' ' ' GLY . . . . . 0.91 ' HA2' HD23 ' A' 1044 ' ' LEU . . . 79.49 -153.96 37.7 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.955 -0.641 . . . . 0.0 112.977 177.447 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 919' ' ' ILE . . . . . 0.612 ' HA ' ' HB3' ' A' 1040 ' ' ASP . 0.1 OUTLIER -73.8 123.18 28.44 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.697 0 C-N-CA 123.358 0.663 . . . . 0.0 109.582 176.909 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 920' ' ' ARG . . . . . . . . . . . . . 43.6 ttm180 -165.38 -17.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.638 -175.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 9.2 m -62.37 94.79 0.06 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.195 0.522 . . . . 0.0 112.301 -171.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -86.38 82.48 7.96 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 176.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 923' ' ' ASP . . . . . 0.651 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 17.3 m-20 -126.53 -168.49 1.87 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.024 -175.511 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 924' ' ' LYS . . . . . 0.488 ' HB3' HG21 ' A' ' 968' ' ' THR . 31.0 mmtp -54.66 -30.85 56.49 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -168.651 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 925' ' ' VAL . . . . . 0.583 ' O ' HG22 ' A' ' 929' ' ' VAL . 35.0 m -56.94 -34.95 45.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.116 0.484 . . . . 0.0 110.641 177.355 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 926' ' ' TYR . . . . . 0.651 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.1 OUTLIER -74.08 -37.28 64.25 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.405 174.952 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 927' ' ' GLU . . . . . 0.492 ' HG3' ' CZ ' ' A' ' 926' ' ' TYR 0.257 1.9 tt0 -78.38 -23.78 46.65 Favored 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 118.399 -1.32 . . . . 0.0 113.758 -177.334 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 928' ' ' ASN . . . . . 0.441 ' ND2' HG22 ' A' ' 964' ' ' THR . 87.1 m-20 -72.2 -27.77 62.77 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.22 0.533 . . . . 0.0 110.097 169.504 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 929' ' ' VAL . . . . . 0.643 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 98.7 t -77.0 -29.38 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.953 171.776 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 930' ' ' THR . . . . . . . . . . . . . 25.7 m -61.48 -40.38 94.33 Favored 'General case' 0 C--N 1.311 -1.088 0 C-N-CA 119.507 -0.877 . . . . 0.0 108.898 171.121 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -71.57 -53.05 10.53 Favored Glycine 0 CA--C 1.527 0.786 0 CA-C-N 115.172 -0.922 . . . . 0.0 113.689 176.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 932' ' ' LEU . . . . . 0.643 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.8 pp -61.73 -46.67 88.65 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.94 0.718 . . . . 0.0 112.94 -176.19 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 73.5 t -68.99 -39.24 79.49 Favored 'Isoleucine or valine' 0 C--O 1.241 0.605 0 CA-C-O 121.154 0.502 . . . . 0.0 110.906 -176.039 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 934' ' ' LYS . . . . . 0.47 ' O ' ' HB2' ' A' ' 938' ' ' GLU . 5.2 tppp? -55.63 -44.11 76.8 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.679 -178.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -60.13 -45.19 93.86 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.462 177.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 936' ' ' VAL . . . . . 0.641 ' O ' ' HB2' ' A' ' 940' ' ' SER . 85.4 t -45.17 -74.32 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 123.6 0.76 . . . . 0.0 112.879 -176.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 937' ' ' ILE . . . . . 0.514 HG22 HD13 ' A' 1022 ' ' LEU . 14.5 pt -77.32 -42.53 30.76 Favored 'Isoleucine or valine' 0 C--O 1.245 0.849 0 CA-C-N 115.927 -0.579 . . . . 0.0 112.546 -174.171 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 938' ' ' GLU . . . . . 0.608 ' O ' ' HB2' ' A' ' 942' ' ' LYS . 35.4 mm-40 -66.65 -43.41 84.69 Favored 'General case' 0 C--N 1.316 -0.867 0 C-N-CA 120.53 -0.468 . . . . 0.0 111.105 -173.059 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 939' ' ' MET . . . . . 0.411 ' HG2' ' HB ' ' A' ' 943' ' ' ILE . 11.1 ttp -75.59 -27.28 58.48 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 119.225 -0.99 . . . . 0.0 110.615 176.238 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 940' ' ' SER . . . . . 0.641 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 32.5 t -48.81 -53.74 18.0 Favored 'General case' 0 C--O 1.236 0.393 0 O-C-N 123.8 0.687 . . . . 0.0 112.101 -170.452 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 10.9 p -123.18 -19.57 5.97 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.96 -174.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 942' ' ' LYS . . . . . 0.608 ' HB2' ' O ' ' A' ' 938' ' ' GLU . 2.1 mptp? -82.41 -40.1 21.72 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 119.5 -0.88 . . . . 0.0 110.472 -174.553 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 943' ' ' ILE . . . . . 0.477 ' O ' HD12 ' A' ' 943' ' ' ILE . 0.1 OUTLIER -34.87 -42.29 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 O-C-N 123.979 0.799 . . . . 0.0 112.729 177.608 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 944' ' ' GLN . . . . . 0.49 ' HB3' ' HA ' ' A' ' 947' ' ' PRO . 53.4 tt0 -174.98 143.65 0.78 Allowed Pre-proline 0 CA--C 1.53 0.194 0 CA-C-N 118.255 0.48 . . . . 0.0 110.419 177.043 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 945' ' ' PRO . . . . . 0.449 ' O ' ' HD3' ' A' ' 947' ' ' PRO . 71.5 Cg_exo -52.14 -48.63 20.68 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.657 2.238 . . . . 0.0 111.496 173.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 946' ' ' ALA . . . . . . . . . . . . . . . -107.25 85.54 2.16 Favored Pre-proline 0 C--N 1.329 -0.323 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 168.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 947' ' ' PRO . . . . . 0.49 ' HA ' ' HB3' ' A' ' 944' ' ' GLN . 68.9 Cg_endo -87.37 119.96 1.47 Allowed 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 123.074 2.516 . . . . 0.0 113.733 -168.021 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 948' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -70.74 -169.05 0.35 Allowed 'Trans proline' 0 CA--C 1.509 -0.757 0 C-N-CA 123.247 2.632 . . . . 0.0 112.231 176.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 949' ' ' GLU . . . . . 0.937 ' HB3' ' HB2' ' A' 1006 ' ' GLN . 0.0 OUTLIER -83.34 76.26 9.92 Favored 'General case' 0 CA--C 1.491 -1.323 0 CA-C-O 121.589 0.709 . . . . 0.0 111.138 178.004 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 950' ' ' GLU . . . . . 0.652 ' HA ' ' HG2' ' A' ' 953' ' ' PRO . 21.2 mm-40 -84.16 10.15 10.95 Favored 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 156.051 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 951' ' ' TYR . . . . . 0.552 ' CD1' ' N ' ' A' ' 951' ' ' TYR . 0.4 OUTLIER -71.5 -55.93 6.9 Favored 'General case' 0 C--O 1.216 -0.699 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.577 -178.424 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 952' ' ' VAL . . . . . 0.978 HG12 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -59.85 -42.69 92.24 Favored Pre-proline 0 CA--C 1.542 0.665 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.41 172.342 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 953' ' ' PRO . . . . . 0.978 ' HD3' HG12 ' A' ' 952' ' ' VAL . 87.1 Cg_exo -55.21 -38.76 93.43 Favored 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 121.212 1.274 . . . . 0.0 111.735 167.572 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 954' ' ' MET . . . . . 0.446 ' O ' HG21 ' A' ' 958' ' ' VAL . 4.0 ttm -66.38 -30.56 70.97 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.874 176.082 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 955' ' ' VAL . . . . . 0.642 HG22 ' HA ' ' A' ' 952' ' ' VAL . 69.4 t -53.53 -42.99 51.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 174.68 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.41 -36.0 80.4 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.464 175.29 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -78.46 -45.93 20.96 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 111.911 0.338 . . . . 0.0 111.911 -174.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 958' ' ' VAL . . . . . 0.685 ' O ' ' HG ' ' A' ' 962' ' ' LEU . 17.7 m -81.63 -34.7 13.15 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.663 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -60.13 -35.59 88.11 Favored Glycine 0 N--CA 1.437 -1.241 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 178.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 960' ' ' LEU . . . . . 0.524 HD11 ' HD3' ' A' ' 963' ' ' ARG . 19.5 tp -76.77 -36.57 56.94 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-O 120.697 0.284 . . . . 0.0 110.682 176.219 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -72.11 -44.21 63.54 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.097 0.475 . . . . 0.0 111.93 -173.11 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 962' ' ' LEU . . . . . 0.897 HD12 ' HG ' ' A' ' 995' ' ' LEU . 4.6 pp -87.16 -18.09 31.21 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.843 -177.853 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 963' ' ' ARG . . . . . 0.524 ' HD3' HD11 ' A' ' 960' ' ' LEU . 12.0 ptm180 -72.79 -38.01 67.38 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 118.834 -1.147 . . . . 0.0 110.119 165.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 964' ' ' THR . . . . . 0.495 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 23.9 m -65.62 -31.27 72.2 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.171 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 965' ' ' LEU . . . . . 0.686 HD23 ' HG ' ' A' ' 991' ' ' LEU . 17.7 tp -62.6 -50.16 72.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.089 171.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 966' ' ' LEU . . . . . 0.775 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 9.8 tt -64.21 -36.37 83.84 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.08 -0.963 . . . . 0.0 108.489 -174.696 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 967' ' ' ALA . . . . . 0.404 ' HA ' ' HB3' ' A' ' 970' ' ' ASP . . . -71.87 -39.19 69.8 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.925 178.496 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 968' ' ' THR . . . . . 0.488 HG21 ' HB3' ' A' ' 924' ' ' LYS . 2.2 p -61.48 -35.81 78.7 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 118.945 0.793 . . . . 0.0 110.212 174.049 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 969' ' ' VAL . . . . . 0.89 HG12 HG22 ' A' ' 984' ' ' ILE . 49.1 t -74.43 -36.61 42.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.208 174.168 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 970' ' ' ASP . . . . . 0.65 ' HB2' HE22 ' A' ' 988' ' ' GLN . 17.3 t70 -70.13 -42.04 73.14 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 122.04 0.924 . . . . 0.0 109.201 -178.629 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 971' ' ' GLU . . . . . 0.594 ' O ' HG22 ' A' ' 975' ' ' VAL . 7.9 tp10 -67.2 -31.18 71.38 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.258 -1.337 . . . . 0.0 109.904 176.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 972' ' ' SER . . . . . 0.478 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 46.9 m -68.38 -18.04 64.37 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.939 174.642 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 973' ' ' LEU . . . . . 0.887 ' HG ' ' HB2' ' A' ' 981' ' ' HIS . 10.4 tt -66.74 -51.67 38.13 Favored Pre-proline 0 CA--C 1.53 0.194 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 -177.89 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 974' ' ' PRO . . . . . 0.744 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 5.0 Cg_exo -79.61 -4.77 13.75 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 121.388 1.392 . . . . 0.0 113.004 172.322 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 975' ' ' VAL . . . . . 0.594 HG22 ' O ' ' A' ' 971' ' ' GLU . 40.1 t -75.98 -54.48 13.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.125 171.608 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 976' ' ' LEU . . . . . 0.585 HD12 HG23 ' A' ' 980' ' ' THR . 97.9 mt -94.86 122.32 60.67 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.451 -178.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 977' ' ' PRO . . . . . 0.483 ' HD3' ' HA ' ' A' ' 976' ' ' LEU . 20.0 Cg_exo -65.95 112.65 2.31 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 123.519 2.813 . . . . 0.0 114.564 -170.046 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . 67.37 -82.19 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 165.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 979' ' ' SER . . . . . 0.408 ' O ' ' HG2' ' A' ' 982' ' ' ARG . 19.7 m -59.63 -37.14 77.84 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -166.284 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 980' ' ' THR . . . . . 0.585 HG23 HD12 ' A' ' 976' ' ' LEU . 54.4 m -69.21 -24.47 64.03 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 120.299 -0.56 . . . . 0.0 111.144 179.167 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 981' ' ' HIS . . . . . 0.887 ' HB2' ' HG ' ' A' ' 973' ' ' LEU . 0.3 OUTLIER -69.0 -18.4 64.05 Favored 'General case' 0 C--O 1.218 -0.554 0 O-C-N 121.934 -0.479 . . . . 0.0 112.187 -174.653 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 982' ' ' ARG . . . . . 0.408 ' HG2' ' O ' ' A' ' 979' ' ' SER . 13.2 ptm180 -83.2 -21.65 33.39 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 119.849 -0.74 . . . . 0.0 110.87 177.557 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 983' ' ' GLU . . . . . 0.46 ' CB ' ' HB3' ' A' 1042 ' ' ALA . 3.0 mp0 -76.15 -33.51 59.38 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 165.046 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 984' ' ' ILE . . . . . 0.89 HG22 HG12 ' A' ' 969' ' ' VAL . 69.6 mt -68.36 -30.39 47.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.569 178.326 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 985' ' ' GLU . . . . . 0.632 ' HG2' ' O ' ' A' ' 981' ' ' HIS . 72.5 mm-40 -62.45 -53.16 58.88 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.269 176.054 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 20.5 ttt -69.82 -39.98 76.16 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.831 -172.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 987' ' ' ALA . . . . . 1.083 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -76.44 -53.41 8.17 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.099 -1.409 . . . . 0.0 112.624 -167.638 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 988' ' ' GLN . . . . . 0.775 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 3.2 pt20 -65.04 -21.77 66.88 Favored 'General case' 0 C--O 1.226 -0.167 0 C-N-CA 120.126 -0.629 . . . . 0.0 109.592 178.464 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 989' ' ' LYS . . . . . 0.59 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 34.0 tttp -73.3 -43.26 61.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.124 -0.944 . . . . 0.0 112.178 173.78 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 990' ' ' LEU . . . . . 0.593 ' O ' ' HB2' ' A' ' 994' ' ' ASP . 16.0 mt -52.54 -53.73 42.22 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.235 174.34 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 991' ' ' LEU . . . . . 0.687 HD12 ' HB2' ' A' ' 962' ' ' LEU . 0.4 OUTLIER -59.82 -39.54 85.41 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 175.946 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 992' ' ' ASN . . . . . 0.59 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 40.9 t-20 -52.88 -57.29 10.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.006 -0.997 . . . . 0.0 111.565 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 26.6 p -80.05 -31.24 39.5 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.211 0.448 . . . . 0.0 112.211 -178.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 994' ' ' ASP . . . . . 0.593 ' HB2' ' O ' ' A' ' 990' ' ' LEU . 0.1 OUTLIER -65.91 -42.07 90.62 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 120.272 -0.571 . . . . 0.0 110.87 178.72 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 995' ' ' LEU . . . . . 0.897 ' HG ' HD12 ' A' ' 962' ' ' LEU . 1.8 tm? -59.42 -32.86 70.57 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.486 0.715 . . . . 0.0 110.691 168.108 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -67.77 -28.34 67.53 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 118.8 -1.16 . . . . 0.0 110.28 174.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -75.26 -43.11 53.22 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 120.638 0.256 . . . . 0.0 110.337 175.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 998' ' ' LEU . . . . . 0.93 HD12 ' HB3' ' A' 1025 ' ' ALA . 8.3 tp -55.8 -47.55 76.94 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.168 0.509 . . . . 0.0 110.998 -179.059 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 999' ' ' ILE . . . . . 0.536 ' O ' ' HB2' ' A' 1003 ' ' LYS . 39.9 mm -68.12 -34.1 64.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 115.296 -0.866 . . . . 0.0 111.738 -172.099 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -63.05 -38.62 91.91 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.179 0.514 . . . . 0.0 111.618 179.095 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1001 ' ' LYS . . . . . 0.521 ' O ' ' HB3' ' A' 1017 ' ' TYR . 14.3 mptt -83.63 -36.74 23.62 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.826 0.822 . . . . 0.0 109.402 -176.121 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1002 ' ' MET . . . . . 0.441 ' HB2' ' HG2' ' A' 1021 ' ' MET . 46.3 ttm -59.87 -30.81 69.24 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 114.349 -1.296 . . . . 0.0 109.684 174.079 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1003 ' ' LYS . . . . . 0.613 ' O ' ' HG3' ' A' 1006 ' ' GLN . 4.6 tptp -74.24 -53.54 9.56 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 114.694 -1.139 . . . . 0.0 111.699 -170.595 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1004 ' ' LEU . . . . . 0.861 HD21 ' HG3' ' A' 1007 ' ' GLN . 86.4 mt -72.48 -13.69 61.49 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.461 -179.459 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1005 ' ' ALA . . . . . 0.618 ' HB3' ' HB3' ' A' 1017 ' ' TYR . . . -70.36 -42.48 71.75 Favored 'General case' 0 C--O 1.216 -0.692 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 177.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1006 ' ' GLN . . . . . 0.937 ' HB2' ' HB3' ' A' ' 949' ' ' GLU . 5.1 pp0? -75.86 -31.73 59.42 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 119.034 -0.508 . . . . 0.0 111.938 172.699 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1007 ' ' GLN . . . . . 0.861 ' HG3' HD21 ' A' 1004 ' ' LEU . 13.2 mm100 -48.36 -51.43 26.4 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.265 0.555 . . . . 0.0 110.045 175.491 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1008 ' ' TYR . . . . . 0.733 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 69.6 m-85 -120.74 45.85 2.14 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.368 173.178 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1009 ' ' VAL . . . . . 1.065 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 10.8 p -52.2 -20.54 1.91 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 CA-C-N 114.847 -1.069 . . . . 0.0 110.183 170.14 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1010 ' ' MET . . . . . 0.419 ' O ' ' HB ' ' A' 1011 ' ' THR . 24.3 mmt -38.53 -44.09 0.92 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 113.843 -1.526 . . . . 0.0 111.298 172.69 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1011 ' ' THR . . . . . 0.486 HG21 ' N ' ' A' 1012 ' ' SER . 8.1 t -178.76 -65.16 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 171.619 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1012 ' ' SER . . . . . 0.486 ' N ' HG21 ' A' 1011 ' ' THR . 6.9 m -57.65 -73.85 0.07 Allowed 'General case' 0 C--O 1.242 0.676 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -167.857 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1013 ' ' LEU . . . . . 0.733 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 7.8 mp -49.89 -37.1 29.88 Favored 'General case' 0 CA--C 1.504 -0.821 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.226 178.67 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1014 ' ' GLN . . . . . 1.065 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.88 -48.73 72.62 Favored 'General case' 0 N--CA 1.443 -0.815 0 O-C-N 123.633 0.583 . . . . 0.0 111.472 -167.088 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A 1015 ' ' GLN . . . . . 0.643 ' O ' ' HB3' ' A' 1019 ' ' LYS . 3.7 pt20 -76.27 -36.83 58.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.967 -176.102 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -74.11 -40.57 62.59 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.765 0.793 . . . . 0.0 110.836 -176.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1017 ' ' TYR . . . . . 0.618 ' HB3' ' HB3' ' A' 1005 ' ' ALA . 5.3 m-85 -78.31 -37.92 43.59 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 115.441 -0.799 . . . . 0.0 112.7 -176.706 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1018 ' ' LYS . . . . . 0.591 ' HA ' ' CB ' ' A' 1021 ' ' MET . 35.7 ttpt -81.96 -25.52 34.75 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.733 -175.425 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1019 ' ' LYS . . . . . 0.643 ' HB3' ' O ' ' A' 1015 ' ' GLN . 0.0 OUTLIER -73.33 -32.47 64.59 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 174.883 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A 1020 ' ' GLN . . . . . 0.473 ' N ' ' HD3' ' A' 1019 ' ' LYS . 49.1 mt-30 -68.32 -32.89 73.33 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.652 162.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1021 ' ' MET . . . . . 0.591 ' CB ' ' HA ' ' A' 1018 ' ' LYS . 18.2 tmm? -64.9 -53.55 44.83 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 -179.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1022 ' ' LEU . . . . . 0.514 HD13 HG22 ' A' ' 937' ' ' ILE . 0.2 OUTLIER -78.15 -11.83 59.95 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 119.248 -0.981 . . . . 0.0 109.821 -173.069 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 63.0 m -86.57 -33.95 20.06 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.761 175.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1024 ' ' ALA . . . . . 0.48 ' O ' ' HB1' ' A' 1027 ' ' ALA . . . -79.32 -23.58 43.39 Favored 'General case' 0 C--O 1.221 -0.432 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 172.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1025 ' ' ALA . . . . . 0.93 ' HB3' HD12 ' A' ' 998' ' ' LEU . . . -86.28 -24.74 25.83 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.619 170.215 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1026 ' ' HIS . . . . . 0.529 ' O ' HG22 ' A' 1030 ' ' VAL . 47.0 t60 -73.37 -28.5 62.07 Favored 'General case' 0 C--O 1.217 -0.644 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 164.287 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1027 ' ' ALA . . . . . 0.48 ' HB1' ' O ' ' A' 1024 ' ' ALA . . . -66.19 -40.9 90.76 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 123.586 0.755 . . . . 0.0 110.418 163.419 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1028 ' ' LEU . . . . . 0.746 HD13 HD23 ' A' ' 998' ' ' LEU . 25.4 mt -61.83 -43.72 98.28 Favored 'General case' 0 C--N 1.313 -0.983 0 C-N-CA 119.919 -0.712 . . . . 0.0 109.89 170.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -58.29 -40.85 83.03 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.645 0.26 . . . . 0.0 110.884 171.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1030 ' ' VAL . . . . . 0.529 HG22 ' O ' ' A' 1026 ' ' HIS . 4.7 t -67.27 -52.05 46.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 121.111 0.482 . . . . 0.0 110.742 -176.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1031 ' ' ASP . . . . . 0.613 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 1.4 m-20 -77.43 -27.85 52.36 Favored 'General case' 0 C--O 1.207 -1.144 0 CA-C-N 115.758 -0.656 . . . . 0.0 112.435 -177.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1032 ' ' ALA . . . . . 0.6 ' O ' HD12 ' A' 1036 ' ' LEU . . . -66.76 -32.7 74.16 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 121.769 -0.582 . . . . 0.0 109.438 169.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1033 ' ' LYS . . . . . 0.403 ' HB3' ' O ' ' A' 1030 ' ' VAL . 87.7 tttt -68.51 -39.66 81.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.894 0.854 . . . . 0.0 109.523 170.216 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1034 ' ' ASN . . . . . 0.613 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 36.6 t30 -71.21 -52.69 17.65 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 114.787 -1.097 . . . . 0.0 111.444 -177.267 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1035 ' ' LEU . . . . . 1.083 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 3.7 pp -64.14 -42.2 96.88 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 118.911 -0.566 . . . . 0.0 111.671 -171.29 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1036 ' ' LEU . . . . . 0.687 HD13 ' H ' ' A' 1037 ' ' ASP . 0.0 OUTLIER -71.76 -33.05 68.32 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 116.416 -2.114 . . . . 0.0 109.056 -178.573 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A 1037 ' ' ASP . . . . . 0.687 ' H ' HD13 ' A' 1036 ' ' LEU . 22.0 t70 -57.28 -44.93 84.46 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.073 171.034 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1038 ' ' VAL . . . . . 0.495 HG22 ' O ' ' A' 1034 ' ' ASN . 37.4 t -56.15 -38.29 53.32 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.61 0 CA-C-N 114.193 -1.367 . . . . 0.0 111.812 175.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1039 ' ' ILE . . . . . 0.647 HD12 ' HA ' ' A' ' 984' ' ' ILE . 1.6 mp -80.61 -32.39 13.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 118.451 0.569 . . . . 0.0 111.814 175.332 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1040 ' ' ASP . . . . . 0.612 ' HB3' ' HA ' ' A' ' 919' ' ' ILE . 0.3 OUTLIER -62.19 -38.57 89.59 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.55 0.691 . . . . 0.0 109.859 170.526 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -76.11 -33.13 59.46 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.779 173.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1042 ' ' ALA . . . . . 0.57 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -55.89 -55.46 32.36 Favored 'General case' 0 CA--C 1.501 -0.94 0 C-N-CA 123.101 0.56 . . . . 0.0 111.984 178.249 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1043 ' ' ARG . . . . . 0.706 ' HD3' ' N ' ' A' 1044 ' ' LEU . 0.0 OUTLIER -65.03 -34.61 78.84 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 -176.877 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A 1044 ' ' LEU . . . . . 0.91 HD23 ' HA2' ' A' ' 918' ' ' GLY . 30.8 tp -66.07 -58.47 5.41 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 115.05 -0.977 . . . . 0.0 109.054 177.888 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1045 ' ' LYS . . . . . 0.538 ' HA ' ' OG ' ' A' 1048 ' ' SER . 16.6 ttpt -52.21 -42.72 63.78 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.648 1.179 . . . . 0.0 112.562 -178.727 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1046 ' ' MET . . . . . 0.544 ' HG2' ' O ' ' A' 1042 ' ' ALA . 8.6 ptm -67.59 -20.51 65.38 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 119.132 -1.027 . . . . 0.0 111.883 179.148 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 41.3 mm -95.84 -32.06 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-O 120.837 0.351 . . . . 0.0 111.228 174.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1048 ' ' SER . . . . . 0.538 ' OG ' ' HA ' ' A' 1045 ' ' LYS . 78.3 p -83.87 -29.45 27.23 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -173.515 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1049 ' ' GLN . . . . . 0.488 ' HA ' ' OE1' ' A' 1049 ' ' GLN . 9.6 mm-40 -59.54 131.27 50.44 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 120.92 0.39 . . . . 0.0 110.664 179.462 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 35.7 p -78.92 -6.18 55.56 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.438 -175.131 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1051 ' ' ARG . . . . . 0.926 ' HB3' ' HD3' ' A' 1052 ' ' PRO . 52.8 ttp180 -154.75 -75.81 0.01 OUTLIER Pre-proline 0 CA--C 1.54 0.558 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 176.848 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1052 ' ' PRO . . . . . 0.926 ' HD3' ' HB3' ' A' 1051 ' ' ARG . 73.9 Cg_endo -98.17 115.8 0.11 Allowed 'Trans proline' 0 N--CA 1.452 -0.953 0 C-N-CA 121.921 1.747 . . . . 0.0 114.628 -166.36 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 1053 ' ' HIS . . . . . 0.511 ' HD2' ' HB3' ' A' 1046 ' ' MET . 26.1 t60 . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.542 170.351 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.791 ' HB2' HG21 ' A' ' 968' ' ' THR . 33.4 mmtp . . . . . 0 C--O 1.226 -0.153 0 N-CA-C 111.711 0.263 . . . . 0.0 111.711 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.607 ' O ' HG23 ' A' ' 929' ' ' VAL . 16.6 m -55.38 -31.84 28.15 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.396 0 CA-C-O 121.02 0.438 . . . . 0.0 110.528 175.858 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 926' ' ' TYR . . . . . 0.456 ' CB ' HD11 ' A' 1036 ' ' LEU . 0.0 OUTLIER -77.79 -32.76 52.6 Favored 'General case' 0 CA--C 1.501 -0.938 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.585 177.175 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -77.53 -23.94 50.04 Favored 'General case' 0 C--N 1.3 -1.558 0 C-N-CA 118.261 -1.376 . . . . 0.0 112.397 178.204 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.516 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 2.7 m120 -72.44 -30.19 64.37 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 121.863 0.839 . . . . 0.0 108.848 171.827 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.651 ' HA ' HD23 ' A' ' 932' ' ' LEU . 90.2 t -79.51 -28.45 13.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 114.666 -1.152 . . . . 0.0 110.362 176.928 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.602 ' O ' ' HD2' ' A' ' 934' ' ' LYS . 53.2 m -57.47 -49.26 76.84 Favored 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 119.561 -0.856 . . . . 0.0 108.786 170.162 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -64.11 -51.4 53.33 Favored Glycine 0 CA--C 1.525 0.707 0 CA-C-N 115.355 -0.838 . . . . 0.0 113.459 177.544 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.651 HD23 ' HA ' ' A' ' 929' ' ' VAL . 0.3 OUTLIER -61.91 -49.02 77.85 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 112.751 0.648 . . . . 0.0 112.751 -175.882 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.47 HG23 HG13 ' A' ' 929' ' ' VAL . 53.0 t -70.17 -38.27 74.26 Favored 'Isoleucine or valine' 0 C--O 1.24 0.576 0 CA-C-O 120.947 0.403 . . . . 0.0 111.446 -174.162 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.602 ' HD2' ' O ' ' A' ' 930' ' ' THR . 0.2 OUTLIER -58.92 -37.15 76.01 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.492 179.208 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 0.491 ' HA ' ' SD ' ' A' ' 939' ' ' MET . . . -64.03 -42.01 97.22 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.607 -0.269 . . . . 0.0 111.066 177.483 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.77 HG22 ' HB1' ' A' 1025 ' ' ALA . 99.3 t -47.55 -69.79 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.065 -178.148 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 26.7 pt -71.95 -39.76 67.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 N-CA-C 112.489 0.551 . . . . 0.0 112.489 -176.339 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -72.52 -52.19 16.76 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 119.722 -0.791 . . . . 0.0 111.37 -173.039 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.491 ' SD ' ' HA ' ' A' ' 935' ' ' ALA . 1.0 OUTLIER -68.59 -24.78 64.63 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.252 -0.579 . . . . 0.0 109.57 -179.065 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.743 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 8.7 p . . . . . 0 C--O 1.224 -0.289 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.206 -179.079 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.989 ' HB3' ' HG2' ' A' 1002 ' ' MET . 22.4 m-85 . . . . . 0 CA--C 1.538 0.517 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 0.604 ' O ' ' HB ' ' A' ' 955' ' ' VAL . 45.8 t -50.57 -43.13 79.9 Favored Pre-proline 0 C--N 1.322 -0.63 0 C-N-CA 122.861 0.464 . . . . 0.0 111.703 173.43 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 0.634 ' O ' ' HB3' ' A' ' 956' ' ' LYS . 24.3 Cg_exo -49.31 -43.05 39.14 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 122.022 1.815 . . . . 0.0 112.831 172.162 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.421 ' O ' HG12 ' A' ' 958' ' ' VAL . 21.2 ttt -76.26 -31.09 58.11 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.566 176.287 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.604 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 78.9 t -52.96 -35.77 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 167.741 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.634 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 11.1 tmtt? -66.58 -36.43 82.61 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.119 172.776 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -76.93 -47.0 22.24 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.908 0.385 . . . . 0.0 111.554 -174.546 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.619 HG22 HD23 ' A' ' 962' ' ' LEU . 14.1 p -85.4 -33.51 7.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.063 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -60.44 -43.11 99.09 Favored Glycine 0 N--CA 1.447 -0.59 0 N-CA-C 110.8 -0.92 . . . . 0.0 110.8 176.063 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 960' ' ' LEU . . . . . 0.419 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 14.7 tp -63.57 -36.76 84.87 Favored 'General case' 0 C--O 1.22 -0.468 0 C-N-CA 122.235 0.214 . . . . 0.0 110.716 176.385 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -75.72 -38.12 58.83 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.266 0.555 . . . . 0.0 111.046 -174.454 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.881 HD21 HD13 ' A' ' 995' ' ' LEU . 4.3 pp -87.37 -20.26 26.96 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.613 -178.203 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.419 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 15.3 ptm180 -77.01 -35.93 56.67 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 119.574 -0.85 . . . . 0.0 110.668 165.71 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 85.8 m -61.5 -36.02 79.34 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 173.747 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.516 ' HA ' ' OD1' ' A' ' 928' ' ' ASN . 18.5 tp -61.77 -47.85 83.34 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.293 -1.321 . . . . 0.0 110.207 173.675 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 0.768 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.4 tt -66.04 -37.85 86.89 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.191 -173.931 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -71.91 -31.15 66.1 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.901 178.574 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.791 HG21 ' HB2' ' A' ' 924' ' ' LYS . 23.5 m -71.22 -36.91 72.03 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 119.668 -0.813 . . . . 0.0 109.553 173.371 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.843 HG12 HG23 ' A' ' 984' ' ' ILE . 61.7 t -68.47 -39.78 81.19 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.338 172.458 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.51 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 10.3 t70 -67.23 -40.23 86.34 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.85 0.833 . . . . 0.0 108.758 -178.912 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.655 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 8.1 tp10 -68.28 -29.47 68.26 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 114.561 -1.2 . . . . 0.0 109.726 177.776 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.686 ' HA ' HG22 ' A' ' 975' ' ' VAL . 70.8 m -69.52 -17.91 63.62 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.879 175.65 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.899 ' HB2' HG21 ' A' ' 984' ' ' ILE . 10.5 tt -68.81 -52.78 16.81 Favored Pre-proline 0 N--CA 1.449 -0.493 0 C-N-CA 120.973 -0.291 . . . . 0.0 110.324 -177.675 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.655 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 90.4 Cg_endo -90.91 0.75 4.94 Favored 'Trans proline' 0 C--N 1.357 0.991 0 C-N-CA 121.357 1.371 . . . . 0.0 114.72 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.686 HG22 ' HA ' ' A' ' 972' ' ' SER . 27.4 m . . . . . 0 N--CA 1.454 -0.269 0 O-C-N 121.427 -0.795 . . . . 0.0 111.298 172.873 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.818 HG23 ' HB1' ' A' 1042 ' ' ALA . 25.8 m . . . . . 0 CA--C 1.536 0.42 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.518 ' O ' ' HG2' ' A' ' 985' ' ' GLU . 12.2 m170 -50.56 -40.54 52.39 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -177.865 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 982' ' ' ARG . . . . . 0.467 ' HA ' ' CG ' ' A' ' 985' ' ' GLU . 11.1 ptt180 -83.52 -18.75 37.37 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 -171.227 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.454 ' HG3' HG13 ' A' 1038 ' ' VAL . 0.4 OUTLIER -74.3 -34.6 63.57 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 171.7 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.899 HG21 ' HB2' ' A' ' 973' ' ' LEU . 1.8 mp -70.99 -32.75 49.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 176.058 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 985' ' ' GLU . . . . . 0.518 ' HG2' ' O ' ' A' ' 981' ' ' HIS . 64.5 mm-40 -57.6 -54.19 49.63 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.325 174.76 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 48.0 ttm -68.47 -45.59 72.03 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.246 -172.159 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.681 ' HB1' ' HB3' ' A' 1035 ' ' LEU . . . -68.69 -52.2 33.54 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.299 -0.864 . . . . 0.0 112.737 -171.834 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.768 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 25.5 pt20 -65.13 -26.98 68.42 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 119.759 -0.776 . . . . 0.0 111.446 -177.156 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 989' ' ' LYS . . . . . 0.821 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 54.9 mtpt -75.15 -42.31 56.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.282 0.563 . . . . 0.0 111.697 175.479 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.546 HD23 HD11 ' A' 1035 ' ' LEU . 39.3 tp -54.0 -58.19 8.25 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -178.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.881 HD11 ' HA ' ' A' 1028 ' ' LEU . 11.4 tp -68.3 -23.12 64.7 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 120.336 -0.545 . . . . 0.0 110.169 179.496 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 992' ' ' ASN . . . . . 0.821 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 25.2 t-20 -51.77 -54.13 32.05 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.82 174.832 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 6.8 p -76.49 -26.1 54.95 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.355 177.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -64.19 -52.46 58.79 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.323 0.582 . . . . 0.0 110.198 177.173 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 0.881 HD13 HD21 ' A' ' 962' ' ' LEU . 0.3 OUTLIER -51.95 -28.36 16.34 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.704 168.598 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -70.29 -35.77 73.93 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 118.789 -1.164 . . . . 0.0 111.291 176.416 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.546 ' O ' ' HD3' ' A' 1001 ' ' LYS . 3.9 pt-20 -78.06 -29.51 49.25 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 121.134 -0.979 . . . . 0.0 110.912 175.863 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.842 HD22 HD11 ' A' 1028 ' ' LEU . 0.1 OUTLIER -56.15 -47.08 78.91 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 121.296 0.569 . . . . 0.0 110.062 178.513 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.502 ' O ' ' HB2' ' A' 1003 ' ' LYS . 75.2 mt -70.66 -32.99 51.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 114.927 -1.033 . . . . 0.0 111.522 -174.552 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -65.46 -41.29 93.55 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.995 0.426 . . . . 0.0 111.879 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.546 ' HD3' ' O ' ' A' ' 997' ' ' GLU . 0.6 OUTLIER -78.39 -34.56 48.09 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 122.332 1.063 . . . . 0.0 108.742 -178.964 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.989 ' HG2' ' HB3' ' A' ' 951' ' ' TYR . 12.5 ttt -62.57 -27.74 69.39 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 113.977 -1.465 . . . . 0.0 109.046 176.256 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.502 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 2.6 tptp -74.84 -53.05 9.81 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 113.753 -1.567 . . . . 0.0 110.623 -167.869 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.561 ' HA ' ' HG2' ' A' 1007 ' ' GLN . 7.4 mp -75.15 -12.32 60.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.87 -179.024 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.754 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -70.28 -50.03 43.67 Favored 'General case' 0 C--O 1.216 -0.698 0 C-N-CA 119.364 -0.934 . . . . 0.0 109.747 177.316 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.927 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.3 pp0? -71.71 -30.64 65.87 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 174.852 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.561 ' HG2' ' HA ' ' A' 1004 ' ' LEU . 4.7 pt20 -57.87 -48.15 80.65 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 119.989 -0.684 . . . . 0.0 109.703 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.663 ' HB2' HD12 ' A' 1013 ' ' LEU . 14.0 m-30 -115.22 42.01 2.32 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 173.564 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1009 ' ' VAL . . . . . 1.033 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 12.4 p -54.0 -24.56 11.14 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.301 0 CA-C-O 122.319 1.057 . . . . 0.0 109.743 173.259 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 49.3 mtt -55.96 -20.72 17.39 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 113.687 -1.597 . . . . 0.0 111.529 174.294 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1011 ' ' THR . . . . . 0.542 ' HB ' ' H ' ' A' 1012 ' ' SER . 16.9 p -142.87 -153.08 0.44 Allowed 'General case' 0 C--O 1.262 1.713 0 CA-C-O 123.596 1.665 . . . . 0.0 115.276 -172.068 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1012 ' ' SER . . . . . 0.542 ' H ' ' HB ' ' A' 1011 ' ' THR . 26.2 p -55.04 -37.99 67.4 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 113.048 -1.887 . . . . 0.0 112.743 -173.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1013 ' ' LEU . . . . . 0.74 ' O ' ' HB2' ' A' 1017 ' ' TYR . 6.6 mt -52.9 -40.32 63.44 Favored 'General case' 0 CA--C 1.494 -1.185 0 C-N-CA 120.196 -0.602 . . . . 0.0 110.507 178.14 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1014 ' ' GLN . . . . . 1.033 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 1.3 tt0 -54.09 -53.7 49.56 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-O 121.699 0.761 . . . . 0.0 109.398 -173.952 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1015 ' ' GLN . . . . . 0.508 ' O ' ' HD3' ' A' 1019 ' ' LYS . 0.9 OUTLIER -72.61 -41.14 65.89 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 114.587 -1.188 . . . . 0.0 112.231 -177.273 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -70.64 -55.47 8.69 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 122.818 0.447 . . . . 0.0 112.041 -178.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.754 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 7.3 m-85 -62.11 -33.33 74.25 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -177.205 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.631 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 54.3 tptt -78.93 -27.8 43.74 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.492 -177.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1019 ' ' LYS . . . . . 0.508 ' HD3' ' O ' ' A' 1015 ' ' GLN . 4.3 mptp? -71.68 -50.23 32.33 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 172.183 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1020 ' ' GLN . . . . . 0.409 ' HB3' ' HG2' ' A' 1001 ' ' LYS . 51.3 mt-30 -52.23 -31.41 32.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.83 165.241 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.568 ' HG3' ' CB ' ' A' 1002 ' ' MET . 2.3 ttp -67.81 -49.23 63.45 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 178.252 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1022 ' ' LEU . . . . . 0.769 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -81.92 -8.58 59.69 Favored 'General case' 0 C--O 1.218 -0.586 0 C-N-CA 118.987 -1.085 . . . . 0.0 109.41 -177.16 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 52.4 m -76.8 -45.74 27.64 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.718 171.242 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.56 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -74.85 -21.46 59.25 Favored 'General case' 0 C--O 1.213 -0.845 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 173.459 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.77 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -84.56 -25.94 28.34 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.223 172.428 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.466 ' O ' HG23 ' A' 1030 ' ' VAL . 42.4 t-80 -78.32 -22.71 47.69 Favored 'General case' 0 C--O 1.214 -0.793 0 O-C-N 121.845 -0.534 . . . . 0.0 109.641 167.257 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -69.84 -42.55 73.45 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 123.421 0.688 . . . . 0.0 109.82 162.372 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.881 ' HA ' HD11 ' A' ' 991' ' ' LEU . 49.7 mt -56.12 -50.05 72.17 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 168.871 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1029 ' ' ALA . . . . . 0.441 ' HA ' HG22 ' A' ' 933' ' ' VAL . . . -59.6 -43.48 93.7 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 175.877 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' 1026 ' ' HIS . 3.7 t -66.98 -50.82 60.92 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.305 0 CA-C-O 121.019 0.438 . . . . 0.0 110.564 -176.407 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.617 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 4.0 m-20 -76.36 -29.1 57.06 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.83 -178.576 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.531 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -67.22 -27.43 67.23 Favored 'General case' 0 C--N 1.321 -0.645 0 O-C-N 121.426 -0.796 . . . . 0.0 109.749 172.344 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.457 ' C ' ' HD3' ' A' 1033 ' ' LYS . 12.7 tmtt? -70.36 -51.86 26.76 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 167.735 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.617 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 36.1 t30 -63.37 -56.66 14.55 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 114.838 -1.074 . . . . 0.0 112.569 -174.669 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.681 ' HB3' ' HB1' ' A' ' 987' ' ' ALA . 0.2 OUTLIER -60.24 -35.85 76.41 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.775 -0.193 . . . . 0.0 110.578 -179.865 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.538 ' C ' HD23 ' A' 1036 ' ' LEU . 0.8 OUTLIER -67.57 -47.27 70.27 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 118.987 -1.085 . . . . 0.0 108.712 179.122 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.5 ' O ' ' HB2' ' A' 1041 ' ' GLN . 13.4 t70 -51.32 -28.35 11.99 Favored 'General case' 0 C--O 1.215 -0.729 0 CA-C-N 113.873 -1.512 . . . . 0.0 109.977 172.258 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.557 ' HB ' ' O ' ' A' 1035 ' ' LEU . 30.1 t -75.19 -29.95 22.36 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.536 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.778 178.404 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.545 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 1.8 mp -85.78 -34.75 8.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 CA-C-N 118.221 0.464 . . . . 0.0 111.577 172.094 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.65 -42.86 93.75 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 167.221 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1041 ' ' GLN . . . . . 0.5 ' HB2' ' O ' ' A' 1037 ' ' ASP . 1.7 mt-30 -58.53 -54.09 51.02 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.894 168.566 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.818 ' HB1' HG23 ' A' ' 980' ' ' THR . . . -53.19 -47.12 69.14 Favored 'General case' 0 CA--C 1.499 -1.017 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.735 -170.501 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.466 ' HG2' ' O ' ' A' 1039 ' ' ILE . 13.8 ptp180 -67.56 -46.69 71.96 Favored 'General case' 0 N--CA 1.432 -1.364 0 C-N-CA 119.91 -0.716 . . . . 0.0 110.668 -172.478 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 36.5 mt . . . . . 0 CA--C 1.531 0.231 0 C-N-CA 120.233 -0.587 . . . . 0.0 112.069 -178.646 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.704 ' HG3' HG21 ' A' ' 968' ' ' THR . 17.9 tppt? . . . . . 0 CA--C 1.535 0.385 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.62 ' O ' HG23 ' A' ' 929' ' ' VAL . 12.3 t -65.7 -28.22 43.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.191 0.52 . . . . 0.0 110.691 177.374 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -75.94 -26.42 56.87 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.398 0.679 . . . . 0.0 111.66 -177.514 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 927' ' ' GLU . . . . . 0.515 ' O ' HG22 ' A' ' 930' ' ' THR . 7.8 pt-20 -76.74 -24.13 53.01 Favored 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 118.743 -1.183 . . . . 0.0 109.853 172.65 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.47 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 1.7 m120 -71.33 -30.72 66.54 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 170.304 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.62 HG23 ' O ' ' A' ' 925' ' ' VAL . 68.6 t -80.88 -30.53 11.88 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-N 114.811 -1.086 . . . . 0.0 111.68 177.742 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.515 HG22 ' O ' ' A' ' 927' ' ' GLU . 3.6 t -66.29 -30.8 71.3 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 120.222 1.374 . . . . 0.0 107.759 170.733 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -72.53 -52.73 9.6 Favored Glycine 0 CA--C 1.526 0.727 0 CA-C-N 115.35 -0.841 . . . . 0.0 113.239 175.655 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.547 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.1 pp -66.99 -49.35 65.64 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -177.372 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.576 HG22 ' HA ' ' A' 1029 ' ' ALA . 79.0 t -68.42 -37.18 77.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-O 121.038 0.446 . . . . 0.0 111.151 -174.267 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.43 ' O ' ' HB2' ' A' ' 938' ' ' GLU . 30.2 ttpt -58.26 -46.31 86.24 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.159 179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -56.17 -36.68 68.61 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.671 176.442 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.792 HG22 ' HB1' ' A' 1025 ' ' ALA . 85.0 t -52.85 -75.45 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-O 121.12 0.486 . . . . 0.0 112.086 -178.775 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 30.7 pt -68.01 -41.68 84.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.328 -176.168 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.43 ' HB2' ' O ' ' A' ' 934' ' ' LYS . 9.2 mm-40 -64.49 -49.63 70.6 Favored 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.908 -174.201 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 25.0 mmt -74.53 -24.94 59.03 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.336 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.59 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 24.8 p . . . . . 0 N--CA 1.465 0.291 0 CA-C-O 121.384 0.611 . . . . 0.0 111.078 -174.094 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.787 ' HB3' ' HB2' ' A' 1002 ' ' MET . 35.3 m-85 . . . . . 0 C--O 1.21 -0.974 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 0.657 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.1 OUTLIER -63.07 -52.88 59.55 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.859 174.097 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 0.657 ' HD3' HG13 ' A' ' 952' ' ' VAL . 0.5 OUTLIER -46.26 -43.68 20.93 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 121.936 1.757 . . . . 0.0 113.309 161.322 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.734 ' HB3' ' HA ' ' A' ' 951' ' ' TYR . 27.3 tpp -60.83 -33.49 73.12 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.794 0.33 . . . . 0.0 110.859 176.261 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.628 HG23 ' HA ' ' A' ' 952' ' ' VAL . 60.0 t -51.84 -40.1 26.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.249 -0.432 . . . . 0.0 109.946 172.6 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.599 ' HD3' ' HA ' ' A' ' 953' ' ' PRO . 3.2 mptp? -66.59 -36.73 83.33 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.735 0.302 . . . . 0.0 110.862 175.688 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -79.85 -45.45 18.66 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.186 -0.461 . . . . 0.0 112.125 -172.284 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.428 HG12 ' O ' ' A' ' 954' ' ' MET . 11.8 p -84.26 -26.34 7.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -65.02 -30.77 78.86 Favored Glycine 0 N--CA 1.442 -0.944 0 N-CA-C 110.03 -1.228 . . . . 0.0 110.03 169.575 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 960' ' ' LEU . . . . . 0.614 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 19.5 tp -71.08 -38.59 72.43 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.305 -0.448 . . . . 0.0 110.097 176.029 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.535 ' HB1' ' HB3' ' A' ' 932' ' ' LEU . . . -72.46 -39.7 67.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.905 0.383 . . . . 0.0 111.109 -174.924 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.454 HD22 HD22 ' A' ' 995' ' ' LEU . 0.0 OUTLIER -70.18 -40.53 74.61 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-O 119.095 -0.478 . . . . 0.0 110.873 173.346 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.614 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 4.6 ptp180 -67.03 -31.38 71.86 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 118.735 -1.186 . . . . 0.0 110.306 178.391 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 964' ' ' THR . . . . . 0.496 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 40.5 m -68.62 -40.96 80.13 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.127 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.624 HD22 HD11 ' A' ' 991' ' ' LEU . 0.1 OUTLIER -63.76 -39.58 94.63 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 114.062 -1.426 . . . . 0.0 110.92 175.535 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 0.618 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.2 tt -76.17 -35.08 59.32 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 -172.716 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 967' ' ' ALA . . . . . 0.413 ' O ' ' HB2' ' A' ' 971' ' ' GLU . . . -72.08 -31.07 65.74 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.393 178.557 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.704 HG21 ' HG3' ' A' ' 924' ' ' LYS . 13.6 p -70.6 -41.58 72.12 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 118.347 0.521 . . . . 0.0 110.301 174.987 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 1.026 HG12 HG23 ' A' ' 984' ' ' ILE . 61.2 t -68.52 -38.19 78.82 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.991 172.494 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.58 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 16.5 t70 -68.06 -39.54 82.97 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.965 0.888 . . . . 0.0 108.88 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.625 ' O ' HG23 ' A' ' 975' ' ' VAL . 37.5 tt0 -65.74 -32.92 74.73 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.272 -1.331 . . . . 0.0 109.672 177.685 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.444 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 71.9 m -66.97 -17.81 65.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.979 175.377 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.752 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 8.5 tt -68.57 -52.39 19.64 Favored Pre-proline 0 CA--C 1.534 0.33 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 -178.314 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.752 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 5.7 Cg_exo -81.89 0.62 9.74 Favored 'Trans proline' 0 C--N 1.354 0.857 0 C-N-CA 121.478 1.452 . . . . 0.0 112.908 173.033 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.625 HG23 ' O ' ' A' ' 971' ' ' GLU . 17.5 t . . . . . 0 C--N 1.329 -0.291 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 170.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 980' ' ' THR . . . . . . . . . . . . . 1.9 m . . . . . 0 N--CA 1.473 0.703 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.712 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 19.2 p80 -50.2 -32.04 15.38 Favored 'General case' 0 C--O 1.214 -0.782 0 C-N-CA 121.135 -0.226 . . . . 0.0 111.54 174.39 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -82.81 -20.51 35.58 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 121.147 -0.221 . . . . 0.0 111.069 -173.683 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 983' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.01 -34.47 57.41 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 169.696 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 1.026 HG23 HG12 ' A' ' 969' ' ' VAL . 69.0 mt -70.05 -32.82 52.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 114.913 -1.039 . . . . 0.0 109.441 177.339 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 985' ' ' GLU . . . . . 0.712 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 42.0 mt-10 -66.01 -51.62 56.68 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.312 177.477 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 18.2 mmt -71.58 -41.73 68.64 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.909 -172.88 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.999 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -75.56 -51.54 12.67 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.357 -0.838 . . . . 0.0 113.25 -171.685 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.71 ' O ' ' HB2' ' A' ' 992' ' ' ASN . 18.2 pt20 -62.42 -28.35 69.73 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 119.649 -0.82 . . . . 0.0 109.703 179.046 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 989' ' ' LYS . . . . . 0.71 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 21.0 tttm -69.48 -40.82 76.84 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.323 -0.853 . . . . 0.0 112.204 170.639 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.451 ' HB3' ' O ' ' A' ' 987' ' ' ALA . 17.2 tp -50.5 -60.36 3.09 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.47 -0.786 . . . . 0.0 113.032 -176.438 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.734 HD22 HD13 ' A' 1035 ' ' LEU . 1.5 pt? -76.55 -20.42 56.88 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-O 121.508 0.671 . . . . 0.0 109.826 -178.305 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 992' ' ' ASN . . . . . 0.71 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 50.3 t-20 -50.9 -53.97 28.07 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 114.424 -1.262 . . . . 0.0 110.876 175.896 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 3.7 m -73.75 -34.75 64.86 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 120.792 -0.363 . . . . 0.0 111.741 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 994' ' ' ASP . . . . . 0.412 ' O ' ' HB2' ' A' ' 997' ' ' GLU . 0.3 OUTLIER -66.91 -32.93 74.51 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 119.829 -0.748 . . . . 0.0 111.904 178.272 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 0.622 ' N ' HD21 ' A' 1028 ' ' LEU . 3.3 tt -69.6 -20.89 63.62 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 122.222 0.209 . . . . 0.0 110.697 170.746 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -75.76 -26.33 57.31 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 119.671 -0.811 . . . . 0.0 109.665 170.349 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.606 ' O ' ' HG2' ' A' 1001 ' ' LYS . 56.0 mm-40 -71.33 -46.23 61.09 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 171.43 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.76 HD22 HD11 ' A' 1028 ' ' LEU . 0.0 OUTLIER -55.38 -45.76 76.57 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.713 -177.404 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.585 ' HA ' ' HG2' ' A' 1002 ' ' MET . 85.6 mt -65.08 -37.74 80.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.356 -175.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 26.6 m-80 -61.33 -40.32 93.8 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.176 0.512 . . . . 0.0 111.457 177.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.606 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 51.1 mmtt -76.38 -45.23 32.76 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.942 0.877 . . . . 0.0 108.998 -171.831 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.787 ' HB2' ' HB3' ' A' ' 951' ' ' TYR . 14.5 ptp -62.25 -30.5 71.16 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.88 -1.054 . . . . 0.0 109.026 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.564 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 6.0 tptm -64.55 -53.02 54.41 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.35 -167.376 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.724 ' HB3' HD13 ' A' 1013 ' ' LEU . 7.2 mp -75.34 -13.82 60.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.876 -178.625 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.654 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -67.95 -43.7 78.48 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.099 -178.761 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.938 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 5.4 pp0? -77.13 -23.82 51.71 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.349 -0.541 . . . . 0.0 111.485 174.373 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1007 ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -52.89 -47.72 67.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.361 0.601 . . . . 0.0 110.638 174.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.639 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 74.6 m-85 -121.5 38.72 4.02 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.988 174.519 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1009 ' ' VAL . . . . . 1.06 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 11.9 p -48.61 -23.07 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.665 173.384 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 1.4 mpt? -37.38 -49.92 1.02 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.108 0.88 . . . . 0.0 111.328 173.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1011 ' ' THR . . . . . . . . . . . . . 71.4 m -163.56 -77.95 0.04 OUTLIER 'General case' 0 C--O 1.243 0.744 0 CA-C-O 121.125 0.488 . . . . 0.0 111.92 175.336 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1012 ' ' SER . . . . . 0.474 ' O ' ' HG2' ' A' 1015 ' ' GLN . 6.3 m -50.55 -76.43 0.02 OUTLIER 'General case' 0 C--O 1.241 0.624 0 CA-C-N 115.278 -0.874 . . . . 0.0 113.297 -166.67 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1013 ' ' LEU . . . . . 0.724 HD13 ' HB3' ' A' 1004 ' ' LEU . 2.8 mt -46.91 -42.57 17.84 Favored 'General case' 0 CA--C 1.501 -0.917 0 N-CA-C 113.569 0.951 . . . . 0.0 113.569 -178.553 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1014 ' ' GLN . . . . . 1.06 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.7 OUTLIER -55.68 -43.85 76.78 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.905 -166.907 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A 1015 ' ' GLN . . . . . 0.474 ' HG2' ' O ' ' A' 1012 ' ' SER . 24.3 pt20 -75.73 -40.79 54.99 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.814 -175.226 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -69.97 -53.63 16.93 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.487 0.66 . . . . 0.0 110.54 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.682 ' CE2' HD22 ' A' 1013 ' ' LEU . 7.8 m-85 -63.86 -35.77 81.73 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.865 -1.061 . . . . 0.0 113.263 -173.868 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.722 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 21.4 tptm -80.63 -28.0 37.08 Favored 'General case' 0 N--CA 1.458 -0.066 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.292 -177.424 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1019 ' ' LYS . . . . . 0.416 ' O ' HD23 ' A' 1022 ' ' LEU . 11.9 mptt -73.38 -51.55 16.95 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 175.585 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -50.79 -34.99 29.7 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.265 163.5 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.622 ' HG3' ' HB3' ' A' 1002 ' ' MET . 1.7 tmt? -65.34 -50.72 64.53 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 110.28 -0.266 . . . . 0.0 110.28 175.551 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1022 ' ' LEU . . . . . 0.739 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -77.5 -6.58 54.09 Favored 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 119.328 -0.949 . . . . 0.0 109.788 -175.712 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 86.5 m -80.05 -44.44 20.08 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 173.316 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.49 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.29 -20.76 50.9 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-O 121.309 0.576 . . . . 0.0 109.543 175.281 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.792 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -84.17 -25.19 29.76 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.17 170.454 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.58 ' O ' HG23 ' A' 1030 ' ' VAL . 16.1 t-80 -76.05 -26.47 56.6 Favored 'General case' 0 C--O 1.215 -0.737 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 165.621 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1027 ' ' ALA . . . . . 0.476 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -66.03 -43.34 87.84 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 122.962 0.505 . . . . 0.0 110.297 162.274 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.76 HD11 HD22 ' A' ' 998' ' ' LEU . 17.0 mt -59.37 -46.1 89.6 Favored 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 120.399 -0.52 . . . . 0.0 109.615 171.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1029 ' ' ALA . . . . . 0.627 ' O ' ' HB2' ' A' 1033 ' ' LYS . . . -57.45 -40.18 77.89 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.128 173.415 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.58 HG23 ' O ' ' A' 1026 ' ' HIS . 12.2 t -69.77 -51.45 40.71 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 CA-C-O 121.407 0.622 . . . . 0.0 110.644 -177.658 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.436 ' O ' ' HB3' ' A' 1035 ' ' LEU . 71.4 m-20 -75.11 -30.82 60.97 Favored 'General case' 0 C--O 1.221 -0.444 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.535 -173.297 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.818 ' HA ' HD22 ' A' 1035 ' ' LEU . . . -72.99 -35.46 66.87 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.841 0.353 . . . . 0.0 110.129 173.814 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.627 ' HB2' ' O ' ' A' 1029 ' ' ALA . 53.2 tttt -63.68 -46.24 86.44 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.944 0.878 . . . . 0.0 108.988 172.484 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.429 ' O ' HG23 ' A' 1038 ' ' VAL . 12.6 t30 -68.93 -51.84 35.58 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 113.996 -1.456 . . . . 0.0 112.485 -177.935 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.999 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 0.2 OUTLIER -59.24 -40.85 87.23 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 117.782 0.265 . . . . 0.0 111.139 -171.713 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.506 ' HG ' ' HB ' ' A' ' 925' ' ' VAL . 1.5 tm? -68.13 -47.56 67.79 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 118.574 -1.251 . . . . 0.0 109.289 -178.04 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 14.8 t70 -47.16 -45.92 23.1 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.363 171.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.47 ' HB ' ' O ' ' A' 1035 ' ' LEU . 22.4 t -56.18 -42.52 73.41 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.633 0 CA-C-N 113.912 -1.495 . . . . 0.0 112.818 177.575 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.587 HG12 HG12 ' A' ' 984' ' ' ILE . 1.6 mp -81.26 -31.77 11.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 119.304 0.956 . . . . 0.0 111.288 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.416 ' O ' ' HG3' ' A' 1043 ' ' ARG . 3.0 m-20 -59.38 -41.25 88.92 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 167.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -71.94 -37.57 69.97 Favored 'General case' 0 C--O 1.215 -0.737 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.578 173.567 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.533 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -53.29 -55.56 23.63 Favored 'General case' 0 CA--C 1.499 -0.988 0 C-N-CA 123.468 0.707 . . . . 0.0 111.566 -179.241 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.441 HH11 ' HD2' ' A' 1043 ' ' ARG . 0.0 OUTLIER -63.45 -37.36 86.98 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.34 -175.56 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 2.8 tm? . . . . . 0 N--CA 1.438 -1.047 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.164 178.03 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.586 ' HB2' HG21 ' A' ' 968' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.735 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.777 ' HA ' HD21 ' A' ' 928' ' ' ASN . 4.2 p -59.84 -34.53 56.18 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 CA-C-N 119.708 1.14 . . . . 0.0 110.942 167.019 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 2.4 p90 -77.23 -28.13 53.6 Favored 'General case' 0 CA--C 1.506 -0.737 0 O-C-N 121.601 -0.687 . . . . 0.0 109.394 174.458 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.85 -24.88 48.45 Favored 'General case' 0 C--N 1.307 -1.282 0 C-N-CA 118.698 -1.201 . . . . 0.0 113.962 178.243 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.777 HD21 ' HA ' ' A' ' 925' ' ' VAL . 13.0 p30 -72.21 -27.66 62.69 Favored 'General case' 0 C--N 1.317 -0.807 0 C-N-CA 118.661 -1.216 . . . . 0.0 108.992 166.06 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.787 HG22 ' HB1' ' A' 1032 ' ' ALA . 71.6 t -76.61 -30.7 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.137 179.239 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 930' ' ' THR . . . . . . . . . . . . . 26.8 m -61.2 -42.9 99.4 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 172.123 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -67.12 -52.72 30.38 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-N 114.61 -1.177 . . . . 0.0 113.808 176.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.62 ' HB3' ' HB1' ' A' ' 961' ' ' ALA . 2.4 pp -64.67 -49.47 70.85 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -174.76 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.531 ' O ' ' HB ' ' A' ' 936' ' ' VAL . 54.3 t -64.2 -37.84 80.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-O 121.311 0.576 . . . . 0.0 110.663 -176.146 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.404 ' O ' ' HB3' ' A' ' 938' ' ' GLU . 19.2 ttpp -59.87 -51.42 69.8 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.08 178.064 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -51.81 -39.69 59.17 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 111.672 0.249 . . . . 0.0 111.672 178.047 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.909 HG22 ' HB1' ' A' 1025 ' ' ALA . 92.0 t -46.73 -76.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 O-C-N 123.747 0.654 . . . . 0.0 111.852 177.256 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.448 HG13 ' N ' ' A' ' 938' ' ' GLU . 26.9 pt -68.66 -40.7 82.05 Favored 'Isoleucine or valine' 0 C--O 1.244 0.788 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -176.775 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.448 ' N ' HG13 ' A' ' 937' ' ' ILE . 30.8 tt0 -61.47 -52.86 62.77 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.117 -171.561 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 85.7 mtp -76.23 -26.93 56.55 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 119.782 -0.767 . . . . 0.0 110.721 -178.226 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.634 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 28.5 t . . . . . 0 CA--C 1.52 -0.21 0 O-C-N 123.925 0.766 . . . . 0.0 112.502 -170.71 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.868 ' CD1' ' HB3' ' A' 1006 ' ' GLN . 0.8 OUTLIER . . . . . 0 C--O 1.223 -0.324 0 CA-C-O 120.72 0.295 . . . . 0.0 110.509 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 0.797 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 26.6 t -59.5 -54.13 59.04 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.963 174.16 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 0.797 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 34.7 Cg_exo -49.01 -41.51 40.03 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 122.059 1.839 . . . . 0.0 112.628 171.535 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 954' ' ' MET . . . . . . . . . . . . . 27.0 ttt -64.36 -38.25 90.38 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.376 175.519 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.747 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 35.1 t -52.25 -47.44 45.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.378 169.397 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -64.21 -29.89 70.98 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.27 177.726 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -78.26 -46.07 21.23 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 121.151 0.5 . . . . 0.0 111.012 -174.838 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 958' ' ' VAL . . . . . . . . . . . . . 14.8 p -81.66 -26.48 9.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.482 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -67.05 -34.49 86.9 Favored Glycine 0 N--CA 1.447 -0.59 0 N-CA-C 110.493 -1.043 . . . . 0.0 110.493 171.112 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 960' ' ' LEU . . . . . 0.577 HD12 ' HD2' ' A' ' 963' ' ' ARG . 20.2 tp -63.88 -30.39 71.48 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.288 -0.456 . . . . 0.0 110.213 175.427 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.62 ' HB1' ' HB3' ' A' ' 932' ' ' LEU . . . -76.41 -56.86 4.25 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.105 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.624 HD22 HD12 ' A' ' 995' ' ' LEU . 0.2 OUTLIER -44.07 -47.35 8.85 Favored 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 169.22 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.577 ' HD2' HD12 ' A' ' 960' ' ' LEU . 9.5 ptp180 -69.79 -27.18 64.68 Favored 'General case' 0 C--N 1.32 -0.699 0 O-C-N 120.848 -1.158 . . . . 0.0 110.831 179.159 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 964' ' ' THR . . . . . 0.484 HG22 ' HB3' ' A' ' 928' ' ' ASN . 93.0 m -68.94 -32.78 72.63 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 171.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.743 HD22 HD23 ' A' ' 991' ' ' LEU . 0.2 OUTLIER -65.44 -41.87 92.99 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.073 172.721 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 5.1 tt -69.98 -42.91 72.48 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.415 -0.811 . . . . 0.0 108.95 -174.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -66.99 -44.07 81.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.258 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.586 HG21 ' HB2' ' A' ' 924' ' ' LYS . 19.4 p -62.38 -48.48 79.57 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.77 0.319 . . . . 0.0 111.224 179.455 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 1.073 HG12 HG23 ' A' ' 984' ' ' ILE . 45.7 t -72.68 -31.43 37.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.81 178.393 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.619 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 15.1 t70 -69.96 -40.87 75.16 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 178.527 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.581 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 31.2 tt0 -64.79 -34.23 77.87 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 114.013 -1.449 . . . . 0.0 109.258 178.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.515 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 61.6 m -71.36 -18.81 62.35 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.324 178.058 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.747 ' HB2' HG21 ' A' ' 984' ' ' ILE . 9.7 tt -65.27 -49.78 63.08 Favored Pre-proline 0 CA--C 1.532 0.254 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.482 -176.591 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.702 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 4.9 Cg_exo -81.84 -9.68 11.93 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 121.659 1.573 . . . . 0.0 113.058 171.16 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.569 HG23 ' O ' ' A' ' 971' ' ' GLU . 25.4 t . . . . . 0 C--N 1.331 -0.212 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 171.593 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.524 HG23 ' HB1' ' A' 1042 ' ' ALA . 54.6 m . . . . . 0 CA--C 1.531 0.225 0 CA-C-O 121.936 0.874 . . . . 0.0 109.366 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.634 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 2.8 t60 -56.9 -35.09 68.58 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 114.187 -1.37 . . . . 0.0 111.427 178.486 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 6.0 ptp180 -84.54 -19.46 33.15 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -174.058 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.633 ' HG3' HG13 ' A' 1038 ' ' VAL . 0.4 OUTLIER -75.55 -33.98 60.71 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 121.903 0.859 . . . . 0.0 108.785 171.542 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 1.073 HG23 HG12 ' A' ' 969' ' ' VAL . 62.1 mt -72.95 -29.24 28.57 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.893 0 CA-C-N 114.219 -1.355 . . . . 0.0 109.596 177.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 985' ' ' GLU . . . . . 0.634 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 57.6 mt-10 -63.27 -47.87 80.55 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.512 0.672 . . . . 0.0 109.844 172.519 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 986' ' ' MET . . . . . 0.511 ' HG2' HD13 ' A' ' 990' ' ' LEU . 54.0 ttm -71.64 -47.38 54.79 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.88 -172.39 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.861 ' HA ' ' HG ' ' A' 1035 ' ' LEU . . . -61.1 -50.61 72.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.785 -175.485 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.66 ' O ' ' HB2' ' A' ' 992' ' ' ASN . 47.6 mt-30 -56.99 -30.67 64.34 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.0 0.429 . . . . 0.0 110.696 177.056 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 989' ' ' LYS . . . . . 0.733 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 1.9 ttmt -79.09 -40.33 31.44 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 -178.896 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.511 HD13 ' HG2' ' A' ' 986' ' ' MET . 3.1 mp -60.33 -54.05 50.29 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 119.552 -0.859 . . . . 0.0 112.867 -178.119 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.743 HD23 HD22 ' A' ' 965' ' ' LEU . 11.7 tp -65.64 -26.44 67.81 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.061 -0.656 . . . . 0.0 109.401 177.225 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 992' ' ' ASN . . . . . 0.733 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 23.8 t-20 -52.97 -57.74 9.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.632 178.828 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 13.4 m -80.42 -36.3 33.91 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -175.678 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.43 -36.7 84.71 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 119.386 -0.926 . . . . 0.0 111.268 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 0.689 ' N ' HD21 ' A' 1028 ' ' LEU . 2.3 tm? -68.16 -24.79 65.02 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.308 171.444 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -71.61 -28.7 63.98 Favored 'General case' 0 C--N 1.316 -0.86 0 C-N-CA 119.283 -0.967 . . . . 0.0 109.978 170.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -76.26 -37.66 57.3 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 110.415 -0.217 . . . . 0.0 110.415 173.607 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.889 HD12 ' HB2' ' A' 1025 ' ' ALA . 1.1 tt -56.6 -46.77 80.68 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.293 0.568 . . . . 0.0 110.855 178.756 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.511 ' N ' HD23 ' A' ' 998' ' ' LEU . 84.7 mt -65.95 -46.76 87.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.722 -172.909 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -56.38 -40.28 74.32 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.333 0.587 . . . . 0.0 111.552 -177.275 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.688 ' HD3' ' HG2' ' A' 1020 ' ' GLN . 96.8 mttt -84.88 -33.92 22.7 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.79 -173.543 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.68 ' SD ' ' HE3' ' A' 1018 ' ' LYS . 5.3 ttp -62.4 -30.31 71.12 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 122.351 1.072 . . . . 0.0 108.574 173.267 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.504 ' O ' ' HG3' ' A' 1006 ' ' GLN . 3.8 tptm -67.38 -53.03 32.94 Favored 'General case' 0 N--CA 1.439 -0.975 0 CA-C-N 113.777 -1.556 . . . . 0.0 110.491 -171.001 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.69 ' HB3' HD23 ' A' 1013 ' ' LEU . 8.4 mp -69.95 -16.65 63.24 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.815 -179.356 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.719 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -70.98 -39.45 72.47 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 119.344 -0.942 . . . . 0.0 110.219 -178.377 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.887 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.4 pp0? -74.75 -32.95 62.23 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 120.384 -0.526 . . . . 0.0 111.328 167.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.627 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 75.4 mt-30 -50.92 -44.51 60.13 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.258 0.551 . . . . 0.0 110.379 176.908 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.739 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 49.7 m-85 -122.2 41.1 3.49 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.561 172.239 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1009 ' ' VAL . . . . . 1.052 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 14.9 p -50.52 -21.18 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.646 171.908 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1010 ' ' MET . . . . . 0.501 ' O ' HG23 ' A' 1011 ' ' THR . 97.0 mmm -38.7 -50.32 1.63 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.33 -1.304 . . . . 0.0 111.381 172.937 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1011 ' ' THR . . . . . 0.501 HG23 ' O ' ' A' 1010 ' ' MET . 0.7 OUTLIER -163.68 -86.15 0.02 OUTLIER 'General case' 0 C--O 1.246 0.897 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 179.369 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 42.5 t -54.02 -67.46 0.26 Allowed 'General case' 0 C--O 1.238 0.474 0 CA-C-N 114.786 -1.097 . . . . 0.0 112.605 -166.231 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1013 ' ' LEU . . . . . 0.739 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 6.8 mp -50.09 -42.39 50.13 Favored 'General case' 0 CA--C 1.5 -0.967 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 -179.189 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1014 ' ' GLN . . . . . 1.052 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.8 OUTLIER -53.47 -48.53 68.79 Favored 'General case' 0 N--CA 1.442 -0.827 0 O-C-N 123.65 0.594 . . . . 0.0 111.222 -166.866 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 27.0 pt20 -74.45 -45.56 45.49 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.262 -176.17 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -66.53 -53.14 38.16 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.495 0.664 . . . . 0.0 110.751 -178.277 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.719 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 15.9 m-85 -62.93 -37.63 87.8 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 114.628 -1.169 . . . . 0.0 113.37 -174.555 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.68 ' HE3' ' SD ' ' A' 1002 ' ' MET . 17.3 tptm -81.54 -29.1 33.62 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.988 -177.73 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1019 ' ' LYS . . . . . 0.433 ' O ' HD23 ' A' 1022 ' ' LEU . 4.5 mptp? -74.27 -51.74 14.41 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 174.814 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1020 ' ' GLN . . . . . 0.688 ' HG2' ' HD3' ' A' 1001 ' ' LYS . 10.5 tt0 -51.02 -34.47 29.62 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.07 163.808 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.635 ' HE2' ' HE2' ' A' 1018 ' ' LYS . 9.9 tmm? -62.87 -50.55 70.47 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 174.81 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1022 ' ' LEU . . . . . 0.89 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -80.11 -2.83 46.21 Favored 'General case' 0 C--O 1.221 -0.445 0 C-N-CA 119.276 -0.97 . . . . 0.0 109.858 -176.811 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 88.5 m -84.57 -39.56 18.59 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 171.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.514 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.21 -21.16 50.44 Favored 'General case' 0 C--O 1.22 -0.486 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 172.139 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.909 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -85.03 -25.11 27.86 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.137 170.536 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.582 ' O ' HG23 ' A' 1030 ' ' VAL . 61.0 t60 -75.78 -23.91 55.95 Favored 'General case' 0 C--O 1.217 -0.61 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 164.365 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1027 ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -71.01 -39.98 72.09 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 123.057 0.543 . . . . 0.0 109.8 164.118 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.697 HD12 HD13 ' A' ' 998' ' ' LEU . 15.0 mt -62.47 -44.7 95.77 Favored 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.104 170.507 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -60.01 -36.43 77.19 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 111.286 0.106 . . . . 0.0 111.286 173.602 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.582 HG23 ' O ' ' A' 1026 ' ' HIS . 8.8 t -70.35 -50.81 43.4 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 CA-C-O 121.506 0.67 . . . . 0.0 109.795 -179.756 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1031 ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -71.16 -42.35 69.23 Favored 'General case' 0 C--O 1.208 -1.101 0 CA-C-N 114.784 -1.098 . . . . 0.0 111.483 -175.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.787 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -66.8 -32.64 74.06 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.668 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 65.4 tttp -64.37 -49.82 70.12 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.747 0.784 . . . . 0.0 110.116 170.77 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.471 ' O ' HG23 ' A' 1038 ' ' VAL . 59.9 t30 -72.28 -38.74 68.72 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 114.826 -1.079 . . . . 0.0 112.018 -173.829 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.861 ' HG ' ' HA ' ' A' ' 987' ' ' ALA . 0.0 OUTLIER -64.83 -40.5 95.29 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 119.215 -0.421 . . . . 0.0 110.817 -177.498 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.551 ' HB3' HG22 ' A' ' 925' ' ' VAL . 4.2 pp -67.8 -39.57 84.0 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 117.232 -1.787 . . . . 0.0 110.177 174.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.08 -39.26 59.47 Favored 'General case' 0 C--N 1.344 0.328 0 CA-C-O 121.725 0.774 . . . . 0.0 110.207 172.375 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.633 HG13 ' HG3' ' A' ' 983' ' ' GLU . 12.3 t -57.91 -46.35 87.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 114.321 -1.309 . . . . 0.0 111.841 176.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.602 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 2.4 mp -73.91 -27.62 22.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 118.329 0.513 . . . . 0.0 111.484 174.834 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -64.45 -46.96 80.87 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.332 170.662 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -60.47 -46.09 91.34 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 172.253 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.602 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -55.49 -51.4 67.09 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.58 -175.884 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.519 ' HG2' ' O ' ' A' 1039 ' ' ILE . 4.8 ptp85 -62.07 -34.73 76.82 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.034 -173.687 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 12.9 mt . . . . . 0 C--N 1.321 -0.66 0 C-N-CA 119.201 -1.0 . . . . 0.0 111.635 174.731 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.821 ' HB3' HG21 ' A' ' 968' ' ' THR . 14.0 tppt? . . . . . 0 N--CA 1.447 -0.59 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.624 HG12 HD12 ' A' ' 965' ' ' LEU . 3.6 t -64.29 -43.36 97.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-N 118.79 0.723 . . . . 0.0 111.274 -172.726 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -78.69 -19.06 53.36 Favored 'General case' 0 CA--C 1.502 -0.89 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.845 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.66 -23.32 53.25 Favored 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 119.64 -0.824 . . . . 0.0 111.147 168.711 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.451 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 8.2 m120 -74.74 -27.53 60.4 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 168.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.668 HG22 ' HB1' ' A' 1032 ' ' ALA . 60.0 t -77.51 -30.95 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.258 176.224 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 930' ' ' THR . . . . . . . . . . . . . 27.9 m -60.32 -41.36 93.35 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 171.081 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -68.72 -54.05 17.0 Favored Glycine 0 CA--C 1.526 0.761 0 CA-C-N 114.996 -1.002 . . . . 0.0 113.621 176.641 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.553 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.2 pp -63.44 -49.33 74.12 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -175.556 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 63.5 t -65.62 -36.84 78.56 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-O 121.112 0.482 . . . . 0.0 110.883 -175.686 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.651 ' O ' ' HB2' ' A' ' 938' ' ' GLU . 4.3 ttpm? -58.92 -46.58 87.58 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.178 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -55.3 -41.63 72.61 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 111.545 0.202 . . . . 0.0 111.545 176.268 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.771 HG22 ' HB1' ' A' 1025 ' ' ALA . 61.9 t -49.21 -75.49 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 123.206 0.603 . . . . 0.0 112.448 -177.757 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.425 HG13 ' N ' ' A' ' 938' ' ' GLU . 35.4 pt -74.3 -42.03 50.6 Favored 'Isoleucine or valine' 0 C--O 1.245 0.836 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -175.123 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.651 ' HB2' ' O ' ' A' ' 934' ' ' LYS . 25.4 mm-40 -60.86 -51.29 69.94 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.907 0.384 . . . . 0.0 110.529 -174.306 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 65.4 mtt -74.16 -26.52 60.35 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.861 -178.464 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.629 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 53.3 p . . . . . 0 CA--C 1.52 -0.202 0 O-C-N 123.705 0.628 . . . . 0.0 111.672 -170.142 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.659 ' CD1' ' HD3' ' A' 1018 ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.219 -0.552 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 0.998 HG23 ' HD3' ' A' ' 953' ' ' PRO . 0.9 OUTLIER -82.62 -39.22 0.83 Allowed Pre-proline 0 N--CA 1.453 -0.281 0 CA-C-O 119.219 -0.42 . . . . 0.0 111.415 176.175 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 0.998 ' HD3' HG23 ' A' ' 952' ' ' VAL . 35.8 Cg_exo -49.84 -42.15 45.05 Favored 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 121.417 1.412 . . . . 0.0 110.729 161.684 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.607 ' HG3' HG23 ' A' ' 958' ' ' VAL . 2.5 ttm -70.4 -28.96 65.49 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 113.831 -1.531 . . . . 0.0 111.846 177.571 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.88 HG23 ' HA ' ' A' ' 952' ' ' VAL . 76.0 t -53.39 -40.34 39.91 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 173.037 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.404 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 8.9 tmtt? -68.45 -33.17 73.72 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 114.973 -1.012 . . . . 0.0 111.723 173.601 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 957' ' ' GLU . . . . . 0.419 ' HB2' ' HA ' ' A' ' 954' ' ' MET . 6.9 mm-40 -78.35 -47.63 17.3 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -176.556 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.607 HG23 ' HG3' ' A' ' 954' ' ' MET . 2.7 t -84.54 -34.92 9.9 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.011 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 -178.143 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -59.8 -39.53 95.49 Favored Glycine 0 N--CA 1.434 -1.453 0 N-CA-C 110.636 -0.986 . . . . 0.0 110.636 178.514 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 960' ' ' LEU . . . . . 0.547 ' O ' ' HG2' ' A' ' 963' ' ' ARG . 9.1 tt -68.13 -36.17 79.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.348 -0.426 . . . . 0.0 110.626 175.276 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -76.25 -60.23 2.42 Favored 'General case' 0 C--N 1.321 -0.65 0 O-C-N 122.093 -0.379 . . . . 0.0 110.952 -174.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 1.108 HD13 HD22 ' A' ' 995' ' ' LEU . 3.4 pp -53.54 -34.13 57.11 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 112.435 0.531 . . . . 0.0 112.435 173.153 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.547 ' HG2' ' O ' ' A' ' 960' ' ' LEU . 3.7 ptm180 -71.83 -39.98 69.39 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 119.949 1.25 . . . . 0.0 111.166 174.803 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 38.3 m -61.24 -38.82 88.05 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 174.682 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.667 HD11 HD21 ' A' 1035 ' ' LEU . 0.3 OUTLIER -55.97 -54.72 41.42 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.66 174.738 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 5.2 tt -69.52 -34.68 74.62 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.164 -172.572 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 967' ' ' ALA . . . . . 0.418 ' O ' ' HB2' ' A' ' 971' ' ' GLU . . . -71.8 -29.16 64.15 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.807 178.108 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.821 HG21 ' HB3' ' A' ' 924' ' ' LYS . 23.7 m -71.99 -32.9 67.68 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 118.824 0.738 . . . . 0.0 109.79 172.354 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 1.003 HG12 HG23 ' A' ' 984' ' ' ILE . 24.3 t -70.24 -40.8 78.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.424 171.404 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.584 ' HB2' ' OE1' ' A' ' 988' ' ' GLN . 16.4 t70 -65.58 -42.1 92.13 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 122.301 1.048 . . . . 0.0 108.864 179.583 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.525 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 37.6 tt0 -62.16 -37.6 85.85 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 113.54 -1.664 . . . . 0.0 109.867 177.516 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 63.7 m -67.1 -18.76 65.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.085 176.813 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.63 ' HG ' ' HB2' ' A' ' 981' ' ' HIS . 9.4 tt -68.69 -51.74 20.56 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.648 -172.601 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.549 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 95.7 Cg_endo -84.37 -7.35 9.91 Favored 'Trans proline' 0 C--N 1.354 0.821 0 CA-C-N 119.883 0.994 . . . . 0.0 112.878 174.858 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 971' ' ' GLU . 75.3 t . . . . . 0 C--N 1.331 -0.228 0 C-N-CA 120.226 -0.59 . . . . 0.0 109.419 170.235 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.867 ' HA ' ' HB1' ' A' 1042 ' ' ALA . 89.4 m . . . . . 0 CA--C 1.531 0.229 0 N-CA-C 111.703 0.26 . . . . 0.0 111.703 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.63 ' HB2' ' HG ' ' A' ' 973' ' ' LEU . 0.5 OUTLIER -62.66 -33.81 75.8 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.961 -175.729 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 9.3 ptm180 -85.4 -19.82 30.77 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 121.046 -0.261 . . . . 0.0 111.046 -178.387 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 983' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.67 -34.48 69.75 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 166.256 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 1.003 HG23 HG12 ' A' ' 969' ' ' VAL . 44.9 mt -69.9 -33.01 53.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.637 176.872 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 985' ' ' GLU . . . . . 0.53 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 50.5 mt-10 -57.96 -49.81 75.53 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.559 175.245 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 50.9 ttp -72.83 -42.49 63.74 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 114.9 -1.046 . . . . 0.0 110.755 -175.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.809 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -68.21 -50.27 55.25 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 114.898 -1.046 . . . . 0.0 112.279 -172.867 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.595 ' O ' ' HB2' ' A' ' 992' ' ' ASN . 44.8 mt-30 -54.39 -43.73 71.67 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 176.2 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 989' ' ' LYS . . . . . 0.708 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 0.0 OUTLIER -63.52 -42.15 98.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.046 177.88 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 26.3 tp -51.86 -59.32 4.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.324 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.452 ' HA ' HD22 ' A' ' 991' ' ' LEU . 0.7 OUTLIER -63.43 -35.5 80.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.709 0.766 . . . . 0.0 108.936 178.143 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 992' ' ' ASN . . . . . 0.708 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 25.5 t-20 -50.37 -55.39 15.86 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 113.82 -1.536 . . . . 0.0 112.749 -176.661 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 5.5 m -77.86 -30.03 50.69 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.31 -0.556 . . . . 0.0 111.99 -178.151 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 994' ' ' ASP . . . . . 0.436 ' O ' ' HB3' ' A' ' 997' ' ' GLU . 0.1 OUTLIER -73.75 -33.79 64.46 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 118.877 -1.129 . . . . 0.0 111.667 179.826 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 1.108 HD22 HD13 ' A' ' 962' ' ' LEU . 1.9 pp -68.02 -19.12 64.88 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 169.645 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -78.21 -23.93 47.31 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 119.414 -0.914 . . . . 0.0 110.133 169.363 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.436 ' HB3' ' O ' ' A' ' 994' ' ' ASP . 6.9 tp10 -74.23 -43.96 55.04 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.976 -0.749 . . . . 0.0 108.976 171.566 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.715 HD13 ' HB2' ' A' 1025 ' ' ALA . 7.5 tp -56.91 -48.06 79.09 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.266 -179.371 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.874 ' HA ' ' SD ' ' A' 1002 ' ' MET . 67.5 mt -68.76 -38.08 78.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.828 -171.278 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 25.8 m-80 -62.76 -35.41 79.72 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.63 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.486 ' HA ' ' HD1' ' A' 1017 ' ' TYR . 0.7 OUTLIER -85.4 -39.84 17.13 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.293 0.568 . . . . 0.0 110.816 -175.469 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.874 ' SD ' ' HA ' ' A' ' 999' ' ' ILE . 8.2 ptm -62.29 -27.08 68.77 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 122.255 1.026 . . . . 0.0 108.653 177.499 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.671 ' O ' ' HG3' ' A' 1006 ' ' GLN . 19.9 tptt -73.92 -54.04 8.81 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 114.158 -1.383 . . . . 0.0 110.575 -171.056 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.549 ' HA ' ' HB2' ' A' 1007 ' ' GLN . 6.4 mt -69.54 -12.52 61.72 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.004 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.749 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -75.73 -38.7 58.27 Favored 'General case' 0 C--O 1.213 -0.838 0 C-N-CA 119.296 -0.962 . . . . 0.0 108.594 -178.85 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.967 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 1.3 pp0? -74.33 -36.7 63.66 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.764 -0.375 . . . . 0.0 111.126 170.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.549 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 33.9 mt-30 -49.26 -43.32 42.86 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.034 0.445 . . . . 0.0 111.289 178.599 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.658 ' HB2' ' HG ' ' A' 1013 ' ' LEU . 49.4 m-85 -126.04 44.74 2.78 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.313 0.578 . . . . 0.0 110.839 169.17 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1009 ' ' VAL . . . . . 1.013 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 7.9 p -53.17 -20.21 2.57 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.409 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.63 171.899 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1010 ' ' MET . . . . . 0.462 ' O ' HG23 ' A' 1011 ' ' THR . 60.2 mtm -48.42 -40.59 26.51 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.162 -1.381 . . . . 0.0 111.915 174.419 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1011 ' ' THR . . . . . 0.462 HG23 ' O ' ' A' 1010 ' ' MET . 1.0 OUTLIER -160.66 -94.18 0.02 OUTLIER 'General case' 0 C--O 1.248 0.998 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 -179.344 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 4.6 m -59.12 -62.65 1.72 Allowed 'General case' 0 C--O 1.24 0.555 0 CA-C-N 114.517 -1.22 . . . . 0.0 113.121 -162.811 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1013 ' ' LEU . . . . . 0.701 HD22 ' HE2' ' A' 1017 ' ' TYR . 14.6 mt -53.57 -37.38 62.86 Favored 'General case' 0 CA--C 1.498 -1.044 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.735 -178.653 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1014 ' ' GLN . . . . . 1.013 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 1.7 tt0 -53.78 -54.56 36.46 Favored 'General case' 0 N--CA 1.441 -0.919 0 O-C-N 123.867 0.729 . . . . 0.0 110.817 -166.693 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -70.57 -42.45 71.07 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.82 -175.61 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -67.0 -53.76 28.26 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.555 0.693 . . . . 0.0 111.149 -179.193 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.749 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 12.0 m-85 -62.56 -34.34 76.77 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 113.823 1.045 . . . . 0.0 113.823 -176.775 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.659 ' HD3' ' CD1' ' A' ' 951' ' ' TYR . 54.1 tptt -79.05 -31.38 44.51 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 114.92 -1.036 . . . . 0.0 110.247 -176.122 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -71.81 -42.51 66.96 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 175.084 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -56.16 -36.25 68.1 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.539 163.335 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.597 ' HB3' ' HA ' ' A' 1018 ' ' LYS . 0.0 OUTLIER -66.82 -51.74 52.0 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.377 0.132 . . . . 0.0 110.834 -177.032 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A 1022 ' ' LEU . . . . . 0.417 ' O ' ' HG ' ' A' 1022 ' ' LEU . 0.0 OUTLIER -78.09 -13.48 59.85 Favored 'General case' 0 C--O 1.218 -0.558 0 C-N-CA 119.595 -0.842 . . . . 0.0 109.955 -176.036 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A 1023 ' ' THR . . . . . 0.499 ' HA ' ' HB3' ' A' 1026 ' ' HIS . 87.5 m -88.44 -32.75 18.14 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.671 177.093 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.499 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.28 -23.36 47.24 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 171.69 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.771 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -86.21 -21.67 27.34 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.255 169.307 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.636 ' O ' HG23 ' A' 1030 ' ' VAL . 84.9 t60 -76.38 -27.07 56.22 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 165.662 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1027 ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -68.98 -41.51 77.78 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 123.806 0.842 . . . . 0.0 109.957 163.19 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.623 HD21 ' N ' ' A' ' 995' ' ' LEU . 12.3 mt -61.23 -39.95 92.18 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 119.989 -0.684 . . . . 0.0 109.666 170.894 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -60.96 -37.34 82.05 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.484 0.183 . . . . 0.0 110.973 171.29 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.636 HG23 ' O ' ' A' 1026 ' ' HIS . 18.1 t -69.28 -50.45 52.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 121.746 0.784 . . . . 0.0 110.109 -178.684 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1031 ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -74.18 -32.83 63.25 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-N 114.445 -1.252 . . . . 0.0 111.024 -174.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.874 ' HA ' HD22 ' A' 1035 ' ' LEU . . . -71.39 -32.36 68.35 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 173.824 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -63.73 -43.89 95.17 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.661 0.743 . . . . 0.0 109.363 171.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.439 ' O ' ' HB3' ' A' 1037 ' ' ASP . 48.3 t30 -79.22 -49.25 12.81 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 114.865 -1.061 . . . . 0.0 112.364 -173.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.874 HD22 ' HA ' ' A' 1032 ' ' ALA . 0.2 OUTLIER -60.33 -39.7 88.01 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 118.012 0.369 . . . . 0.0 110.662 -174.422 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.511 ' H ' HD23 ' A' 1035 ' ' LEU . 2.5 tm? -68.83 -43.19 76.02 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 117.998 -1.481 . . . . 0.0 108.87 178.669 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.439 ' HB3' ' O ' ' A' 1034 ' ' ASN . 27.8 t70 -52.6 -41.76 63.95 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.457 174.49 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.474 ' HB ' ' O ' ' A' 1035 ' ' LEU . 24.6 t -56.41 -41.38 71.71 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.694 0 CA-C-N 114.182 -1.372 . . . . 0.0 111.706 174.871 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.657 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 1.6 mp -81.16 -28.63 10.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 118.215 0.461 . . . . 0.0 111.282 177.721 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -59.23 -48.6 81.01 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 168.889 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -70.76 -33.43 70.78 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.53 175.225 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.867 ' HB1' ' HA ' ' A' ' 980' ' ' THR . . . -55.37 -50.22 70.27 Favored 'General case' 0 CA--C 1.512 -0.511 0 C-N-CA 123.384 0.673 . . . . 0.0 112.422 178.739 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.591 ' HG2' ' O ' ' A' 1039 ' ' ILE . 4.0 ptp85 -64.58 -34.87 79.28 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.911 -0.404 . . . . 0.0 109.911 -177.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 51.7 tp . . . . . 0 C--N 1.328 -0.334 0 CA-C-O 121.102 0.477 . . . . 0.0 110.61 173.16 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.462 ' HA ' ' HD2' ' A' ' 924' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--O 1.224 -0.27 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.569 HG21 ' HB2' ' A' 1036 ' ' LEU . 20.0 m -60.42 -29.22 43.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.318 0.58 . . . . 0.0 110.744 175.221 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.79 -35.16 64.9 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.004 -0.544 . . . . 0.0 112.205 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 927' ' ' GLU . . . . . 0.843 ' HA ' ' HB ' ' A' ' 930' ' ' THR . 12.1 pt-20 -76.26 -22.71 54.79 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 119.566 1.075 . . . . 0.0 110.736 179.388 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.416 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 1.4 m120 -71.81 -30.3 65.35 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 174.306 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.661 HG22 ' HB1' ' A' 1032 ' ' ALA . 75.6 t -80.53 -32.5 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.297 0 CA-C-N 114.593 -1.185 . . . . 0.0 109.556 172.932 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.843 ' HB ' ' HA ' ' A' ' 927' ' ' GLU . 1.2 m -54.4 -44.72 72.59 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 167.137 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -68.35 -53.2 22.59 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-N 115.006 -0.997 . . . . 0.0 114.008 175.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.574 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.0 pp -64.68 -48.32 75.18 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 117.518 0.659 . . . . 0.0 112.772 -175.323 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 49.7 t -66.64 -36.69 77.88 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.394 0 CA-C-O 121.04 0.448 . . . . 0.0 110.925 -174.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.41 ' HE2' ' HB3' ' A' ' 934' ' ' LYS . 22.0 ttpt -60.09 -41.98 93.65 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.303 179.046 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -62.46 -32.1 72.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.554 0.216 . . . . 0.0 111.543 176.131 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.814 HG22 ' HB1' ' A' 1025 ' ' ALA . 98.6 t -58.6 -75.83 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -177.912 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 27.4 pt -73.35 -39.45 55.38 Favored 'Isoleucine or valine' 0 C--O 1.239 0.516 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -173.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -63.09 -51.9 64.79 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.686 0.755 . . . . 0.0 109.809 -174.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.706 ' HG3' ' SD ' ' A' ' 954' ' ' MET . 21.6 mmt -73.32 -26.59 61.11 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.877 -177.383 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.662 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 25.7 p . . . . . 0 CA--C 1.519 -0.247 0 O-C-N 123.746 0.654 . . . . 0.0 111.458 -173.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.833 ' CE1' ' HD3' ' A' 1018 ' ' LYS . 23.6 m-85 . . . . . 0 N--CA 1.466 0.355 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 0.881 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -54.69 -51.78 75.83 Favored Pre-proline 0 CA--C 1.542 0.643 0 CA-C-O 119.077 -0.487 . . . . 0.0 111.877 178.76 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 0.881 ' HD3' HG13 ' A' ' 952' ' ' VAL . 5.7 Cg_exo -46.4 -49.18 12.15 Favored 'Trans proline' 0 C--N 1.354 0.827 0 C-N-CA 122.522 2.148 . . . . 0.0 113.73 169.492 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.706 ' SD ' ' HG3' ' A' ' 939' ' ' MET . 2.3 tpt -58.47 -49.03 78.8 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.546 0.688 . . . . 0.0 110.233 176.899 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.884 HG21 ' HG2' ' A' 1002 ' ' MET . 56.8 t -53.37 -33.57 21.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 114.56 -1.2 . . . . 0.0 112.414 171.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 5.7 mptp? -63.36 -31.68 72.9 Favored 'General case' 0 C--N 1.315 -0.901 0 C-N-CA 119.737 -0.785 . . . . 0.0 111.149 173.047 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 957' ' ' GLU . . . . . 0.432 ' O ' ' HB3' ' A' ' 960' ' ' LEU . 45.0 mm-40 -79.76 -42.76 23.85 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.545 0.212 . . . . 0.0 111.506 176.868 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' ' 954' ' ' MET . 2.0 t -69.42 -33.46 57.55 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 177.639 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -66.1 -37.4 93.03 Favored Glycine 0 N--CA 1.435 -1.401 0 N-CA-C 110.352 -1.099 . . . . 0.0 110.352 173.502 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 960' ' ' LEU . . . . . 0.565 HD12 ' HD3' ' A' ' 963' ' ' ARG . 16.3 tp -62.81 -31.98 73.08 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 115.034 -0.583 . . . . 0.0 110.045 172.538 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.51 ' HB1' ' HB3' ' A' ' 932' ' ' LEU . . . -73.76 -58.54 3.23 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.763 -0.198 . . . . 0.0 110.588 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.535 ' HG ' ' N ' ' A' ' 963' ' ' ARG . 0.1 OUTLIER -39.22 -53.65 1.88 Allowed 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 166.682 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.565 ' HD3' HD12 ' A' ' 960' ' ' LEU . 6.5 ptm180 -67.7 -31.96 72.27 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 119.318 0.963 . . . . 0.0 111.516 -178.111 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 83.5 m -65.96 -35.6 81.04 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 175.401 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.941 HD21 HD11 ' A' 1035 ' ' LEU . 52.9 tp -70.88 -37.76 73.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.52 -1.218 . . . . 0.0 109.63 176.569 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 9.7 tt -68.21 -40.37 82.12 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 114.628 -1.169 . . . . 0.0 108.36 -175.816 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -70.63 -37.18 73.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.531 -0.759 . . . . 0.0 112.262 178.351 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 7.6 p -66.07 -41.42 90.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 118.802 0.728 . . . . 0.0 110.169 176.628 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.973 HG12 HG23 ' A' ' 984' ' ' ILE . 77.0 t -71.1 -38.58 71.87 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.324 174.619 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.648 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 7.1 t70 -68.01 -41.49 82.16 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.647 0.736 . . . . 0.0 109.045 -178.889 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.469 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 45.5 tt0 -62.93 -33.37 75.19 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.519 176.8 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.42 ' HB2' ' O ' ' A' ' 969' ' ' VAL . 62.2 m -67.06 -20.03 65.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.184 176.396 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.713 ' HB2' HG21 ' A' ' 984' ' ' ILE . 9.1 tt -68.64 -53.18 16.88 Favored Pre-proline 0 CA--C 1.534 0.352 0 CA-C-O 119.513 -0.28 . . . . 0.0 110.907 -174.192 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.693 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 4.1 Cg_endo -89.29 -2.69 6.06 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 121.766 1.644 . . . . 0.0 113.143 176.647 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 975' ' ' VAL . . . . . . . . . . . . . 20.9 t . . . . . 0 C--N 1.328 -0.363 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.616 175.137 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.891 HG23 ' HB1' ' A' 1042 ' ' ALA . 23.7 m . . . . . 0 CA--C 1.54 0.563 0 CA-C-O 120.923 0.392 . . . . 0.0 111.625 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.455 ' HA ' ' HG ' ' A' ' 973' ' ' LEU . 7.9 p80 -52.98 -32.62 47.29 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -179.525 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 982' ' ' ARG . . . . . 0.546 ' HA ' ' HG2' ' A' ' 985' ' ' GLU . 4.4 ptm180 -83.46 -21.57 32.84 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 120.268 -0.573 . . . . 0.0 111.714 -174.683 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.436 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 0.4 OUTLIER -79.33 -39.88 31.67 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 121.882 0.849 . . . . 0.0 109.232 171.63 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.973 HG23 HG12 ' A' ' 969' ' ' VAL . 75.0 mt -69.02 -33.22 57.75 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 CA-C-N 114.254 -1.339 . . . . 0.0 110.0 -178.334 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 985' ' ' GLU . . . . . 0.546 ' HG2' ' HA ' ' A' ' 982' ' ' ARG . 12.8 pt-20 -71.2 -43.54 67.17 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 119.553 -0.859 . . . . 0.0 109.525 -179.499 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 54.3 tpp -71.3 -43.52 66.94 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 114.583 -1.189 . . . . 0.0 111.344 -172.747 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.987 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -74.83 -50.09 18.33 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.879 -1.055 . . . . 0.0 112.687 -170.327 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.565 ' O ' ' HB2' ' A' ' 992' ' ' ASN . 23.8 pt20 -60.02 -29.1 68.27 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.972 176.472 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 989' ' ' LYS . . . . . 0.722 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 20.8 tttm -70.03 -39.64 75.66 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.19 172.479 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.463 ' HB3' ' O ' ' A' ' 987' ' ' ALA . 16.7 tp -50.37 -60.54 2.89 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.412 -0.813 . . . . 0.0 112.651 -179.353 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.718 HD22 ' HG ' ' A' 1035 ' ' LEU . 1.6 pt? -73.46 -22.25 60.23 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.584 0.707 . . . . 0.0 110.036 -177.862 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 992' ' ' ASN . . . . . 0.722 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 48.8 t-20 -51.94 -55.43 20.37 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 114.317 -1.311 . . . . 0.0 110.965 175.363 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 14.6 m -73.16 -31.87 64.51 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.854 -179.234 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.5 -31.73 68.94 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 119.58 -0.848 . . . . 0.0 112.059 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 0.592 ' N ' HD21 ' A' 1028 ' ' LEU . 8.3 tt -71.05 -16.65 62.61 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 122.168 -0.333 . . . . 0.0 110.227 171.187 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -76.81 -24.41 52.79 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 119.854 -0.738 . . . . 0.0 109.901 168.417 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -74.1 -42.93 59.34 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 109.144 -0.688 . . . . 0.0 109.144 171.568 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.645 HD22 HD11 ' A' 1028 ' ' LEU . 0.4 OUTLIER -55.69 -43.48 76.47 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.34 -0.846 . . . . 0.0 111.024 -179.597 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.795 HG12 HG11 ' A' ' 955' ' ' VAL . 75.5 mt -64.45 -43.94 96.98 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.957 -177.016 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 29.1 m-80 -63.8 -33.75 76.38 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.321 0.582 . . . . 0.0 111.856 -178.702 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.977 ' HD3' ' HG2' ' A' 1020 ' ' GLN . 89.7 mttt -82.55 -42.48 18.29 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.539 -174.055 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.884 ' HG2' HG21 ' A' ' 955' ' ' VAL . 0.0 OUTLIER -62.88 -25.48 68.32 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.919 0.866 . . . . 0.0 108.893 176.341 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.615 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 10.4 tptp -71.04 -54.97 9.3 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.432 -168.796 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.773 ' HB3' HD23 ' A' 1013 ' ' LEU . 80.3 mt -70.69 -14.11 62.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.343 179.242 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.76 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -70.5 -50.95 32.46 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 119.704 -0.798 . . . . 0.0 110.002 178.822 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.68 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.2 pp0? -74.11 -30.4 62.31 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.319 -0.553 . . . . 0.0 112.049 173.576 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.618 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 49.4 mt-30 -50.78 -45.42 59.11 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.524 0.678 . . . . 0.0 110.175 173.165 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.637 ' CD1' HD22 ' A' 1013 ' ' LEU . 73.3 m-85 -121.93 43.58 2.82 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.267 175.675 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1009 ' ' VAL . . . . . 1.087 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 7.7 p -51.92 -29.44 11.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-O 121.79 0.805 . . . . 0.0 110.65 173.256 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1010 ' ' MET . . . . . 0.429 ' HG3' ' OG1' ' A' 1011 ' ' THR . 24.1 ptp -69.04 -5.69 23.46 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.003 -0.999 . . . . 0.0 111.897 176.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1011 ' ' THR . . . . . 0.911 HG22 ' H ' ' A' 1012 ' ' SER . 1.2 m -141.55 -168.45 2.66 Favored 'General case' 0 C--O 1.258 1.544 0 CA-C-O 122.952 1.358 . . . . 0.0 113.98 -172.823 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1012 ' ' SER . . . . . 0.911 ' H ' HG22 ' A' 1011 ' ' THR . 15.5 m -57.72 -32.57 67.53 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 114.2 -1.364 . . . . 0.0 111.899 -175.615 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1013 ' ' LEU . . . . . 0.773 HD23 ' HB3' ' A' 1004 ' ' LEU . 7.5 mp -49.72 -43.32 47.63 Favored 'General case' 0 CA--C 1.499 -1.006 0 C-N-CA 120.425 -0.51 . . . . 0.0 112.206 172.388 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1014 ' ' GLN . . . . . 1.087 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.7 OUTLIER -56.63 -50.16 72.85 Favored 'General case' 0 N--CA 1.439 -1.016 0 C-N-CA 119.871 -0.731 . . . . 0.0 109.437 -173.533 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -71.31 -42.15 69.0 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 114.869 -1.059 . . . . 0.0 111.965 -175.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -67.12 -56.31 10.53 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.352 0.596 . . . . 0.0 111.623 179.029 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.76 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 13.8 m-85 -63.93 -33.1 74.95 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 -173.298 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.833 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 42.2 tptt -79.68 -30.8 41.24 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.453 -178.938 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1019 ' ' LYS . . . . . 0.511 ' O ' HD23 ' A' 1022 ' ' LEU . 1.1 mptm? -70.68 -51.21 29.19 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 173.152 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1020 ' ' GLN . . . . . 0.977 ' HG2' ' HD3' ' A' 1001 ' ' LYS . 8.0 tt0 -50.69 -33.56 23.24 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.761 -1.109 . . . . 0.0 111.206 165.692 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.655 ' HG3' ' HB3' ' A' 1002 ' ' MET . 1.9 tmt? -68.32 -46.82 69.21 Favored 'General case' 0 CA--C 1.512 -0.508 0 O-C-N 122.168 -0.333 . . . . 0.0 110.355 176.557 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1022 ' ' LEU . . . . . 0.682 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -80.47 -7.29 59.11 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 118.857 -1.137 . . . . 0.0 109.595 -179.28 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 84.8 m -83.93 -40.4 18.58 Favored 'General case' 0 C--N 1.333 -0.133 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 174.429 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.555 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -77.27 -21.13 54.13 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 172.233 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.814 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -85.09 -23.01 28.69 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.401 169.437 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.564 ' O ' HG23 ' A' 1030 ' ' VAL . 16.3 t60 -76.96 -24.84 52.3 Favored 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 166.26 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -73.74 -39.01 64.58 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 123.489 0.716 . . . . 0.0 109.67 165.78 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.645 HD11 HD22 ' A' ' 998' ' ' LEU . 22.7 mt -60.63 -44.34 96.48 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 168.646 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -59.99 -38.45 82.62 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 111.445 0.165 . . . . 0.0 111.445 173.154 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' 1026 ' ' HIS . 7.8 t -69.93 -50.31 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.166 0 CA-C-O 121.488 0.661 . . . . 0.0 110.071 -178.441 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.469 ' O ' HD12 ' A' 1035 ' ' LEU . 23.8 m-20 -66.63 -38.05 86.11 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 114.687 -1.142 . . . . 0.0 110.496 -178.808 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.661 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -59.76 -42.57 93.57 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.349 173.237 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 50.9 mttp -64.03 -53.14 54.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.665 0.745 . . . . 0.0 110.054 173.444 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.433 ' O ' HG23 ' A' 1038 ' ' VAL . 9.0 t30 -63.18 -52.18 63.4 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.175 -1.375 . . . . 0.0 111.813 -171.207 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.987 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 0.0 OUTLIER -65.31 -38.0 88.85 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 119.307 -0.378 . . . . 0.0 110.825 -173.204 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.721 ' N ' HD13 ' A' 1035 ' ' LEU . 4.0 pp -72.98 -35.1 66.83 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 116.951 -1.899 . . . . 0.0 109.718 -179.326 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.424 ' N ' HD12 ' A' 1036 ' ' LEU . 38.3 t70 -59.12 -42.86 91.56 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 114.988 -1.006 . . . . 0.0 109.823 174.494 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' 1034 ' ' ASN . 19.6 t -53.9 -42.3 52.77 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.706 0 CA-C-N 113.847 -1.524 . . . . 0.0 111.522 173.903 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.647 ' O ' ' HG2' ' A' 1043 ' ' ARG . 1.7 mp -79.11 -31.11 14.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 118.35 0.523 . . . . 0.0 111.387 177.466 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.435 ' HA ' ' HE ' ' A' 1043 ' ' ARG . 0.4 OUTLIER -56.83 -50.39 72.53 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.655 0.74 . . . . 0.0 109.511 169.907 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -65.61 -42.93 91.04 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.222 174.475 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.891 ' HB1' HG23 ' A' ' 980' ' ' THR . . . -52.33 -48.46 65.44 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 122.973 0.509 . . . . 0.0 112.37 -175.844 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.647 ' HG2' ' O ' ' A' 1039 ' ' ILE . 13.4 ptt180 -64.27 -47.76 78.31 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.905 -178.662 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 47.5 tp . . . . . 0 N--CA 1.469 0.498 0 C-N-CA 120.461 -0.496 . . . . 0.0 111.221 178.766 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.807 ' HB3' HG21 ' A' ' 968' ' ' THR . 11.2 tptm . . . . . 0 N--CA 1.447 -0.595 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.577 HG12 ' HB ' ' A' ' 968' ' ' THR . 14.0 m -65.86 -31.74 55.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 CA-C-O 121.045 0.45 . . . . 0.0 110.421 177.173 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.14 -23.52 51.7 Favored 'General case' 0 CA--C 1.504 -0.797 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 174.525 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.78 -25.27 48.91 Favored 'General case' 0 C--N 1.301 -1.529 0 C-N-CA 120.067 -0.653 . . . . 0.0 111.542 173.354 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.586 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 3.2 m120 -77.16 -30.34 54.96 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 174.226 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.603 HG22 HD21 ' A' ' 932' ' ' LEU . 62.6 t -79.74 -29.52 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.766 175.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.488 ' O ' ' HB3' ' A' ' 934' ' ' LYS . 84.8 m -57.8 -39.97 78.81 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 119.127 0.876 . . . . 0.0 108.642 169.043 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -72.7 -52.52 9.63 Favored Glycine 0 CA--C 1.527 0.812 0 CA-C-N 114.978 -1.01 . . . . 0.0 113.775 177.349 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.603 HD21 HG22 ' A' ' 929' ' ' VAL . 2.1 pp -63.2 -45.43 91.76 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 117.745 0.772 . . . . 0.0 112.706 -176.062 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 61.5 t -65.56 -39.44 85.06 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 CA-C-O 121.253 0.549 . . . . 0.0 110.366 -178.51 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.488 ' HB3' ' O ' ' A' ' 930' ' ' THR . 1.4 tmtt? -61.08 -35.94 78.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.942 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 0.457 ' HB1' ' SD ' ' A' ' 954' ' ' MET . . . -64.61 -41.98 95.83 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 118.129 0.422 . . . . 0.0 110.801 177.423 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.86 HG22 ' HB1' ' A' 1025 ' ' ALA . 58.0 t -47.63 -73.84 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.974 -179.485 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.416 HG13 ' N ' ' A' ' 938' ' ' GLU . 25.6 pt -65.64 -41.38 90.46 Favored 'Isoleucine or valine' 0 C--O 1.244 0.813 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -177.015 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.416 ' N ' HG13 ' A' ' 937' ' ' ILE . 36.2 tt0 -69.6 -51.89 31.01 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.588 -170.315 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 23.8 mmt -73.71 -27.18 61.08 Favored 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 119.757 -0.777 . . . . 0.0 109.371 -174.145 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.577 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 59.9 p . . . . . 0 C--N 1.343 0.288 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.429 -174.611 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.8 ' HB3' ' HG3' ' A' 1002 ' ' MET . 1.0 OUTLIER . . . . . 0 CA--C 1.536 0.43 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 0.615 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 23.8 t -53.41 -45.4 98.51 Favored Pre-proline 0 C--N 1.323 -0.563 0 C-N-CA 123.151 0.58 . . . . 0.0 111.608 171.047 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 0.615 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 38.4 Cg_exo -51.58 -39.42 65.52 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.186 1.924 . . . . 0.0 112.53 174.029 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.457 ' SD ' ' HB1' ' A' ' 935' ' ' ALA . 5.3 tpt -73.96 -36.41 64.59 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.762 175.073 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.605 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 71.2 t -52.67 -40.74 35.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.794 168.166 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.4 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 3.1 tmtm? -66.59 -33.02 74.73 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.597 175.627 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 957' ' ' GLU . . . . . 0.434 ' HB3' ' HA ' ' A' ' 954' ' ' MET . 7.0 tp10 -77.55 -45.81 24.24 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 121.002 0.429 . . . . 0.0 111.01 -174.278 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.498 HG11 HD21 ' A' ' 998' ' ' LEU . 14.6 p -87.05 -27.53 5.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.618 -178.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -63.82 -38.91 96.84 Favored Glycine 0 N--CA 1.447 -0.567 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 173.554 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 960' ' ' LEU . . . . . 0.467 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 17.0 tp -63.11 -38.26 90.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.279 -0.46 . . . . 0.0 109.893 174.264 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.463 ' HB1' ' HB3' ' A' ' 932' ' ' LEU . . . -70.3 -40.76 74.06 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.706 -176.154 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.596 HD13 HD12 ' A' ' 991' ' ' LEU . 0.2 OUTLIER -67.74 -44.16 78.23 Favored 'General case' 0 C--O 1.217 -0.644 0 CA-C-O 118.782 -0.627 . . . . 0.0 111.437 173.423 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.467 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 6.1 ptp180 -64.85 -31.68 73.03 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 120.187 1.358 . . . . 0.0 110.457 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 964' ' ' THR . . . . . 0.483 HG22 ' ND2' ' A' ' 928' ' ' ASN . 30.4 m -69.33 -39.11 78.39 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 176.602 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 1.0 HD11 HD21 ' A' 1036 ' ' LEU . 37.5 tp -62.79 -44.11 97.04 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.559 -1.2 . . . . 0.0 109.949 175.179 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 0.745 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.5 tt -68.2 -35.22 77.66 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.318 -0.856 . . . . 0.0 109.119 -172.861 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -69.81 -43.48 71.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.815 178.322 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.807 HG21 ' HB3' ' A' ' 924' ' ' LYS . 4.6 m -64.41 -41.11 96.8 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 119.843 -0.743 . . . . 0.0 110.134 178.321 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.736 HG12 HG23 ' A' ' 984' ' ' ILE . 43.6 t -67.65 -38.09 79.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.178 173.473 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 970' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -66.73 -38.61 87.01 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 122.21 1.005 . . . . 0.0 108.696 -178.325 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.448 ' C ' ' HD2' ' A' ' 974' ' ' PRO . 28.1 tt0 -76.01 -21.94 56.34 Favored 'General case' 0 N--CA 1.437 -1.106 0 CA-C-N 113.964 -1.471 . . . . 0.0 110.128 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.588 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 52.7 m -72.08 -17.67 61.98 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.708 171.651 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.828 ' HA ' HD13 ' A' ' 984' ' ' ILE . 9.4 tt -66.04 -51.0 48.95 Favored Pre-proline 0 CA--C 1.53 0.176 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 179.736 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.536 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 95.0 Cg_endo -81.97 -2.44 11.3 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 120.964 1.109 . . . . 0.0 113.546 171.926 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.588 ' HB ' ' HA ' ' A' ' 972' ' ' SER . 0.3 OUTLIER . . . . . 0 CA--C 1.537 0.464 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.691 178.351 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.498 HG23 ' CB ' ' A' 1042 ' ' ALA . 15.8 m . . . . . 0 CA--C 1.542 0.668 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.656 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 0.3 OUTLIER -51.82 -34.85 42.12 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -175.542 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -82.22 -21.03 36.56 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.116 0.871 . . . . 0.0 111.94 -171.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.586 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 0.4 OUTLIER -77.77 -33.81 52.55 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.386 0.612 . . . . 0.0 109.723 169.615 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.838 HG12 HG12 ' A' 1039 ' ' ILE . 69.3 mt -70.8 -30.28 41.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 CA-C-N 114.889 -1.05 . . . . 0.0 108.469 179.319 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 985' ' ' GLU . . . . . 0.656 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 45.9 mt-10 -63.97 -54.47 34.01 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.302 174.729 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 986' ' ' MET . . . . . 0.577 ' HA ' ' HD2' ' A' ' 989' ' ' LYS . 75.2 mtp -70.61 -41.52 72.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.789 -170.736 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.953 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -65.24 -50.81 64.38 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.19 -0.914 . . . . 0.0 112.167 -173.713 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.745 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 24.5 pt20 -61.83 -28.2 69.31 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 120.452 -0.499 . . . . 0.0 111.074 178.528 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 989' ' ' LYS . . . . . 0.662 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 55.9 mttm -70.0 -43.42 71.45 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.449 0.643 . . . . 0.0 111.182 173.418 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.708 HD23 ' HB3' ' A' 1035 ' ' LEU . 7.7 tp -50.52 -60.08 3.38 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 114.694 -1.139 . . . . 0.0 112.539 -176.647 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.625 ' HB2' ' CD2' ' A' 1035 ' ' LEU . 0.4 OUTLIER -63.9 -33.49 75.83 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 121.398 0.618 . . . . 0.0 109.401 179.643 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 992' ' ' ASN . . . . . 0.662 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 44.7 t-20 -52.44 -51.89 56.88 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.584 -1.189 . . . . 0.0 110.546 177.814 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 993' ' ' SER . . . . . 0.489 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 32.7 t -75.01 -42.44 57.4 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.464 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.54 -36.31 80.23 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.971 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 0.639 ' HG ' HD23 ' A' ' 998' ' ' LEU . 8.1 tt -73.18 -19.75 61.04 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 122.198 -0.314 . . . . 0.0 110.617 172.902 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -75.0 -25.55 58.9 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 119.841 -0.744 . . . . 0.0 109.788 168.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.56 ' O ' ' HG2' ' A' 1001 ' ' LYS . 4.6 mm-40 -75.43 -40.16 57.98 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 172.15 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.826 HD13 ' HB2' ' A' 1025 ' ' ALA . 0.2 OUTLIER -56.18 -47.01 79.13 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.325 177.917 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.525 HG13 ' O ' ' A' ' 995' ' ' LEU . 95.8 mt -64.73 -42.12 94.1 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.575 -174.545 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 14.5 m-80 -59.49 -39.41 83.69 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.345 0.593 . . . . 0.0 111.856 -178.677 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.56 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 69.5 mmtt -77.96 -37.61 47.12 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 122.097 0.951 . . . . 0.0 108.739 -177.028 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.878 ' HB2' ' HG3' ' A' 1021 ' ' MET . 1.7 ttp -61.64 -28.71 69.57 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 114.061 -1.427 . . . . 0.0 109.179 175.84 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.47 ' O ' ' HG3' ' A' 1006 ' ' GLN . 2.9 tptm -73.76 -47.03 42.03 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.948 -167.661 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.872 HD13 ' HG3' ' A' 1007 ' ' GLN . 3.8 mm? -77.5 -13.56 59.89 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.102 179.609 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.834 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -75.38 -32.21 60.72 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 119.443 -0.903 . . . . 0.0 110.61 -177.853 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.719 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 5.2 pp0? -75.13 -33.27 61.54 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 118.867 -0.587 . . . . 0.0 110.961 165.406 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.872 ' HG3' HD13 ' A' 1004 ' ' LEU . 13.7 mm100 -48.33 -44.12 33.88 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.126 0.488 . . . . 0.0 110.497 176.245 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.884 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 28.6 m-85 -130.01 47.4 2.51 Favored 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 120.014 -0.674 . . . . 0.0 111.074 170.027 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1009 ' ' VAL . . . . . 1.029 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 7.2 p -50.95 -24.47 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 CA-C-O 121.945 0.878 . . . . 0.0 109.599 167.293 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 16.4 mmt -48.68 -44.6 38.05 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 113.838 -1.528 . . . . 0.0 110.922 175.575 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1011 ' ' THR . . . . . . . . . . . . . 2.6 p -154.98 -101.9 0.04 OUTLIER 'General case' 0 C--O 1.251 1.182 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 -177.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 16.4 p -57.67 -64.02 1.04 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-N 114.552 -1.204 . . . . 0.0 112.881 -164.73 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1013 ' ' LEU . . . . . 0.884 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 4.6 mp -45.99 -42.94 13.75 Favored 'General case' 0 CA--C 1.5 -0.98 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1014 ' ' GLN . . . . . 1.029 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 1.0 OUTLIER -55.03 -47.77 74.29 Favored 'General case' 0 N--CA 1.438 -1.042 0 O-C-N 123.866 0.729 . . . . 0.0 110.345 -168.499 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A 1015 ' ' GLN . . . . . 0.614 ' O ' ' HD3' ' A' 1019 ' ' LYS . 97.8 mt-30 -69.37 -51.57 35.42 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.08 -177.458 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -64.35 -48.0 77.19 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.36 0.6 . . . . 0.0 111.188 -176.559 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.834 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 7.2 m-85 -68.24 -37.52 80.87 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.258 -0.883 . . . . 0.0 113.139 -173.393 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.6 ' HD3' ' CE2' ' A' ' 951' ' ' TYR . 47.1 tptt -80.96 -28.42 35.68 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.3 -176.727 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1019 ' ' LYS . . . . . 0.614 ' HD3' ' O ' ' A' 1015 ' ' GLN . 5.6 mptp? -73.32 -53.27 11.21 Favored 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 174.091 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1020 ' ' GLN . . . . . 0.478 ' HG2' ' HG3' ' A' 1001 ' ' LYS . 55.6 tt0 -50.56 -32.01 17.35 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.809 164.467 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.878 ' HG3' ' HB2' ' A' 1002 ' ' MET . 2.4 ttp -68.69 -50.66 49.18 Favored 'General case' 0 CA--C 1.514 -0.417 0 O-C-N 122.333 -0.23 . . . . 0.0 110.621 176.892 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1022 ' ' LEU . . . . . 0.762 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -84.9 -9.41 58.13 Favored 'General case' 0 C--O 1.219 -0.553 0 C-N-CA 119.629 -0.829 . . . . 0.0 110.317 -174.035 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 52.4 m -83.34 -34.8 25.57 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 171.409 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.53 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -78.28 -21.85 49.14 Favored 'General case' 0 C--O 1.223 -0.319 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 171.018 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.86 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -85.64 -23.38 27.52 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.176 170.187 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.582 ' O ' HG23 ' A' 1030 ' ' VAL . 46.9 t-80 -75.77 -24.58 56.03 Favored 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 165.345 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1027 ' ' ALA . . . . . 0.53 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -70.68 -38.88 73.78 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 123.53 0.732 . . . . 0.0 109.654 164.236 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.635 HD11 HD22 ' A' ' 998' ' ' LEU . 21.6 mt -60.95 -47.21 87.49 Favored 'General case' 0 C--N 1.314 -0.939 0 C-N-CA 120.191 -0.604 . . . . 0.0 109.495 169.681 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -57.74 -40.92 80.79 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 111.366 0.135 . . . . 0.0 111.366 173.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.582 HG23 ' O ' ' A' 1026 ' ' HIS . 16.1 t -70.18 -52.17 32.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-O 121.232 0.539 . . . . 0.0 110.711 -177.093 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.74 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 5.7 m-20 -77.27 -29.14 53.75 Favored 'General case' 0 C--O 1.214 -0.783 0 CA-C-N 115.441 -0.8 . . . . 0.0 112.746 -174.696 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.594 ' O ' ' HG ' ' A' 1036 ' ' LEU . . . -66.51 -32.68 74.18 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 170.105 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.503 ' HB3' ' O ' ' A' 1030 ' ' VAL . 22.9 tttm -64.96 -51.24 62.88 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 122.078 0.942 . . . . 0.0 109.098 168.102 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.74 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 32.4 t30 -61.58 -52.11 65.75 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 113.396 -1.729 . . . . 0.0 112.572 -173.399 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.953 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 1.5 pp -62.45 -37.95 87.89 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 118.941 -0.552 . . . . 0.0 110.23 -176.187 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1036 ' ' LEU . . . . . 1.0 HD21 HD11 ' A' ' 965' ' ' LEU . 19.9 mt -66.95 -45.86 76.48 Favored 'General case' 0 C--O 1.224 -0.279 0 C-N-CA 116.809 -1.956 . . . . 0.0 108.785 176.795 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.484 ' HB3' ' O ' ' A' 1034 ' ' ASN . 28.3 t70 -50.19 -40.79 48.07 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 114.46 -1.245 . . . . 0.0 111.038 175.273 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.522 ' HB ' ' O ' ' A' 1035 ' ' LEU . 24.2 t -53.33 -51.09 43.84 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.692 0 CA-C-N 114.267 -1.333 . . . . 0.0 111.66 173.015 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.838 HG12 HG12 ' A' ' 984' ' ' ILE . 3.0 mp -72.4 -33.08 44.58 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.428 0 CA-C-N 118.917 0.78 . . . . 0.0 110.738 176.792 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.469 ' O ' ' HG3' ' A' 1043 ' ' ARG . 90.1 m-20 -52.88 -52.59 56.92 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 122.317 1.056 . . . . 0.0 109.343 173.533 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -75.61 -35.72 60.45 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.524 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.654 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -53.96 -50.05 67.37 Favored 'General case' 0 CA--C 1.499 -0.994 0 C-N-CA 123.465 0.706 . . . . 0.0 111.998 -178.79 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.703 ' HD3' ' N ' ' A' 1044 ' ' LEU . 0.1 OUTLIER -62.2 -41.09 98.04 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -177.394 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A 1044 ' ' LEU . . . . . 0.703 ' N ' ' HD3' ' A' 1043 ' ' ARG . 50.7 tp . . . . . 0 CA--C 1.534 0.353 0 CA-C-O 121.52 0.676 . . . . 0.0 110.319 -177.559 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.571 ' HB2' HG21 ' A' ' 968' ' ' THR . 68.2 mmtt . . . . . 0 N--CA 1.456 -0.128 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.61 ' O ' HG23 ' A' ' 929' ' ' VAL . 34.0 m -57.51 -32.52 41.99 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.36 0 CA-C-O 121.164 0.507 . . . . 0.0 110.494 175.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.56 -41.72 60.04 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.337 -179.738 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 927' ' ' GLU . . . . . 0.475 ' HG2' ' HA ' ' A' ' 924' ' ' LYS . 10.8 pt-20 -76.59 -25.6 54.12 Favored 'General case' 0 C--N 1.317 -0.807 0 C-N-CA 119.175 -1.01 . . . . 0.0 111.342 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -66.17 -28.59 68.89 Favored 'General case' 0 C--N 1.319 -0.754 0 O-C-N 121.651 -0.655 . . . . 0.0 110.346 167.528 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.616 HG22 ' HB1' ' A' 1032 ' ' ALA . 69.2 t -79.23 -34.9 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.312 172.535 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.466 HG22 ' O ' ' A' ' 927' ' ' GLU . 1.3 t -67.99 -30.43 69.69 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 120.369 1.44 . . . . 0.0 108.275 173.151 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -73.17 -53.11 8.02 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-N 115.398 -0.819 . . . . 0.0 113.084 174.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.456 ' CD2' ' HA ' ' A' ' 929' ' ' VAL . 0.9 OUTLIER -65.79 -49.69 67.4 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -178.414 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.421 ' O ' ' HB ' ' A' ' 936' ' ' VAL . 72.6 t -68.59 -32.39 54.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 CA-C-O 121.185 0.517 . . . . 0.0 110.733 -174.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 934' ' ' LYS . . . . . . . . . . . . . 24.7 ttpt -61.99 -45.96 91.33 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.084 176.774 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 0.462 ' O ' ' HB2' ' A' ' 939' ' ' MET . . . -56.38 -35.33 67.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.464 0.173 . . . . 0.0 111.366 176.557 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.856 HG22 ' HB1' ' A' 1025 ' ' ALA . 57.8 t -52.79 -74.95 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.696 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 23.5 pt -74.74 -42.64 47.55 Favored 'Isoleucine or valine' 0 C--O 1.245 0.851 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -175.741 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -64.9 -51.41 62.06 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.383 0.611 . . . . 0.0 109.99 -171.409 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.462 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 65.4 mtt -73.55 -25.49 60.41 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.254 -178.211 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.748 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 32.6 p . . . . . 0 C--N 1.347 0.468 0 O-C-N 123.797 0.686 . . . . 0.0 111.346 -173.64 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.959 ' HB3' ' HG3' ' A' 1002 ' ' MET . 20.2 m-85 . . . . . 0 N--CA 1.469 0.504 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 0.802 ' O ' ' HB ' ' A' ' 955' ' ' VAL . 25.3 t -63.49 -48.4 81.51 Favored Pre-proline 0 C--N 1.324 -0.511 0 O-C-N 122.49 -0.131 . . . . 0.0 110.863 178.604 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 0.679 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 25.7 Cg_exo -50.6 -40.0 55.47 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 121.928 1.752 . . . . 0.0 112.806 166.808 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.402 ' O ' HG12 ' A' ' 958' ' ' VAL . 36.9 ttm -67.33 -31.92 72.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.034 0.445 . . . . 0.0 110.235 175.752 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.802 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 49.7 t -52.59 -39.12 28.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.087 168.927 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.632 ' HD3' ' HA ' ' A' ' 953' ' ' PRO . 12.8 mptt -64.82 -36.4 84.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.592 0.234 . . . . 0.0 111.293 172.799 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -78.87 -46.93 17.53 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.768 0.318 . . . . 0.0 111.773 -172.404 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.6 HG22 HD23 ' A' ' 962' ' ' LEU . 14.5 p -80.75 -32.01 12.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 179.214 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -59.72 -42.84 98.13 Favored Glycine 0 N--CA 1.446 -0.674 0 N-CA-C 110.719 -0.953 . . . . 0.0 110.719 174.134 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 960' ' ' LEU . . . . . 0.569 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 7.7 tt -67.39 -41.35 85.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.822 0.344 . . . . 0.0 110.305 177.519 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -66.97 -43.45 83.05 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.063 0.459 . . . . 0.0 111.689 -174.647 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.774 HD13 HD22 ' A' ' 995' ' ' LEU . 4.0 pp -84.94 -26.47 27.18 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.01 -178.674 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.613 ' HG3' ' N ' ' A' ' 964' ' ' THR . 8.6 ptt180 -66.82 -39.08 87.56 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 118.656 -1.218 . . . . 0.0 109.606 171.149 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 964' ' ' THR . . . . . 0.613 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 12.5 m -64.67 -31.51 72.76 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.742 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.724 HD23 HD22 ' A' ' 991' ' ' LEU . 54.2 tp -63.44 -51.43 65.75 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 121.561 0.695 . . . . 0.0 109.541 173.436 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 0.758 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.3 tt -63.36 -37.81 88.73 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 114.52 -1.218 . . . . 0.0 109.081 -175.114 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 967' ' ' ALA . . . . . 0.493 ' HA ' ' HB3' ' A' ' 970' ' ' ASP . . . -74.37 -28.66 61.22 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.667 179.545 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.571 HG21 ' HB2' ' A' ' 924' ' ' LYS . 31.4 m -72.0 -32.53 67.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 119.19 0.905 . . . . 0.0 109.214 171.759 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.667 HG12 HG23 ' A' ' 984' ' ' ILE . 71.3 t -71.35 -40.1 72.79 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.166 171.899 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.493 ' HB3' ' HA ' ' A' ' 967' ' ' ALA . 24.8 t70 -69.23 -38.65 78.63 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 122.033 0.921 . . . . 0.0 108.572 -179.587 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.645 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 6.8 tp10 -63.78 -35.34 80.26 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.583 174.398 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.443 ' HB2' ' O ' ' A' ' 969' ' ' VAL . 64.8 m -64.9 -17.93 64.75 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.12 174.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.76 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 2.4 tm? -66.18 -53.07 34.78 Favored Pre-proline 0 CA--C 1.537 0.456 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -176.51 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.76 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 94.0 Cg_endo -91.31 -19.31 0.88 Allowed 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 121.236 1.291 . . . . 0.0 114.23 174.275 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 975' ' ' VAL . . . . . . . . . . . . . 3.4 t . . . . . 0 N--CA 1.466 0.356 0 CA-C-N 118.019 0.372 . . . . 0.0 110.666 177.947 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.84 HG23 ' HB1' ' A' 1042 ' ' ALA . 55.1 m . . . . . 0 CA--C 1.532 0.25 0 CA-C-O 121.366 0.603 . . . . 0.0 110.1 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.499 ' HA ' HD12 ' A' ' 984' ' ' ILE . 0.3 OUTLIER -52.56 -25.7 11.23 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 114.816 -1.083 . . . . 0.0 113.825 -176.73 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 982' ' ' ARG . . . . . 0.669 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 0.0 OUTLIER -84.37 -20.16 32.42 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.396 -0.815 . . . . 0.0 111.6 -177.409 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.558 ' CB ' ' HB2' ' A' 1042 ' ' ALA . 0.3 OUTLIER -78.5 -34.96 47.04 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.808 0.813 . . . . 0.0 109.157 168.912 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.667 HG23 HG12 ' A' ' 969' ' ' VAL . 70.4 mt -69.58 -30.13 44.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 114.459 -1.246 . . . . 0.0 109.31 179.459 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 985' ' ' GLU . . . . . 0.669 ' HG3' ' O ' ' A' ' 982' ' ' ARG . 2.4 pp20? -70.37 -44.01 68.95 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 121.494 0.664 . . . . 0.0 109.923 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 24.9 ttt -72.09 -42.78 65.76 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.474 -173.196 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.95 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -74.44 -51.77 13.94 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.984 -1.007 . . . . 0.0 112.488 -170.31 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.758 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 28.9 pt20 -61.87 -23.15 66.11 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.277 177.187 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 989' ' ' LYS . . . . . 0.8 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 15.1 tttt -73.07 -37.24 66.87 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.887 171.654 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.632 HD23 ' OD1' ' A' 1031 ' ' ASP . 15.7 tp -60.37 -57.73 11.5 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 119.616 -0.833 . . . . 0.0 111.89 179.128 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.724 HD22 HD23 ' A' ' 965' ' ' LEU . 11.6 tp -53.42 -33.95 55.93 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.475 0.655 . . . . 0.0 110.162 175.808 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 992' ' ' ASN . . . . . 0.8 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 24.6 t-20 -50.04 -53.84 24.22 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.065 -1.425 . . . . 0.0 111.426 -179.417 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 20.0 m -79.57 -26.79 41.27 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 179.493 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.64 -44.03 75.02 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.569 -0.852 . . . . 0.0 111.011 178.453 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 0.774 HD22 HD13 ' A' ' 962' ' ' LEU . 0.8 OUTLIER -66.02 -21.93 66.42 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 123.179 0.591 . . . . 0.0 110.478 172.405 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -75.91 -26.16 56.7 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 119.171 -1.012 . . . . 0.0 110.009 171.689 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -75.38 -43.38 50.59 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 171.418 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.887 HD22 HD11 ' A' 1028 ' ' LEU . 0.1 OUTLIER -56.37 -48.1 77.54 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.316 -0.857 . . . . 0.0 111.742 -177.683 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.74 HD12 HG13 ' A' ' 955' ' ' VAL . 47.5 mm -69.65 -37.76 74.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.455 -175.018 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 11.7 m-80 -63.66 -36.1 82.73 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 121.126 0.489 . . . . 0.0 111.83 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.586 ' HD3' ' HB3' ' A' 1020 ' ' GLN . 35.2 mttp -82.47 -35.34 27.56 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.477 0.656 . . . . 0.0 110.453 -176.499 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.959 ' HG3' ' HB3' ' A' ' 951' ' ' TYR . 15.2 tpp -60.42 -29.45 69.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 122.423 1.106 . . . . 0.0 108.514 173.406 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1003 ' ' LYS . . . . . . . . . . . . . 2.7 tptm -73.69 -52.66 12.54 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 113.865 -1.516 . . . . 0.0 111.04 -167.02 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.733 ' HA ' ' HB2' ' A' 1007 ' ' GLN . 7.8 mp -76.8 -13.43 60.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.731 -178.393 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.737 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -69.12 -44.58 72.08 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 119.317 -0.953 . . . . 0.0 109.434 179.348 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.78 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 2.9 pp0? -71.86 -34.03 68.89 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 120.127 -0.629 . . . . 0.0 111.435 170.134 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.733 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 51.8 mt-30 -47.14 -48.95 23.19 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.993 0.425 . . . . 0.0 110.901 176.838 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.832 ' HB2' HD13 ' A' 1013 ' ' LEU . 89.0 m-85 -125.15 47.75 2.12 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.191 -0.603 . . . . 0.0 110.529 171.465 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1009 ' ' VAL . . . . . 1.038 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 12.5 p -51.76 -22.04 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 115.087 -0.961 . . . . 0.0 110.434 171.366 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1010 ' ' MET . . . . . 0.469 ' O ' HG23 ' A' 1011 ' ' THR . 22.7 mmt -41.67 -36.61 1.0 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.402 -1.272 . . . . 0.0 111.961 176.117 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1011 ' ' THR . . . . . 0.469 HG23 ' O ' ' A' 1010 ' ' MET . 0.2 OUTLIER -167.7 -92.42 0.01 OUTLIER 'General case' 0 C--O 1.246 0.911 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 176.522 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 12.2 m -53.1 -64.62 0.76 Allowed 'General case' 0 C--O 1.237 0.408 0 CA-C-N 114.571 -1.195 . . . . 0.0 113.311 -164.668 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1013 ' ' LEU . . . . . 0.832 HD13 ' HB2' ' A' 1008 ' ' TYR . 4.1 mp -52.7 -40.28 62.81 Favored 'General case' 0 CA--C 1.496 -1.099 0 O-C-N 123.25 0.343 . . . . 0.0 111.365 -177.714 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1014 ' ' GLN . . . . . 1.038 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 1.3 tt0 -54.09 -48.33 70.8 Favored 'General case' 0 N--CA 1.44 -0.93 0 O-C-N 123.639 0.587 . . . . 0.0 110.506 -168.206 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1015 ' ' GLN . . . . . 0.539 ' O ' ' HD3' ' A' 1019 ' ' LYS . 92.7 mt-30 -71.39 -47.92 53.18 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 120.343 -0.543 . . . . 0.0 111.605 -179.076 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -67.5 -56.33 9.98 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.148 0.499 . . . . 0.0 111.25 -176.495 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.737 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 10.3 m-85 -56.46 -38.6 71.89 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.283 -177.148 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.915 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 22.9 tptm -80.01 -30.89 39.68 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 114.865 -1.061 . . . . 0.0 110.808 -177.194 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1019 ' ' LYS . . . . . 0.539 ' HD3' ' O ' ' A' 1015 ' ' GLN . 1.6 mptm? -70.87 -52.88 17.52 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 174.302 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1020 ' ' GLN . . . . . 0.586 ' HB3' ' HD3' ' A' 1001 ' ' LYS . 98.2 mt-30 -50.79 -32.86 21.21 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.107 164.792 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.49 ' SD ' HD12 ' A' ' 998' ' ' LEU . 10.7 tmm? -65.73 -50.73 63.74 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 177.398 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1022 ' ' LEU . . . . . 0.77 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -81.08 -5.01 57.14 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 119.301 -0.96 . . . . 0.0 109.707 -177.023 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 87.4 m -88.21 -35.9 17.08 Favored 'General case' 0 C--O 1.223 -0.306 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 173.572 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.555 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -77.76 -21.73 51.31 Favored 'General case' 0 C--O 1.22 -0.478 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 170.705 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.856 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -85.34 -24.09 27.77 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.368 169.139 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.614 ' O ' HG23 ' A' 1030 ' ' VAL . 28.4 t60 -76.97 -24.14 52.3 Favored 'General case' 0 C--O 1.215 -0.743 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 166.095 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1027 ' ' ALA . . . . . 0.459 ' HA ' ' HB ' ' A' 1030 ' ' VAL . . . -73.23 -39.81 65.18 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 123.88 0.872 . . . . 0.0 109.875 165.068 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.887 HD11 HD22 ' A' ' 998' ' ' LEU . 39.7 mt -59.68 -45.11 93.07 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 168.237 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -61.45 -34.88 76.17 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.592 0.234 . . . . 0.0 111.41 173.492 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.614 HG23 ' O ' ' A' 1026 ' ' HIS . 4.3 t -66.85 -50.33 66.16 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -179.49 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.773 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 34.2 t70 -74.55 -28.4 60.94 Favored 'General case' 0 C--O 1.206 -1.212 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.424 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.616 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -55.16 -45.59 75.71 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 171.629 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.426 ' O ' ' HB2' ' A' 1037 ' ' ASP . 78.0 tttt -67.82 -40.7 83.76 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.421 174.003 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.773 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 7.0 t30 -77.96 -56.1 4.76 Favored 'General case' 0 C--O 1.221 -0.444 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.176 -170.353 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.95 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 0.2 OUTLIER -61.37 -39.99 92.69 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 118.978 -0.534 . . . . 0.0 110.654 -175.025 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.653 HD13 ' N ' ' A' 1037 ' ' ASP . 0.0 OUTLIER -72.94 -29.57 63.2 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 116.029 -2.268 . . . . 0.0 109.644 -179.372 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.653 ' N ' HD13 ' A' 1036 ' ' LEU . 15.2 t70 -63.03 -41.92 99.65 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-O 122.116 0.96 . . . . 0.0 109.314 174.349 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' 1034 ' ' ASN . 36.3 t -59.95 -45.48 95.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 113.764 -1.562 . . . . 0.0 111.591 177.585 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.658 HD11 ' HA ' ' A' ' 984' ' ' ILE . 2.0 mp -72.79 -31.63 37.28 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 C-N-CA 119.972 -0.691 . . . . 0.0 110.917 174.064 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 1.7 t0 -58.54 -46.34 87.03 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.317 0.579 . . . . 0.0 109.746 170.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1041 ' ' GLN . . . . . 0.486 ' HG3' ' O ' ' A' 1037 ' ' ASP . 78.2 mt-30 -60.36 -49.43 77.61 Favored 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 173.671 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.84 ' HB1' HG23 ' A' ' 980' ' ' THR . . . -54.2 -52.27 61.77 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 114.279 -1.328 . . . . 0.0 113.353 -173.146 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.607 ' HD3' ' N ' ' A' 1044 ' ' LEU . 0.0 OUTLIER -64.07 -41.24 97.4 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 -176.2 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A 1044 ' ' LEU . . . . . 0.607 ' N ' ' HD3' ' A' 1043 ' ' ARG . 3.0 tm? . . . . . 0 N--CA 1.44 -0.94 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 -177.275 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.488 ' HB2' HG21 ' A' ' 968' ' ' THR . 27.8 mmtp . . . . . 0 CA--C 1.531 0.231 0 N-CA-C 112.605 0.595 . . . . 0.0 112.605 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.885 ' HA ' HD21 ' A' ' 928' ' ' ASN . 16.3 m -65.87 -28.76 44.86 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.394 0 CA-C-O 120.96 0.41 . . . . 0.0 110.575 178.237 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -78.71 -31.76 46.64 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.814 172.326 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -77.08 -24.14 51.89 Favored 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 118.837 -1.145 . . . . 0.0 113.528 -177.475 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.885 HD21 ' HA ' ' A' ' 925' ' ' VAL . 8.8 p30 -70.75 -45.8 64.14 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 118.388 -1.325 . . . . 0.0 109.106 166.861 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.626 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 98.3 t -53.04 -33.84 20.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 N-CA-C 113.809 1.041 . . . . 0.0 113.809 171.031 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 930' ' ' THR . . . . . . . . . . . . . 33.1 m -62.05 -43.42 98.88 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 119.884 1.22 . . . . 0.0 108.836 174.438 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -67.8 -51.73 33.49 Favored Glycine 0 CA--C 1.53 1.025 0 CA-C-N 114.65 -1.159 . . . . 0.0 113.574 175.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.626 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.8 pp -65.66 -49.13 69.76 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -174.253 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.455 HG23 HG13 ' A' ' 929' ' ' VAL . 53.3 t -65.89 -37.97 81.07 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.417 0 CA-C-O 121.101 0.477 . . . . 0.0 110.466 -176.007 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.55 ' HD2' ' C ' ' A' ' 934' ' ' LYS . 4.1 tmmm? -58.51 -41.01 84.44 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.99 178.162 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -67.45 -31.69 72.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.804 0.335 . . . . 0.0 111.498 -179.135 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.762 HG22 ' HB1' ' A' 1025 ' ' ALA . 80.2 t -54.45 -65.92 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.052 178.502 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 25.6 pt -70.24 -39.33 76.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.414 -178.392 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -65.51 -52.21 54.34 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 120.194 -0.602 . . . . 0.0 110.451 -173.577 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -70.52 -24.97 62.92 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.462 -176.286 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.548 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 28.7 p . . . . . 0 N--CA 1.454 -0.253 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.737 -171.946 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.799 ' CE1' ' HD3' ' A' 1018 ' ' LYS . 30.9 m-85 . . . . . 0 C--O 1.217 -0.617 0 N-CA-C 114.544 1.312 . . . . 0.0 114.544 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 0.601 ' HA ' ' CG2' ' A' ' 955' ' ' VAL . 46.9 t -53.15 -45.38 98.3 Favored Pre-proline 0 C--N 1.319 -0.737 0 C-N-CA 122.944 0.497 . . . . 0.0 111.256 170.723 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 0.599 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 48.8 Cg_exo -51.53 -38.31 64.32 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 122.071 1.847 . . . . 0.0 112.078 172.557 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.436 ' O ' HG12 ' A' ' 958' ' ' VAL . 7.0 tpt -77.45 -32.48 54.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.076 -0.966 . . . . 0.0 110.644 175.624 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.65 HG22 ' SD ' ' A' 1002 ' ' MET . 88.9 t -52.92 -38.71 29.42 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 167.843 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.546 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 12.4 tmtt? -66.87 -35.48 80.11 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.451 175.346 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -78.66 -46.79 18.36 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -177.014 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.527 ' O ' ' HG ' ' A' ' 962' ' ' LEU . 11.2 p -83.58 -30.36 7.92 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.365 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.299 -178.311 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -61.09 -38.89 96.31 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 110.617 -0.993 . . . . 0.0 110.617 174.321 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 960' ' ' LEU . . . . . 0.581 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 9.4 tt -70.15 -36.41 74.72 Favored 'General case' 0 C--O 1.223 -0.296 0 CA-C-O 120.935 0.397 . . . . 0.0 110.146 177.297 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.577 ' O ' ' HB2' ' A' ' 928' ' ' ASN . . . -72.68 -42.56 64.12 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.152 0.501 . . . . 0.0 111.523 -176.504 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 1.05 HD13 HD22 ' A' ' 995' ' ' LEU . 4.1 pp -81.5 -24.63 36.57 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.466 -179.167 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.581 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 4.9 ptp180 -73.73 -31.04 63.18 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 119.159 -1.017 . . . . 0.0 109.934 168.853 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 964' ' ' THR . . . . . 0.402 HG22 ' HB3' ' A' ' 928' ' ' ASN . 93.1 m -62.86 -32.52 73.77 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 174.025 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.996 HD23 HD22 ' A' ' 991' ' ' LEU . 63.5 tp -65.46 -55.66 16.7 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.235 174.055 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 0.534 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 9.5 tt -55.54 -41.18 72.86 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 114.199 -1.364 . . . . 0.0 109.901 -175.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -72.43 -36.74 68.65 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.289 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.488 HG21 ' HB2' ' A' ' 924' ' ' LYS . 22.2 m -66.29 -42.04 88.95 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.446 176.203 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.733 HG12 HG23 ' A' ' 984' ' ' ILE . 18.0 t -73.22 -33.55 41.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.929 178.412 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.651 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 7.6 t70 -68.16 -42.46 80.02 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 122.087 0.946 . . . . 0.0 108.815 178.835 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.658 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 31.9 tt0 -69.82 -29.86 67.23 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-N 114.082 -1.417 . . . . 0.0 109.874 178.114 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 73.2 m -67.21 -17.66 64.91 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.664 174.453 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.701 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 10.2 tt -68.64 -51.69 21.14 Favored Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 121.064 -0.254 . . . . 0.0 110.39 -178.787 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.701 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 2.6 Cg_endo -84.95 -27.62 1.16 Allowed 'Trans proline' 0 C--N 1.359 1.08 0 C-N-CA 121.771 1.647 . . . . 0.0 114.206 174.697 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 975' ' ' VAL . . . . . . . . . . . . . 52.3 t . . . . . 0 N--CA 1.468 0.44 0 O-C-N 122.155 -0.341 . . . . 0.0 111.376 -177.041 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.7 HG23 ' HB1' ' A' 1042 ' ' ALA . 74.7 m . . . . . 0 CA--C 1.536 0.43 0 CA-C-O 121.595 0.712 . . . . 0.0 109.184 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.574 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 1.7 p80 -48.88 -35.28 14.4 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 114.214 -1.357 . . . . 0.0 114.563 -174.367 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 982' ' ' ARG . . . . . 0.402 ' HA ' ' OE2' ' A' ' 985' ' ' GLU . 3.8 ptp180 -78.96 -19.33 51.96 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 118.867 0.758 . . . . 0.0 111.062 -169.268 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.57 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 0.0 OUTLIER -76.52 -37.94 55.93 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 120.401 -0.52 . . . . 0.0 109.865 171.928 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.803 HG13 HG12 ' A' 1039 ' ' ILE . 3.6 mp -66.51 -35.75 75.63 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.486 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 175.854 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 985' ' ' GLU . . . . . 0.574 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 40.5 mt-10 -56.99 -52.88 63.51 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.598 178.428 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 89.9 mtp -70.57 -39.88 73.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.478 -174.018 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.997 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -76.9 -52.41 9.5 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.868 -1.06 . . . . 0.0 112.792 -169.695 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.534 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 27.0 pt20 -64.32 -24.88 67.8 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 121.6 0.714 . . . . 0.0 109.498 179.32 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 989' ' ' LYS . . . . . 0.798 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 31.7 tttm -73.39 -38.87 65.49 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.748 -1.115 . . . . 0.0 111.742 172.558 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.5 ' HG ' ' OD2' ' A' 1031 ' ' ASP . 17.1 tp -57.39 -58.27 9.02 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.423 -0.511 . . . . 0.0 112.275 178.277 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.996 HD22 HD23 ' A' ' 965' ' ' LEU . 13.6 tp -55.03 -34.45 63.52 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-O 121.365 0.602 . . . . 0.0 110.085 175.784 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 992' ' ' ASN . . . . . 0.798 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 24.7 t-20 -48.47 -53.21 18.8 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.197 -1.365 . . . . 0.0 111.606 -178.163 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 6.5 p -77.6 -29.95 52.2 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 120.591 -0.443 . . . . 0.0 112.131 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 994' ' ' ASP . . . . . 0.438 ' O ' ' HB2' ' A' ' 997' ' ' GLU . 0.9 OUTLIER -69.76 -39.04 76.95 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 119.646 -0.822 . . . . 0.0 110.741 -179.866 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 1.05 HD22 HD13 ' A' ' 962' ' ' LEU . 2.2 pp -68.41 -17.44 64.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.7 171.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -78.43 -24.38 46.18 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 119.523 -0.871 . . . . 0.0 110.259 168.374 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.654 ' O ' ' HG2' ' A' 1001 ' ' LYS . 71.6 mm-40 -72.08 -45.99 58.55 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 172.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.726 HD22 HD11 ' A' 1028 ' ' LEU . 0.2 OUTLIER -56.03 -46.76 78.74 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.752 -178.147 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.761 ' HA ' ' SD ' ' A' 1002 ' ' MET . 84.1 mt -66.99 -36.8 78.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.428 -173.392 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 19.9 m-80 -64.05 -35.36 80.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.124 0.488 . . . . 0.0 111.5 177.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.654 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 44.7 mmtm -77.4 -45.28 26.38 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.78 0.8 . . . . 0.0 109.792 -174.258 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1002 ' ' MET . . . . . 1.01 ' HB3' ' HG3' ' A' 1021 ' ' MET . 7.1 ptm -63.76 -25.92 68.41 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 122.165 0.983 . . . . 0.0 108.973 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.619 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 9.4 tptm -69.55 -52.66 24.26 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.439 -167.446 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.804 HD13 ' HG3' ' A' 1007 ' ' GLN . 4.0 mm? -75.33 -12.59 60.3 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.483 -0.781 . . . . 0.0 111.592 179.557 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.754 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -71.96 -37.78 69.87 Favored 'General case' 0 C--O 1.213 -0.828 0 C-N-CA 119.389 -0.924 . . . . 0.0 110.52 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.695 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.4 pp0? -76.3 -30.69 57.85 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 119.105 -0.474 . . . . 0.0 110.984 173.132 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.804 ' HG3' HD13 ' A' 1004 ' ' LEU . 17.2 mm-40 -48.3 -49.28 34.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.393 0.616 . . . . 0.0 109.989 175.253 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.504 ' HB2' HD12 ' A' 1013 ' ' LEU . 68.7 m-85 -129.09 55.04 1.76 Allowed 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 121.483 0.659 . . . . 0.0 110.419 170.362 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1009 ' ' VAL . . . . . 0.995 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 4.7 p -56.51 -25.54 21.15 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.527 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.786 168.155 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 59.8 mtt -74.01 1.32 11.21 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 114.818 -1.083 . . . . 0.0 111.081 176.544 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1011 ' ' THR . . . . . 0.593 HG22 ' H ' ' A' 1012 ' ' SER . 0.2 OUTLIER -151.63 -154.77 0.56 Allowed 'General case' 0 C--O 1.26 1.606 0 CA-C-O 122.9 1.333 . . . . 0.0 114.043 -176.357 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A 1012 ' ' SER . . . . . 0.593 ' H ' HG22 ' A' 1011 ' ' THR . 15.1 m -59.06 -43.84 91.77 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 113.902 -1.499 . . . . 0.0 112.376 -170.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1013 ' ' LEU . . . . . 0.669 ' O ' ' HB2' ' A' 1017 ' ' TYR . 13.2 mt -48.6 -43.23 35.94 Favored 'General case' 0 CA--C 1.494 -1.183 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.888 178.678 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1014 ' ' GLN . . . . . 0.995 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 3.4 tt0 -54.72 -54.08 46.56 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-O 121.521 0.677 . . . . 0.0 109.798 -171.374 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -67.01 -44.94 79.02 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 114.283 -1.326 . . . . 0.0 110.825 -174.64 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -65.67 -56.21 13.37 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.296 0.569 . . . . 0.0 111.799 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.754 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 6.7 m-85 -62.02 -34.52 76.37 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.988 -1.005 . . . . 0.0 113.149 -172.697 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.799 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 55.6 tptt -80.61 -30.72 36.77 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.74 -176.683 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -73.0 -49.79 26.88 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 174.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -54.65 -30.54 55.5 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 114.999 -1.001 . . . . 0.0 110.782 165.064 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1021 ' ' MET . . . . . 1.01 ' HG3' ' HB3' ' A' 1002 ' ' MET . 2.5 ttp -68.95 -48.16 63.89 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 175.934 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1022 ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' 1022 ' ' LEU . 0.0 OUTLIER -79.13 -12.28 59.99 Favored 'General case' 0 C--O 1.216 -0.702 0 C-N-CA 119.835 -0.746 . . . . 0.0 109.977 -177.016 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 97.8 m -84.45 -36.07 22.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.111 175.166 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.52 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.73 -22.08 47.09 Favored 'General case' 0 C--O 1.222 -0.369 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 171.816 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.762 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -84.92 -21.98 29.45 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.877 -0.602 . . . . 0.0 109.887 169.069 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.509 ' O ' HG23 ' A' 1030 ' ' VAL . 8.5 t60 -76.0 -27.18 57.32 Favored 'General case' 0 C--O 1.217 -0.624 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 165.584 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1027 ' ' ALA . . . . . 0.448 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -69.27 -39.94 78.09 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 123.355 0.662 . . . . 0.0 110.09 164.045 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.726 HD11 HD22 ' A' ' 998' ' ' LEU . 26.0 mt -61.3 -44.61 96.92 Favored 'General case' 0 C--N 1.315 -0.921 0 C-N-CA 120.353 -0.539 . . . . 0.0 109.615 170.427 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -59.09 -40.28 84.81 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.529 0.204 . . . . 0.0 111.476 173.233 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.509 HG23 ' O ' ' A' 1026 ' ' HIS . 9.5 t -69.11 -46.31 78.41 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 CA-C-O 121.7 0.762 . . . . 0.0 110.179 -178.799 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.5 ' OD2' ' HG ' ' A' ' 990' ' ' LEU . 5.5 t70 -71.84 -42.54 66.81 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 114.339 -1.301 . . . . 0.0 110.187 -174.904 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.601 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -59.98 -36.27 76.8 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 174.309 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 36.4 tttm -66.14 -55.01 18.52 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.631 0.729 . . . . 0.0 110.001 173.001 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.47 ' O ' ' HB3' ' A' 1037 ' ' ASP . 9.6 t30 -64.91 -48.66 73.38 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 114.587 -1.188 . . . . 0.0 112.552 -172.711 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.997 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 2.0 pp -63.99 -40.67 96.89 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 119.401 -0.333 . . . . 0.0 110.108 -176.382 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.638 HD22 HG23 ' A' ' 925' ' ' VAL . 4.0 pp -70.59 -33.68 71.33 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 117.232 -1.787 . . . . 0.0 109.618 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.47 ' HB3' ' O ' ' A' 1034 ' ' ASN . 18.3 t70 -58.25 -44.36 88.27 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.654 173.777 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.46 ' HB ' ' O ' ' A' 1035 ' ' LEU . 24.8 t -55.09 -39.38 50.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 113.708 -1.587 . . . . 0.0 111.269 174.284 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.803 HG12 HG13 ' A' ' 984' ' ' ILE . 1.7 mp -80.45 -33.13 13.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.374 176.857 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.61 -44.26 76.85 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 121.536 0.684 . . . . 0.0 109.482 170.874 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 92.1 mt-30 -70.06 -39.22 75.81 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.058 174.205 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.7 ' HB1' HG23 ' A' ' 980' ' ' THR . . . -55.62 -52.51 63.55 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -177.414 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.648 ' HG2' ' O ' ' A' 1039 ' ' ILE . 5.7 ptm180 -66.1 -41.14 91.02 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 -176.379 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 44.5 tp . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 115.987 -0.552 . . . . 0.0 109.895 174.225 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.717 ' HB2' HG21 ' A' ' 968' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.539 0 N-CA-C 114.444 1.276 . . . . 0.0 114.444 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.683 ' H ' ' HD2' ' A' ' 924' ' ' LYS . 4.1 t -53.62 -40.57 42.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 CA-C-N 119.148 0.886 . . . . 0.0 111.895 -169.653 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -80.03 -20.94 44.17 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.084 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 927' ' ' GLU . . . . . 0.587 ' HG2' ' O ' ' A' ' 924' ' ' LYS . 9.3 pt-20 -76.71 -24.17 53.11 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 120.173 1.351 . . . . 0.0 109.542 169.286 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.55 ' OD1' ' HA ' ' A' ' 925' ' ' VAL . 1.1 m120 -68.57 -29.7 68.31 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 170.601 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.578 ' HA ' ' CD2' ' A' ' 932' ' ' LEU . 44.3 t -80.5 -30.24 12.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 114.726 -1.125 . . . . 0.0 109.841 175.258 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.457 ' OG1' ' HA ' ' A' ' 927' ' ' GLU . 31.1 m -57.36 -43.4 83.47 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 168.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -66.55 -52.35 35.43 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-N 114.518 -1.219 . . . . 0.0 114.106 176.091 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.578 ' CD2' ' HA ' ' A' ' 929' ' ' VAL . 2.2 pp -65.29 -49.32 69.96 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -175.269 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.456 HG22 ' CB ' ' A' 1029 ' ' ALA . 76.7 t -62.1 -42.17 94.0 Favored 'Isoleucine or valine' 0 C--O 1.242 0.68 0 CA-C-O 121.399 0.619 . . . . 0.0 110.312 -176.637 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.472 ' O ' ' HB2' ' A' ' 938' ' ' GLU . 4.7 tmmm? -58.52 -39.04 79.02 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.612 -1.176 . . . . 0.0 109.906 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 0.56 ' HA ' ' SD ' ' A' ' 939' ' ' MET . . . -66.75 -35.41 80.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.569 0.223 . . . . 0.0 111.169 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.673 HG22 ' HB1' ' A' 1025 ' ' ALA . 59.8 t -53.24 -77.12 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.687 -179.513 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.511 ' O ' ' HB2' ' A' ' 940' ' ' SER . 27.1 pt -67.43 -42.57 87.4 Favored 'Isoleucine or valine' 0 C--O 1.249 1.062 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -174.908 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.472 ' HB2' ' O ' ' A' ' 934' ' ' LYS . 7.5 mm-40 -66.49 -46.5 76.1 Favored 'General case' 0 C--N 1.315 -0.929 0 C-N-CA 120.932 -0.307 . . . . 0.0 110.928 -170.149 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.56 ' SD ' ' HA ' ' A' ' 935' ' ' ALA . 1.0 OUTLIER -69.84 -28.33 65.6 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.174 178.032 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.751 ' HA ' ' NZ ' ' A' 1018 ' ' LYS . 4.6 m . . . . . 0 CA--C 1.514 -0.434 0 O-C-N 123.542 0.526 . . . . 0.0 112.355 -171.788 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 1.029 ' HB3' ' HG3' ' A' 1002 ' ' MET . 16.5 m-85 . . . . . 0 C--O 1.214 -0.79 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 0.784 ' O ' HG12 ' A' ' 955' ' ' VAL . 66.6 t -53.82 -54.06 50.81 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 117.949 0.34 . . . . 0.0 111.142 174.079 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 0.721 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 12.8 Cg_exo -48.3 -43.82 30.88 Favored 'Trans proline' 0 CA--C 1.545 1.071 0 C-N-CA 121.703 1.602 . . . . 0.0 113.413 170.588 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 954' ' ' MET . . . . . . . . . . . . . 5.2 tpt -71.12 -48.21 53.56 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.547 0.739 . . . . 0.0 112.023 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.784 HG12 ' O ' ' A' ' 952' ' ' VAL . 0.3 OUTLIER -54.27 -29.65 19.8 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.772 169.059 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.531 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 9.5 tmtt? -68.64 -31.61 70.87 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.585 0.231 . . . . 0.0 111.296 169.842 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 957' ' ' GLU . . . . . 0.673 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 18.6 mm-40 -77.76 -44.69 26.84 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.395 0.617 . . . . 0.0 110.247 -176.888 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.458 HG12 ' HA ' ' A' ' 955' ' ' VAL . 7.3 p -77.01 -27.38 16.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.283 178.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 959' ' ' GLY . . . . . 0.508 ' HA2' HD11 ' A' ' 995' ' ' LEU . . . -65.44 -34.96 90.69 Favored Glycine 0 N--CA 1.448 -0.529 0 N-CA-C 110.293 -1.123 . . . . 0.0 110.293 170.658 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 960' ' ' LEU . . . . . 0.593 HD12 ' HD3' ' A' ' 963' ' ' ARG . 25.8 tp -63.67 -32.66 74.21 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.022 -0.589 . . . . 0.0 110.526 174.405 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.472 ' HB1' ' HB3' ' A' ' 932' ' ' LEU . . . -75.58 -58.19 3.43 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 121.137 -0.225 . . . . 0.0 110.612 -178.324 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.608 HD13 HD12 ' A' ' 991' ' ' LEU . 0.4 OUTLIER -42.82 -50.7 5.64 Favored 'General case' 0 C--O 1.212 -0.918 0 N-CA-C 112.748 0.648 . . . . 0.0 112.748 168.827 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.593 ' HD3' HD12 ' A' ' 960' ' ' LEU . 3.5 ptm180 -65.82 -28.51 69.04 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 119.654 1.116 . . . . 0.0 110.745 -177.626 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 38.8 m -68.78 -39.26 80.28 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 173.278 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.521 HD21 HD21 ' A' 1035 ' ' LEU . 0.1 OUTLIER -66.36 -38.96 88.79 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.389 -1.278 . . . . 0.0 110.66 177.287 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 0.837 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 9.9 tt -76.48 -38.79 54.76 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 115.415 -0.811 . . . . 0.0 108.92 -172.723 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -71.13 -31.66 68.0 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.304 177.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.717 HG21 ' HB2' ' A' ' 924' ' ' LYS . 11.8 p -68.77 -39.98 79.94 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 118.654 0.661 . . . . 0.0 110.29 175.289 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.893 HG12 HG23 ' A' ' 984' ' ' ILE . 97.7 t -71.14 -40.73 75.38 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.045 173.894 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.488 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 19.4 t70 -64.79 -42.98 94.62 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 122.003 0.906 . . . . 0.0 108.691 -179.103 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.687 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 11.2 tp10 -61.48 -38.13 86.16 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 114.032 -1.44 . . . . 0.0 109.415 177.123 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.716 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 58.8 m -64.42 -18.94 65.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.772 179.053 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.841 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 8.8 tt -66.89 -53.24 27.77 Favored Pre-proline 0 CA--C 1.536 0.434 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 -179.618 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.841 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 4.8 Cg_exo -80.83 -17.61 9.54 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 121.71 1.606 . . . . 0.0 113.78 172.063 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.716 ' HB ' ' HA ' ' A' ' 972' ' ' SER . 3.5 t . . . . . 0 N--CA 1.467 0.386 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -178.14 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.759 HG23 ' HB1' ' A' 1042 ' ' ALA . 67.4 m . . . . . 0 N--CA 1.448 -0.562 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.557 ' HA ' HD12 ' A' ' 984' ' ' ILE . 2.0 p-80 -52.04 -23.33 5.07 Favored 'General case' 0 C--O 1.216 -0.669 0 CA-C-N 113.971 -1.468 . . . . 0.0 113.403 179.03 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -82.56 -21.42 35.3 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 119.081 0.855 . . . . 0.0 110.755 178.567 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.73 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 0.2 OUTLIER -78.63 -33.98 46.87 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 168.454 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.893 HG23 HG12 ' A' ' 969' ' ' VAL . 53.5 mt -70.15 -30.65 44.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 114.766 -1.106 . . . . 0.0 108.055 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 985' ' ' GLU . . . . . 0.518 ' O ' ' HG3' ' A' ' 989' ' ' LYS . 9.6 mm-40 -64.1 -55.35 22.67 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.783 174.417 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 65.3 mtt -71.11 -44.78 64.95 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.131 -0.94 . . . . 0.0 111.619 -168.62 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 1.021 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -66.6 -49.38 66.49 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.069 -0.968 . . . . 0.0 112.288 -173.352 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.837 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 25.9 pt20 -61.76 -29.92 70.45 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 119.817 -0.753 . . . . 0.0 111.26 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 989' ' ' LYS . . . . . 0.743 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 50.9 mttm -70.5 -39.16 74.31 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.616 0.722 . . . . 0.0 111.396 174.21 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.622 HD23 ' HB3' ' A' 1035 ' ' LEU . 15.8 tp -49.94 -60.49 2.87 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.447 -178.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.724 HD21 ' HA ' ' A' 1028 ' ' LEU . 0.3 OUTLIER -67.99 -28.55 67.53 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.522 0.677 . . . . 0.0 109.788 -179.885 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 992' ' ' ASN . . . . . 0.743 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 22.7 t-20 -52.27 -55.44 21.31 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.346 -1.297 . . . . 0.0 111.023 178.278 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 30.8 t -76.41 -34.75 58.82 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.383 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 994' ' ' ASP . . . . . 0.464 ' O ' ' HB3' ' A' ' 997' ' ' GLU . 0.7 OUTLIER -65.27 -37.04 85.97 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.6 -0.44 . . . . 0.0 112.162 179.306 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 1.035 ' HG ' HD23 ' A' ' 998' ' ' LEU . 6.8 tt -72.0 -17.49 62.04 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 122.32 -0.238 . . . . 0.0 110.546 172.703 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -72.8 -25.73 61.25 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 119.446 -0.901 . . . . 0.0 110.032 166.761 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.464 ' HB3' ' O ' ' A' ' 994' ' ' ASP . 12.1 tp10 -74.97 -38.4 61.68 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 173.371 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 1.035 HD23 ' HG ' ' A' ' 995' ' ' LEU . 0.1 OUTLIER -56.38 -46.39 80.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.039 178.629 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.589 ' O ' ' HB2' ' A' 1003 ' ' LYS . 76.2 mt -60.7 -46.11 96.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.679 -175.429 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -58.04 -39.87 79.49 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -175.876 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.554 ' O ' ' HB3' ' A' 1017 ' ' TYR . 32.7 mmtp -84.15 -37.05 22.42 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.721 0.772 . . . . 0.0 110.119 -175.551 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1002 ' ' MET . . . . . 1.029 ' HG3' ' HB3' ' A' ' 951' ' ' TYR . 34.3 tpp -57.97 -32.54 67.96 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.731 -1.122 . . . . 0.0 108.821 172.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.589 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 13.4 tptp -70.39 -53.7 15.46 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 113.808 -1.542 . . . . 0.0 111.369 -167.426 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.65 HD13 ' HG3' ' A' 1007 ' ' GLN . 4.1 mm? -76.9 -13.16 60.02 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.681 -177.383 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.629 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -68.45 -47.98 65.73 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 119.664 -0.814 . . . . 0.0 109.762 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.906 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 8.4 pt20 -70.87 -36.16 72.69 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 119.941 -0.704 . . . . 0.0 111.898 171.486 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.65 ' HG3' HD13 ' A' 1004 ' ' LEU . 12.4 mm100 -43.13 -51.55 5.86 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.108 0.48 . . . . 0.0 110.734 177.086 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.688 ' HB2' ' HG ' ' A' 1013 ' ' LEU . 66.4 m-85 -123.71 52.3 1.45 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.52 0.676 . . . . 0.0 110.088 169.372 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1009 ' ' VAL . . . . . 0.983 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 13.0 p -53.73 -18.05 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.423 0 CA-C-N 114.576 -1.193 . . . . 0.0 110.288 169.555 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1010 ' ' MET . . . . . 0.418 ' C ' ' HG1' ' A' 1011 ' ' THR . 16.4 ptp -62.31 81.17 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.078 166.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1011 ' ' THR . . . . . 0.418 ' HG1' ' C ' ' A' 1010 ' ' MET . 45.8 p 68.0 -89.08 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 126.231 1.812 . . . . 0.0 114.589 175.479 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 37.6 m -45.98 -79.38 0.01 OUTLIER 'General case' 0 C--O 1.241 0.638 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 -165.264 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1013 ' ' LEU . . . . . 0.688 ' HG ' ' HB2' ' A' 1008 ' ' TYR . 13.3 mt -54.57 -35.17 63.02 Favored 'General case' 0 CA--C 1.501 -0.92 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 -174.784 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1014 ' ' GLN . . . . . 0.983 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.8 OUTLIER -54.39 -48.61 71.36 Favored 'General case' 0 N--CA 1.445 -0.718 0 O-C-N 123.646 0.591 . . . . 0.0 110.912 -167.78 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A 1015 ' ' GLN . . . . . 0.403 ' O ' ' HD3' ' A' 1019 ' ' LYS . 22.3 pt20 -75.17 -41.06 58.88 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.565 -176.397 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -72.64 -46.74 52.5 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.203 0.525 . . . . 0.0 111.042 -176.431 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.629 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 6.9 m-85 -67.87 -36.5 80.39 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.48 -176.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.789 ' HE2' ' CE ' ' A' 1021 ' ' MET . 9.5 tptm -79.86 -26.61 40.3 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.587 -175.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1019 ' ' LYS . . . . . 0.403 ' HD3' ' O ' ' A' 1015 ' ' GLN . 1.1 mptm? -74.18 -42.16 60.3 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 174.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -57.34 -35.04 69.41 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.191 163.229 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.789 ' CE ' ' HE2' ' A' 1018 ' ' LYS . 6.6 tmm? -66.41 -53.6 33.94 Favored 'General case' 0 C--O 1.219 -0.505 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 -179.039 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1022 ' ' LEU . . . . . 0.522 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -78.98 -8.53 58.99 Favored 'General case' 0 C--O 1.22 -0.46 0 C-N-CA 119.367 -0.933 . . . . 0.0 109.852 -171.472 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 82.6 m -88.15 -35.27 17.51 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.944 174.367 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.488 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -79.0 -22.72 45.12 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-O 121.222 0.534 . . . . 0.0 109.582 171.833 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.673 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -86.18 -23.92 26.33 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.927 170.213 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.525 ' O ' HG23 ' A' 1030 ' ' VAL . 63.8 t60 -75.96 -22.58 55.76 Favored 'General case' 0 C--O 1.214 -0.777 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 164.689 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1027 ' ' ALA . . . . . 0.488 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -73.2 -39.11 65.83 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 123.282 0.633 . . . . 0.0 109.386 165.231 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.724 ' HA ' HD21 ' A' ' 991' ' ' LEU . 14.4 mt -59.87 -48.15 82.85 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 168.793 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1029 ' ' ALA . . . . . 0.456 ' CB ' HG22 ' A' ' 933' ' ' VAL . . . -57.73 -42.72 84.44 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.867 -0.151 . . . . 0.0 111.358 175.234 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.525 HG23 ' O ' ' A' 1026 ' ' HIS . 8.0 t -69.19 -51.79 39.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.318 0.58 . . . . 0.0 110.877 -176.623 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.537 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 12.4 m-20 -77.15 -29.38 54.56 Favored 'General case' 0 C--O 1.214 -0.779 0 CA-C-N 115.338 -0.847 . . . . 0.0 112.661 -174.984 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.426 ' HA ' ' CD2' ' A' 1035 ' ' LEU . . . -70.32 -31.24 68.46 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 172.224 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.55 ' HE2' ' O ' ' A' 1033 ' ' LYS . 1.0 OUTLIER -63.83 -49.95 70.81 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 168.892 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.537 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 42.2 t30 -64.13 -53.94 41.66 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-N 113.921 -1.49 . . . . 0.0 112.474 -175.829 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1035 ' ' LEU . . . . . 1.021 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 2.3 pp -60.47 -41.27 93.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 119.638 -0.22 . . . . 0.0 110.551 -172.242 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.536 ' HG ' ' HB ' ' A' ' 925' ' ' VAL . 1.0 OUTLIER -68.77 -43.95 74.69 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 117.974 -1.491 . . . . 0.0 109.142 179.12 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.524 ' HB3' ' O ' ' A' 1034 ' ' ASN . 12.1 t70 -49.28 -42.91 42.54 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 114.801 -1.091 . . . . 0.0 110.22 173.771 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.611 ' CG1' ' HG3' ' A' ' 983' ' ' GLU . 21.2 t -56.82 -48.7 80.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 113.488 -1.687 . . . . 0.0 111.966 176.064 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.731 ' O ' ' HG2' ' A' 1043 ' ' ARG . 2.0 mp -70.68 -31.48 46.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 118.761 0.709 . . . . 0.0 111.435 177.039 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.405 ' HA ' ' HD2' ' A' 1043 ' ' ARG . 0.2 OUTLIER -63.38 -47.41 82.18 Favored 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.559 174.204 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -61.58 -43.87 98.06 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.006 0.432 . . . . 0.0 109.863 172.204 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.759 ' HB1' HG23 ' A' ' 980' ' ' THR . . . -54.1 -50.99 65.58 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -176.399 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.731 ' HG2' ' O ' ' A' 1039 ' ' ILE . 1.3 ptp180 -63.7 -46.94 83.2 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.477 -174.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1044 ' ' LEU . . . . . 0.532 HD22 ' HG3' ' A' 1043 ' ' ARG . 3.7 mm? . . . . . 0 C--N 1.332 -0.191 0 CA-C-O 120.764 0.316 . . . . 0.0 111.016 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.48 ' O ' ' HG2' ' A' ' 927' ' ' GLU . 4.9 tptp . . . . . 0 N--CA 1.47 0.56 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.825 HG13 ' HB2' ' A' 1036 ' ' LEU . 1.5 p -62.45 -28.81 45.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 CA-C-O 121.291 0.567 . . . . 0.0 110.83 177.859 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 926' ' ' TYR . . . . . 0.619 ' HA ' HD22 ' A' 1036 ' ' LEU . 0.0 OUTLIER -68.09 -30.02 69.1 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.498 0.719 . . . . 0.0 111.555 174.986 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 927' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 924' ' ' LYS . 3.6 pt-20 -74.97 -23.22 58.25 Favored 'General case' 0 C--N 1.315 -0.935 0 C-N-CA 118.661 -1.215 . . . . 0.0 109.636 -179.531 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.419 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 1.6 m120 -75.48 -30.98 60.07 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 172.08 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.656 HG22 HD21 ' A' ' 932' ' ' LEU . 83.3 t -81.68 -30.41 10.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.745 178.247 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.466 HG22 ' O ' ' A' ' 927' ' ' GLU . 3.1 t -65.37 -26.69 68.12 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 170.139 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -72.03 -52.87 10.21 Favored Glycine 0 CA--C 1.531 1.044 0 CA-C-N 115.047 -0.978 . . . . 0.0 113.379 172.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.656 HD21 HG22 ' A' ' 929' ' ' VAL . 3.2 pp -65.8 -47.43 75.15 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -177.617 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 95.6 t -64.37 -34.39 69.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 CA-C-O 121.375 0.607 . . . . 0.0 110.237 -177.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.494 ' O ' ' HB3' ' A' ' 938' ' ' GLU . 37.9 tptt -62.48 -34.03 76.03 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.516 176.131 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -68.62 -40.31 80.4 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.316 -0.554 . . . . 0.0 110.644 174.663 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.834 HG22 ' HB1' ' A' 1025 ' ' ALA . 88.3 t -47.38 -78.92 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 123.417 0.687 . . . . 0.0 112.511 -178.46 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 19.2 pt -70.49 -41.94 78.22 Favored 'Isoleucine or valine' 0 C--O 1.249 1.028 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -175.875 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.494 ' HB3' ' O ' ' A' ' 934' ' ' LYS . 5.2 tp10 -70.46 -48.08 57.54 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.426 -168.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.54 ' SD ' ' HB2' ' A' ' 954' ' ' MET . 16.2 ttt -74.49 -27.27 60.49 Favored 'General case' 0 C--N 1.308 -1.219 0 C-N-CA 119.276 -0.97 . . . . 0.0 110.05 -178.395 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.699 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 26.3 t . . . . . 0 CA--C 1.519 -0.247 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.512 -171.534 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 1.004 ' HB3' ' HG2' ' A' 1002 ' ' MET . 20.5 m-30 . . . . . 0 CA--C 1.539 0.55 0 N-CA-C 114.255 1.206 . . . . 0.0 114.255 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 0.549 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 45.6 t -48.1 -44.69 62.07 Favored Pre-proline 0 CA--C 1.541 0.597 0 C-N-CA 122.849 0.46 . . . . 0.0 112.058 172.327 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 0.549 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 19.0 Cg_exo -47.62 -44.13 26.6 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 122.572 2.181 . . . . 0.0 113.185 173.864 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.779 ' HB3' ' HE1' ' A' 1002 ' ' MET . 14.1 ttt -71.76 -37.55 70.5 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 120.897 0.379 . . . . 0.0 110.227 175.774 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.519 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 86.2 t -52.96 -40.62 37.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.809 170.787 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.509 ' HE2' ' OE2' ' A' ' 957' ' ' GLU . 0.8 OUTLIER -62.7 -34.03 76.3 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.788 174.376 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 957' ' ' GLU . . . . . 0.509 ' OE2' ' HE2' ' A' ' 956' ' ' LYS . 69.7 mm-40 -77.87 -44.83 26.0 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.195 0.522 . . . . 0.0 111.111 -179.24 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.451 HG23 ' HB2' ' A' ' 932' ' ' LEU . 14.6 p -78.79 -29.37 14.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.928 -177.375 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -69.62 -35.52 74.6 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 110.549 -1.02 . . . . 0.0 110.549 172.801 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 960' ' ' LEU . . . . . 0.455 ' O ' ' HG2' ' A' ' 963' ' ' ARG . 8.6 tt -62.77 -41.22 99.13 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 174.121 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.422 ' CB ' ' HB3' ' A' ' 932' ' ' LEU . . . -69.32 -57.99 4.6 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 121.132 -0.227 . . . . 0.0 110.966 -179.593 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.597 ' HB2' HD22 ' A' ' 991' ' ' LEU . 0.1 OUTLIER -42.86 -49.22 5.85 Favored 'General case' 0 C--O 1.217 -0.642 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 169.763 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.466 ' N ' ' HG ' ' A' ' 962' ' ' LEU . 11.2 ptm180 -67.89 -28.77 67.8 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 120.108 1.322 . . . . 0.0 111.064 -179.529 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 28.0 m -68.3 -35.53 77.97 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 173.652 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.719 HD22 HD13 ' A' ' 991' ' ' LEU . 0.0 OUTLIER -66.57 -38.64 87.48 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 114.523 -1.217 . . . . 0.0 109.467 174.686 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 10.3 tt -65.92 -40.36 91.36 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-N 114.314 -1.312 . . . . 0.0 108.271 -177.082 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -65.29 -44.69 87.16 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.397 -0.82 . . . . 0.0 112.249 178.166 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 13.8 p -64.81 -41.02 96.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 118.858 0.753 . . . . 0.0 110.412 179.379 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.724 HG12 HG23 ' A' ' 984' ' ' ILE . 87.3 t -72.96 -41.85 60.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.021 176.811 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.605 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 14.0 t70 -67.03 -38.83 86.62 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 -177.57 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.625 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 14.2 tt0 -60.83 -33.85 73.66 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.012 -0.995 . . . . 0.0 109.773 174.231 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.506 ' HB2' ' O ' ' A' ' 969' ' ' VAL . 64.2 m -65.57 -18.29 65.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.085 177.728 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.727 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 10.5 tt -70.61 -52.02 11.45 Favored Pre-proline 0 CA--C 1.537 0.48 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.256 -178.529 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.727 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 2.2 Cg_endo -88.01 -4.7 6.95 Favored 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 121.758 1.639 . . . . 0.0 113.94 173.751 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 971' ' ' GLU . 15.9 t . . . . . 0 C--N 1.329 -0.287 0 C-N-CA 120.157 -0.617 . . . . 0.0 109.766 171.156 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.603 HG22 ' CD1' ' A' ' 984' ' ' ILE . 32.5 m . . . . . 0 CA--C 1.542 0.662 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.689 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 2.5 p80 -50.13 -34.52 22.45 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -175.352 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -82.66 -20.79 35.55 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -168.137 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 983' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.59 -37.65 41.93 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.316 0.579 . . . . 0.0 109.684 172.58 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.779 HG13 HG12 ' A' 1039 ' ' ILE . 2.5 mp -65.68 -29.74 47.94 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.524 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 176.005 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 985' ' ' GLU . . . . . 0.689 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 42.3 mt-10 -63.79 -52.45 60.2 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-O 121.36 0.6 . . . . 0.0 110.579 176.164 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 58.7 mtt -70.06 -46.34 65.17 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 114.978 -1.01 . . . . 0.0 111.424 -169.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.466 ' HA ' HD12 ' A' ' 990' ' ' LEU . . . -75.09 -51.11 14.29 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.719 -1.128 . . . . 0.0 112.776 -169.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.677 ' O ' ' HB2' ' A' ' 992' ' ' ASN . 17.9 pt20 -63.29 -20.95 65.93 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 119.406 -0.918 . . . . 0.0 109.209 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 989' ' ' LYS . . . . . 0.62 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 9.1 ttmm -73.94 -42.43 60.58 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.042 -0.981 . . . . 0.0 112.591 170.982 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.498 HD13 HD11 ' A' 1035 ' ' LEU . 1.2 mt -56.29 -54.05 49.96 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -178.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.719 HD13 HD22 ' A' ' 965' ' ' LEU . 1.2 tt -65.22 -32.21 73.77 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 175.774 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 992' ' ' ASN . . . . . 0.677 ' HB2' ' O ' ' A' ' 988' ' ' GLN . 47.3 t-20 -53.95 -56.88 13.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.932 179.003 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 20.7 t -79.32 -33.88 42.77 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -177.42 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 994' ' ' ASP . . . . . 0.502 ' O ' ' HB3' ' A' ' 997' ' ' GLU . 0.2 OUTLIER -69.0 -33.41 73.63 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.17 -0.612 . . . . 0.0 111.705 178.946 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 0.611 ' N ' HD21 ' A' 1028 ' ' LEU . 2.9 tm? -69.33 -19.63 63.87 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 169.911 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -76.08 -21.76 56.36 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 119.434 -0.906 . . . . 0.0 110.415 167.606 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.594 ' HA ' ' ND2' ' A' 1000 ' ' ASN . 7.7 tp10 -75.25 -42.41 55.19 Favored 'General case' 0 C--O 1.239 0.528 0 C-N-CA 122.367 0.267 . . . . 0.0 110.532 173.228 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.961 HD12 ' HB2' ' A' 1025 ' ' ALA . 1.6 tt -56.53 -44.21 80.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.725 0.298 . . . . 0.0 110.366 177.518 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.546 HG13 ' O ' ' A' ' 995' ' ' LEU . 88.5 mt -66.46 -46.87 85.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 CA-C-N 115.868 -0.605 . . . . 0.0 112.274 -172.473 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1000 ' ' ASN . . . . . 0.594 ' ND2' ' HA ' ' A' ' 997' ' ' GLU . 10.2 p30 -63.21 -37.51 87.54 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.438 0.637 . . . . 0.0 111.374 -172.147 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.599 ' HD3' ' HB3' ' A' 1020 ' ' GLN . 49.9 mttp -83.96 -34.15 24.48 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.086 -178.883 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1002 ' ' MET . . . . . 1.004 ' HG2' ' HB3' ' A' ' 951' ' ' TYR . 12.7 ttt -62.48 -27.23 68.99 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 122.054 0.93 . . . . 0.0 109.013 175.537 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.55 ' O ' ' HG3' ' A' 1007 ' ' GLN . 10.3 tptp -72.91 -55.28 6.84 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-N 113.724 -1.58 . . . . 0.0 110.224 -170.812 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.417 HD23 ' CD ' ' A' 1007 ' ' GLN . 90.5 mt -66.24 -13.53 60.52 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.615 179.435 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.726 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -72.88 -51.76 17.4 Favored 'General case' 0 C--O 1.212 -0.898 0 C-N-CA 119.634 -0.827 . . . . 0.0 110.147 178.85 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.971 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.5 pp0? -68.86 -32.39 72.02 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 118.332 0.515 . . . . 0.0 111.94 174.272 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.55 ' HG3' ' O ' ' A' 1003 ' ' LYS . 67.5 mt-30 -51.79 -40.86 61.11 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.18 0.514 . . . . 0.0 111.282 175.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.514 ' HB2' ' HG ' ' A' 1013 ' ' LEU . 54.9 m-85 -126.49 39.06 4.01 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.333 173.268 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1009 ' ' VAL . . . . . 1.008 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 12.9 p -54.28 -22.14 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 CA-C-O 121.692 0.758 . . . . 0.0 110.332 177.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1010 ' ' MET . . . . . 0.497 ' O ' HG23 ' A' 1011 ' ' THR . 59.1 mtt -50.03 -29.32 8.47 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.355 -1.293 . . . . 0.0 111.831 177.918 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1011 ' ' THR . . . . . 0.497 HG23 ' O ' ' A' 1010 ' ' MET . 0.6 OUTLIER -163.79 -99.51 0.02 OUTLIER 'General case' 0 C--O 1.253 1.275 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 177.311 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 4.7 p -56.92 -65.24 0.65 Allowed 'General case' 0 C--O 1.237 0.438 0 CA-C-N 114.267 -1.333 . . . . 0.0 113.57 -163.065 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1013 ' ' LEU . . . . . 0.609 ' HB3' ' CD2' ' A' 1017 ' ' TYR . 8.9 mt -52.1 -37.01 52.64 Favored 'General case' 0 CA--C 1.501 -0.913 0 N-CA-C 111.558 0.207 . . . . 0.0 111.558 -177.395 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1014 ' ' GLN . . . . . 1.008 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 4.3 tm0? -54.35 -52.72 60.69 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-O 121.202 0.525 . . . . 0.0 110.974 -168.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1015 ' ' GLN . . . . . 0.691 ' O ' ' HB3' ' A' 1019 ' ' LYS . 4.6 pp0? -71.42 -36.83 71.44 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.261 -174.955 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1016 ' ' GLU . . . . . 0.472 ' HA ' ' HD2' ' A' 1019 ' ' LYS . 17.3 tt0 -73.2 -51.64 17.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.8 0.809 . . . . 0.0 111.015 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.726 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 12.2 m-85 -66.85 -37.79 85.14 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -174.587 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.544 ' HE3' ' HA ' ' A' ' 940' ' ' SER . 45.7 tptt -79.99 -29.31 39.49 Favored 'General case' 0 N--CA 1.461 0.094 0 CA-C-N 115.056 -0.974 . . . . 0.0 109.967 -177.574 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1019 ' ' LYS . . . . . 0.691 ' HB3' ' O ' ' A' 1015 ' ' GLN . 0.0 OUTLIER -74.29 -40.41 62.29 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.778 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A 1020 ' ' GLN . . . . . 0.599 ' HB3' ' HD3' ' A' 1001 ' ' LYS . 61.8 mt-30 -60.86 -33.28 72.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.526 162.839 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.553 ' HG3' ' CG ' ' A' 1002 ' ' MET . 11.5 tmm? -65.19 -51.27 62.07 Favored 'General case' 0 CA--C 1.506 -0.723 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 -178.821 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1022 ' ' LEU . . . . . 0.862 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.1 OUTLIER -84.39 -2.67 57.52 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 119.231 -0.988 . . . . 0.0 109.76 -174.485 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 53.1 m -89.0 -34.07 16.96 Favored 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 171.271 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.529 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.76 -21.31 48.11 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 169.544 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.961 ' HB2' HD12 ' A' ' 998' ' ' LEU . . . -85.55 -24.4 27.26 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.785 169.514 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.583 ' O ' HG23 ' A' 1030 ' ' VAL . 53.6 t-80 -75.84 -23.09 55.71 Favored 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 164.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1027 ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -73.04 -40.47 65.08 Favored 'General case' 0 C--N 1.318 -0.8 0 C-N-CA 123.345 0.658 . . . . 0.0 109.419 165.528 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.611 HD21 ' N ' ' A' ' 995' ' ' LEU . 26.3 mt -61.3 -43.92 98.08 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 170.288 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -59.5 -42.78 92.95 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 111.429 0.159 . . . . 0.0 111.429 173.526 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' 1026 ' ' HIS . 10.5 t -66.42 -50.58 66.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.237 0 CA-C-O 121.61 0.719 . . . . 0.0 110.346 -178.276 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1031 ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -72.24 -39.54 68.4 Favored 'General case' 0 C--O 1.204 -1.308 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.113 -176.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.508 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -63.83 -35.44 80.63 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.917 -0.313 . . . . 0.0 110.235 176.429 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 8.0 tmtm? -61.57 -44.23 97.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.607 0.718 . . . . 0.0 109.624 172.218 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.511 ' O ' HG23 ' A' 1038 ' ' VAL . 40.5 t30 -70.8 -53.57 14.88 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 114.868 -1.06 . . . . 0.0 111.165 -177.881 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.634 HD23 ' HB2' ' A' ' 991' ' ' LEU . 0.0 OUTLIER -59.0 -42.17 89.43 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.192 -173.375 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.825 ' HB2' HG13 ' A' ' 925' ' ' VAL . 3.9 pp -62.9 -48.59 78.29 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 118.372 -1.331 . . . . 0.0 109.762 178.411 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.44 ' N ' HD12 ' A' 1036 ' ' LEU . 24.0 t70 -52.21 -38.61 58.45 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 114.165 -1.38 . . . . 0.0 110.784 175.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' 1034 ' ' ASN . 25.3 t -62.46 -50.62 79.14 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.916 0 CA-C-N 113.96 -1.473 . . . . 0.0 112.827 -179.383 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.779 HG12 HG13 ' A' ' 984' ' ' ILE . 1.5 mp -76.36 -29.33 18.79 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 CA-C-N 119.881 1.219 . . . . 0.0 111.666 -177.185 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.581 ' O ' ' HG3' ' A' 1043 ' ' ARG . 1.2 m-20 -55.87 -51.16 68.53 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.278 167.346 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1041 ' ' GLN . . . . . 0.619 ' O ' ' HB3' ' A' 1044 ' ' LEU . 36.2 mt-30 -77.1 -23.29 51.85 Favored 'General case' 0 C--N 1.312 -1.036 0 O-C-N 121.911 -0.493 . . . . 0.0 111.552 177.028 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.627 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -55.53 -52.94 62.01 Favored 'General case' 0 CA--C 1.495 -1.161 0 CA-C-O 121.577 0.703 . . . . 0.0 111.011 176.372 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.581 ' HG3' ' O ' ' A' 1040 ' ' ASP . 0.0 OUTLIER -63.55 -35.53 80.79 Favored 'General case' 0 N--CA 1.432 -1.365 0 CA-C-N 114.775 -1.102 . . . . 0.0 108.401 -179.536 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A 1044 ' ' LEU . . . . . 0.619 ' HB3' ' O ' ' A' 1041 ' ' GLN . 6.7 tt . . . . . 0 C--N 1.332 -0.168 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.407 175.037 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.416 ' HB3' HG21 ' A' ' 968' ' ' THR . 65.3 mmtt . . . . . 0 CA--C 1.531 0.216 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.782 HG11 HD13 ' A' 1036 ' ' LEU . 0.2 OUTLIER -70.72 -29.88 39.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 172.899 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 926' ' ' TYR . . . . . 0.506 ' HA ' ' HB ' ' A' ' 929' ' ' VAL . 0.1 OUTLIER -79.02 -21.0 47.58 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 178.566 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -73.15 -43.43 61.56 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 114.602 -1.181 . . . . 0.0 109.893 171.884 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.697 ' OD1' ' HB ' ' A' ' 964' ' ' THR . 69.7 m-80 -74.95 -27.32 60.14 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 119.159 0.89 . . . . 0.0 111.581 174.761 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.604 HG13 HG21 ' A' ' 933' ' ' VAL . 42.8 t -65.78 -33.31 62.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.194 167.245 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.679 ' O ' ' HB2' ' A' ' 934' ' ' LYS . 98.8 m -65.58 -42.68 91.46 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 119.372 0.987 . . . . 0.0 109.778 174.605 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -73.41 -53.9 7.21 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 120.603 -0.808 . . . . 0.0 113.621 179.148 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.503 ' O ' HG23 ' A' ' 936' ' ' VAL . 1.5 pp -64.47 -47.62 78.33 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -176.638 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.604 HG21 HG13 ' A' ' 929' ' ' VAL . 72.8 t -67.49 -36.61 76.87 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 CA-C-O 121.073 0.463 . . . . 0.0 111.028 -175.208 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.679 ' HB2' ' O ' ' A' ' 930' ' ' THR . 4.1 mmtp -62.75 -42.81 99.85 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.149 -179.642 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 0.511 ' HA ' ' SD ' ' A' ' 939' ' ' MET . . . -59.31 -35.47 73.86 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.717 0.294 . . . . 0.0 111.36 177.204 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.77 ' O ' ' HB2' ' A' ' 940' ' ' SER . 66.8 t -54.55 -74.87 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.729 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 21.1 pt -71.61 -42.5 71.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -174.304 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -64.42 -53.31 50.36 Favored 'General case' 0 C--O 1.243 0.738 0 CA-C-O 121.521 0.676 . . . . 0.0 110.634 -172.377 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.511 ' SD ' ' HA ' ' A' ' 935' ' ' ALA . 1.8 mpt? -71.21 -24.67 62.25 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 119.439 -0.904 . . . . 0.0 109.131 -178.545 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.77 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 5.0 t . . . . . 0 N--CA 1.454 -0.265 0 CA-C-O 121.824 0.821 . . . . 0.0 110.867 -175.456 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.59 ' CE1' ' HD3' ' A' 1018 ' ' LYS . 23.1 m-85 . . . . . 0 C--O 1.216 -0.69 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 0.754 ' HA ' ' CG2' ' A' ' 955' ' ' VAL . 43.4 t -56.13 -44.71 99.83 Favored Pre-proline 0 C--N 1.323 -0.57 0 C-N-CA 123.005 0.522 . . . . 0.0 111.322 171.014 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 0.593 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 47.0 Cg_exo -52.34 -36.36 68.31 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 121.843 1.696 . . . . 0.0 111.915 170.169 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.406 ' O ' HG12 ' A' ' 958' ' ' VAL . 32.3 ttm -76.69 -31.01 56.95 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.123 176.001 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.754 ' CG2' ' HA ' ' A' ' 952' ' ' VAL . 85.4 t -53.26 -39.36 34.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 168.826 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.58 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 0.7 OUTLIER -63.8 -39.64 94.74 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.124 175.104 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -76.18 -46.7 27.23 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.442 -171.277 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.662 HG22 HD23 ' A' ' 962' ' ' LEU . 11.7 p -87.8 -28.45 5.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.347 -178.907 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 959' ' ' GLY . . . . . 0.505 ' O ' ' HG2' ' A' ' 963' ' ' ARG . . . -61.99 -46.93 93.05 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.471 -0.871 . . . . 0.0 111.2 176.379 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 960' ' ' LEU . . . . . 0.467 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 9.5 tt -64.62 -34.27 77.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.039 0.447 . . . . 0.0 110.206 177.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.413 ' O ' ' HB3' ' A' ' 928' ' ' ASN . . . -72.5 -46.78 53.12 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -178.527 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.881 HD13 HD22 ' A' ' 995' ' ' LEU . 4.0 pp -84.55 -18.07 36.86 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 119.345 -0.36 . . . . 0.0 111.482 -176.37 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.506 ' HG3' ' N ' ' A' ' 964' ' ' THR . 8.5 ptp180 -70.31 -37.9 74.84 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 118.829 -1.148 . . . . 0.0 110.091 166.673 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 964' ' ' THR . . . . . 0.697 ' HB ' ' OD1' ' A' ' 928' ' ' ASN . 10.5 m -71.13 -26.46 63.02 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.74 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.491 ' CD1' HG23 ' A' ' 925' ' ' VAL . 9.7 tp -63.27 -46.36 87.19 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.618 169.145 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 0.796 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 9.7 tt -66.62 -33.25 75.24 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -177.437 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 967' ' ' ALA . . . . . 0.55 ' HA ' ' HB3' ' A' ' 970' ' ' ASP . . . -75.24 -32.95 61.26 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 115.342 -0.845 . . . . 0.0 112.224 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.416 HG21 ' HB3' ' A' ' 924' ' ' LYS . 2.4 p -71.53 -35.26 70.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.173 0.511 . . . . 0.0 110.157 176.302 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.76 HG12 HG23 ' A' ' 984' ' ' ILE . 48.6 t -74.45 -34.92 37.41 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.731 170.345 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.601 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 12.8 t70 -66.66 -41.57 87.97 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 122.422 1.106 . . . . 0.0 108.77 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.681 ' O ' HG23 ' A' ' 975' ' ' VAL . 36.0 tt0 -66.23 -29.11 69.29 Favored 'General case' 0 N--CA 1.436 -1.171 0 CA-C-N 113.818 -1.537 . . . . 0.0 110.308 178.407 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 69.0 m -69.62 -19.09 63.64 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.643 175.635 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.93 ' HA ' HD13 ' A' ' 984' ' ' ILE . 5.8 tt -66.09 -51.14 47.58 Favored Pre-proline 0 N--CA 1.454 -0.272 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.333 -177.747 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.677 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 1.1 Cg_endo -85.7 0.18 8.53 Favored 'Trans proline' 0 C--N 1.357 1.01 0 C-N-CA 121.85 1.7 . . . . 0.0 113.416 173.191 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.681 HG23 ' O ' ' A' ' 971' ' ' GLU . 11.6 t . . . . . 0 N--CA 1.465 0.291 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.045 171.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.698 HG23 ' HB1' ' A' 1042 ' ' ALA . 14.4 m . . . . . 0 CA--C 1.532 0.278 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.656 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 16.1 m-70 -50.25 -39.1 43.95 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.013 -177.714 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 14.9 ptm180 -82.1 -18.56 42.59 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.675 -0.239 . . . . 0.0 111.121 -170.516 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.889 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 1.3 tp10 -75.19 -43.02 54.38 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 172.231 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.93 HD13 ' HA ' ' A' ' 973' ' ' LEU . 3.2 mp -65.54 -32.63 59.06 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 177.227 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 985' ' ' GLU . . . . . 0.656 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 34.6 mt-10 -55.25 -52.4 63.51 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.305 0.574 . . . . 0.0 110.262 174.417 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 45.8 ttm -72.71 -40.39 66.21 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 114.979 -1.01 . . . . 0.0 111.261 -173.47 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.867 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -75.02 -50.93 14.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.524 -1.216 . . . . 0.0 112.71 -172.189 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.796 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 22.4 pt20 -62.88 -21.99 66.39 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 120.074 -0.651 . . . . 0.0 109.803 175.443 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 989' ' ' LYS . . . . . 0.722 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 59.2 tttt -74.91 -39.97 61.14 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.491 170.625 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.432 ' HB3' ' O ' ' A' ' 987' ' ' ALA . 18.0 tp -52.54 -59.22 4.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.665 177.576 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.56 ' HB3' ' CD1' ' A' 1035 ' ' LEU . 2.4 pp -59.8 -34.84 73.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.771 0.796 . . . . 0.0 109.481 177.795 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 992' ' ' ASN . . . . . 0.722 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 24.6 t-20 -52.85 -54.03 40.27 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 113.747 -1.569 . . . . 0.0 112.08 -178.924 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 6.0 m -78.83 -30.32 45.22 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 112.054 0.391 . . . . 0.0 112.054 -179.328 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.12 -42.76 88.74 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 119.488 -0.885 . . . . 0.0 111.488 176.33 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 0.881 HD22 HD13 ' A' ' 962' ' ' LEU . 1.2 pp -62.62 -23.26 66.97 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 122.717 0.407 . . . . 0.0 110.223 170.549 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -78.45 -27.23 46.39 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 119.456 -0.898 . . . . 0.0 110.406 174.564 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -73.99 -45.71 48.29 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 170.504 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.853 HD21 ' HE2' ' A' 1021 ' ' MET . 0.7 OUTLIER -56.7 -42.97 80.05 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.559 -1.2 . . . . 0.0 111.184 -178.508 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.606 ' HA ' ' CE ' ' A' 1002 ' ' MET . 69.0 mt -65.37 -43.99 94.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 O-C-N 122.458 -0.151 . . . . 0.0 111.255 -179.175 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 23.6 m-80 -60.4 -36.02 77.12 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.233 0.54 . . . . 0.0 111.446 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.465 ' O ' ' HB3' ' A' 1017 ' ' TYR . 13.5 mptt -73.56 -47.18 42.63 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.729 -174.609 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1002 ' ' MET . . . . . 1.044 ' HB3' ' HG3' ' A' 1021 ' ' MET . 16.1 ptt? -65.1 -23.79 67.25 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.841 0.829 . . . . 0.0 109.577 179.139 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.528 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 8.7 tptm -70.99 -44.99 64.8 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.162 -165.793 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.566 ' HB2' ' CD1' ' A' 1017 ' ' TYR . 6.7 mp -83.02 -13.09 56.57 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.913 178.62 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.641 ' HB2' ' CB ' ' A' 1017 ' ' TYR . . . -70.47 -37.41 74.25 Favored 'General case' 0 C--O 1.211 -0.951 0 C-N-CA 118.904 -1.118 . . . . 0.0 109.532 178.202 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.799 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 3.9 pp0? -75.47 -40.12 57.81 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 119.151 -0.452 . . . . 0.0 111.874 171.665 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.585 ' HG3' ' CD2' ' A' 1008 ' ' TYR . 5.6 pt20 -53.68 -37.97 63.73 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 121.32 0.581 . . . . 0.0 110.349 -175.747 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.8 ' HB2' HD22 ' A' 1013 ' ' LEU . 73.4 m-85 -128.99 43.18 3.19 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.364 169.775 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1009 ' ' VAL . . . . . 1.071 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 14.7 p -48.99 -21.91 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.702 169.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1010 ' ' MET . . . . . 0.427 ' O ' HG23 ' A' 1011 ' ' THR . 65.3 mtt -31.8 -55.97 0.29 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.111 -1.404 . . . . 0.0 111.548 172.062 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1011 ' ' THR . . . . . 0.427 HG23 ' O ' ' A' 1010 ' ' MET . 1.7 p -159.25 -91.04 0.03 OUTLIER 'General case' 0 C--O 1.249 1.062 0 N-CA-C 113.332 0.864 . . . . 0.0 113.332 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 32.4 t -51.27 -65.57 0.53 Allowed 'General case' 0 C--O 1.237 0.41 0 CA-C-N 114.411 -1.268 . . . . 0.0 112.399 -166.884 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1013 ' ' LEU . . . . . 0.8 HD22 ' HB2' ' A' 1008 ' ' TYR . 8.0 mp -47.88 -43.26 28.46 Favored 'General case' 0 CA--C 1.507 -0.674 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -179.741 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1014 ' ' GLN . . . . . 1.071 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.8 OUTLIER -57.08 -47.79 80.17 Favored 'General case' 0 C--N 1.319 -0.753 0 O-C-N 123.299 0.374 . . . . 0.0 111.509 -167.724 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A 1015 ' ' GLN . . . . . 0.737 ' O ' ' HB3' ' A' 1019 ' ' LYS . 86.5 mm-40 -72.46 -37.98 68.37 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-O 120.93 0.395 . . . . 0.0 111.13 -176.651 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -69.33 -55.28 10.91 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.631 0.729 . . . . 0.0 110.828 -179.409 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.708 ' CE2' ' HG ' ' A' 1013 ' ' LEU . 13.6 m-85 -65.49 -39.57 92.07 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.758 -1.11 . . . . 0.0 113.779 -174.489 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.59 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 25.5 tptp -79.9 -28.91 39.8 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.501 -176.942 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1019 ' ' LYS . . . . . 0.737 ' HB3' ' O ' ' A' 1015 ' ' GLN . 0.0 OUTLIER -73.23 -45.32 56.77 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 175.072 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A 1020 ' ' GLN . . . . . 0.42 ' HB3' ' HG2' ' A' 1001 ' ' LYS . 55.9 mt-30 -54.91 -35.34 64.05 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.822 162.437 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1021 ' ' MET . . . . . 1.044 ' HG3' ' HB3' ' A' 1002 ' ' MET . 1.9 tmt? -64.71 -51.92 59.85 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 110.275 -0.268 . . . . 0.0 110.275 -179.021 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1022 ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' 1022 ' ' LEU . 0.0 OUTLIER -78.69 -8.61 58.86 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 119.511 -0.876 . . . . 0.0 109.778 -175.613 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 91.8 m -86.09 -36.88 19.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.08 174.547 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.553 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -79.28 -22.76 44.22 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-O 121.412 0.625 . . . . 0.0 109.415 173.743 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.728 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -86.27 -24.83 25.81 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.193 169.786 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.556 ' O ' HG23 ' A' 1030 ' ' VAL . 53.3 t60 -69.21 -36.28 77.09 Favored 'General case' 0 C--O 1.211 -0.947 0 N-CA-C 108.569 -0.901 . . . . 0.0 108.569 164.104 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1027 ' ' ALA . . . . . 0.553 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -58.4 -45.43 88.37 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 123.453 0.701 . . . . 0.0 111.204 162.043 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.637 HD21 ' N ' ' A' ' 995' ' ' LEU . 31.4 mt -56.96 -46.57 82.07 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 118.706 0.684 . . . . 0.0 109.64 173.642 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -59.33 -43.64 92.69 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 173.079 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' 1026 ' ' HIS . 17.0 t -66.15 -50.68 67.01 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 CA-C-O 121.854 0.835 . . . . 0.0 110.721 -177.104 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.78 ' O ' HD13 ' A' 1035 ' ' LEU . 17.3 m-20 -75.96 -31.05 58.85 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.139 -175.137 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.6 ' HA ' ' CD1' ' A' 1035 ' ' LEU . . . -69.13 -34.02 74.36 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 171.684 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.556 ' HB3' ' O ' ' A' 1030 ' ' VAL . 0.0 OUTLIER -58.63 -37.4 75.85 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 167.63 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.454 ' O ' ' HB3' ' A' 1037 ' ' ASP . 53.2 t30 -79.35 -51.41 9.44 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 114.334 -1.303 . . . . 0.0 112.702 -173.057 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.867 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 0.0 OUTLIER -59.8 -31.39 69.66 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 119.142 0.883 . . . . 0.0 111.485 -174.137 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.782 HD13 HG11 ' A' ' 925' ' ' VAL . 9.9 tp -68.82 -51.24 42.8 Favored 'General case' 0 C--N 1.344 0.338 0 C-N-CA 117.262 -1.775 . . . . 0.0 109.41 175.148 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.454 ' HB3' ' O ' ' A' 1034 ' ' ASN . 25.3 t70 -45.03 -42.32 8.3 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 114.856 -1.066 . . . . 0.0 111.251 173.181 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.491 ' CG1' ' HG3' ' A' ' 983' ' ' GLU . 45.6 t -61.7 -40.6 87.34 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.489 0 CA-C-N 114.559 -1.201 . . . . 0.0 112.476 177.635 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.789 HG12 HG13 ' A' ' 984' ' ' ILE . 1.9 mp -83.31 -25.0 7.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 118.589 0.632 . . . . 0.0 110.522 177.327 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.761 ' O ' ' HG3' ' A' 1043 ' ' ARG . 68.9 m-20 -61.2 -45.1 95.97 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 164.513 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -62.04 -48.89 78.25 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.653 173.375 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.889 ' HB2' ' HG2' ' A' ' 983' ' ' GLU . . . -54.98 -45.86 75.03 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.61 -176.394 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.761 ' HG3' ' O ' ' A' 1040 ' ' ASP . 0.0 OUTLIER -59.9 -42.76 94.54 Favored 'General case' 0 N--CA 1.441 -0.875 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.906 -174.799 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A 1044 ' ' LEU . . . . . 0.408 ' N ' ' HD3' ' A' 1043 ' ' ARG . 43.0 tp . . . . . 0 N--CA 1.451 -0.391 0 CA-C-O 121.13 0.49 . . . . 0.0 110.582 -178.684 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.434 ' HA ' ' HG2' ' A' ' 927' ' ' GLU . 35.0 mmtp . . . . . 0 CA--C 1.53 0.195 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.656 HG23 HD22 ' A' 1036 ' ' LEU . 32.2 m -62.93 -30.95 50.82 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-O 121.365 0.602 . . . . 0.0 110.322 178.325 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.38 -30.69 53.84 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.696 178.479 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 927' ' ' GLU . . . . . 0.61 ' O ' HG22 ' A' ' 930' ' ' THR . 7.7 pt-20 -76.4 -24.0 54.06 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 119.096 -1.042 . . . . 0.0 110.785 176.582 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -71.41 -29.94 65.49 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 171.551 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.539 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 86.9 t -80.35 -30.07 12.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.236 175.971 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.61 HG22 ' O ' ' A' ' 927' ' ' GLU . 2.8 t -65.81 -33.73 76.54 Favored 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 118.215 -1.394 . . . . 0.0 108.257 171.24 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -74.01 -53.51 7.02 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-N 115.366 -0.834 . . . . 0.0 113.572 176.341 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.539 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.2 pp -64.38 -48.37 75.75 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -177.16 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.464 HG23 HG13 ' A' ' 929' ' ' VAL . 54.6 t -69.35 -31.78 50.86 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.319 0 CA-C-O 120.755 0.312 . . . . 0.0 110.852 -175.825 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.561 ' HD2' ' C ' ' A' ' 934' ' ' LYS . 2.1 tmmm? -56.26 -50.3 71.73 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 175.44 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -57.88 -36.26 72.12 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.154 0.284 . . . . 0.0 111.29 -178.539 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.821 HG22 ' HB1' ' A' 1025 ' ' ALA . 86.1 t -50.82 -73.9 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.583 178.083 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 28.4 pt -67.25 -35.83 75.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -177.505 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -67.49 -55.73 12.38 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.733 0.778 . . . . 0.0 110.77 -174.601 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -73.47 -23.9 60.13 Favored 'General case' 0 N--CA 1.438 -1.067 0 C-N-CA 119.776 -0.77 . . . . 0.0 108.969 -176.83 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.608 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 44.5 t . . . . . 0 N--CA 1.443 -0.817 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.617 -178.809 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.739 ' HB3' ' HG3' ' A' 1002 ' ' MET . 21.0 m-85 . . . . . 0 C--O 1.221 -0.396 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 0.889 HG13 ' HD3' ' A' ' 953' ' ' PRO . 3.4 p -52.22 -36.81 36.05 Favored Pre-proline 0 CA--C 1.55 0.959 0 CA-C-N 118.506 0.594 . . . . 0.0 112.557 175.045 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 0.889 ' HD3' HG13 ' A' ' 952' ' ' VAL . 37.3 Cg_exo -53.47 -40.01 80.11 Favored 'Trans proline' 0 C--N 1.358 1.045 0 C-N-CA 121.699 1.599 . . . . 0.0 112.208 169.884 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.658 ' O ' HG23 ' A' ' 958' ' ' VAL . 8.5 ttt -76.33 -48.86 18.56 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.005 177.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.695 HG12 ' HA ' ' A' ' 952' ' ' VAL . 0.4 OUTLIER -54.05 -31.42 21.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.545 173.736 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 5.5 tttm -65.52 -40.97 93.61 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.064 170.738 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 957' ' ' GLU . . . . . 0.573 ' HG2' ' O ' ' A' ' 954' ' ' MET . 14.5 pt-20 -79.38 -42.95 24.4 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 120.393 -0.523 . . . . 0.0 111.023 -176.2 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.658 HG23 ' O ' ' A' ' 954' ' ' MET . 2.2 t -66.26 -38.26 81.49 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.821 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 173.944 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 959' ' ' GLY . . . . . 0.429 ' O ' ' HG2' ' A' ' 963' ' ' ARG . . . -58.49 -38.88 92.16 Favored Glycine 0 N--CA 1.434 -1.462 0 N-CA-C 110.813 -0.915 . . . . 0.0 110.813 176.15 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 960' ' ' LEU . . . . . 0.636 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 25.3 tp -69.14 -35.82 76.77 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 120.766 0.317 . . . . 0.0 110.818 174.888 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -72.29 -43.31 64.43 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.135 0.493 . . . . 0.0 111.643 -176.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.88 HD11 ' HG ' ' A' ' 995' ' ' LEU . 4.4 pp -86.33 -16.7 36.61 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.968 -176.935 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.636 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 0.5 OUTLIER -75.42 -32.79 60.83 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 119.064 -1.054 . . . . 0.0 109.939 164.239 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 964' ' ' THR . . . . . 0.562 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 59.1 m -64.55 -34.44 78.25 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 175.169 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.516 HD21 HD21 ' A' 1035 ' ' LEU . 26.9 tp -62.78 -41.51 99.28 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.776 173.328 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 0.744 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.0 tt -70.06 -36.68 75.16 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.049 -175.327 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -72.45 -38.13 68.37 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.306 178.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 7.9 p -66.07 -41.01 91.33 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 118.644 0.656 . . . . 0.0 110.005 175.616 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.564 HG12 HG23 ' A' ' 984' ' ' ILE . 74.4 t -68.25 -39.11 80.58 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.526 173.631 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 970' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -66.53 -39.68 88.75 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 122.228 1.014 . . . . 0.0 108.77 -177.811 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.569 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 28.7 tt0 -70.69 -30.58 67.19 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 114.488 -1.233 . . . . 0.0 110.335 178.179 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 70.2 m -66.26 -17.74 64.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.272 173.423 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.615 ' HA ' HD13 ' A' ' 984' ' ' ILE . 10.5 tt -69.41 -51.81 16.17 Favored Pre-proline 0 CA--C 1.53 0.187 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.776 -176.085 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.582 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 94.9 Cg_endo -87.42 2.04 6.9 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 121.178 1.252 . . . . 0.0 113.45 174.426 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' ' 971' ' ' GLU . 25.1 t . . . . . 0 C--N 1.328 -0.331 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.253 172.678 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.629 ' OG1' ' HA ' ' A' 1043 ' ' ARG . 85.5 m . . . . . 0 CA--C 1.537 0.47 0 CA-C-O 121.147 0.499 . . . . 0.0 110.778 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 981' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -50.79 -27.36 7.11 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 178.764 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 982' ' ' ARG . . . . . 0.511 ' HA ' ' HG2' ' A' ' 985' ' ' GLU . 0.0 OUTLIER -83.11 -21.87 33.55 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 119.481 1.037 . . . . 0.0 111.149 -176.127 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.458 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 1.4 mp0 -77.03 -38.7 52.32 Favored 'General case' 0 CA--C 1.499 -0.981 0 CA-C-O 121.764 0.792 . . . . 0.0 109.143 168.552 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.847 HG12 HG12 ' A' 1039 ' ' ILE . 73.8 mt -68.17 -36.28 74.63 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.18 0 CA-C-N 114.145 -1.389 . . . . 0.0 109.503 -176.354 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 985' ' ' GLU . . . . . 0.78 ' O ' ' HD3' ' A' ' 989' ' ' LYS . 13.3 pt-20 -74.29 -40.8 62.03 Favored 'General case' 0 N--CA 1.439 -0.988 0 C-N-CA 118.159 -1.416 . . . . 0.0 109.426 -178.557 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 986' ' ' MET . . . . . 0.53 ' O ' ' HB2' ' A' ' 989' ' ' LYS . 2.1 tmt? -68.63 -40.0 80.5 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.56 -174.428 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.973 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -71.88 -45.78 60.09 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.571 -174.104 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.744 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 29.4 pt20 -60.31 -23.89 64.56 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.808 175.284 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 989' ' ' LYS . . . . . 0.799 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 2.6 mptp? -72.55 -39.05 67.78 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.986 0.898 . . . . 0.0 111.05 171.868 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.591 ' HB3' ' O ' ' A' ' 987' ' ' ALA . 18.6 tp -54.32 -59.66 4.38 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.414 -1.267 . . . . 0.0 111.853 179.135 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.528 ' HB2' HD13 ' A' 1035 ' ' LEU . 0.4 OUTLIER -59.96 -33.06 71.41 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.745 0.783 . . . . 0.0 109.417 177.722 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 992' ' ' ASN . . . . . 0.799 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 22.7 t-20 -52.03 -52.57 50.01 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 113.911 -1.495 . . . . 0.0 111.438 179.569 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 2.6 p -77.59 -31.61 53.12 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.673 0.619 . . . . 0.0 112.673 -178.313 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -68.47 -40.51 80.99 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 119.729 -0.789 . . . . 0.0 111.189 176.774 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 0.88 ' HG ' HD11 ' A' ' 962' ' ' LEU . 0.9 OUTLIER -57.09 -36.65 70.84 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.066 0.546 . . . . 0.0 109.935 166.843 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -66.65 -30.39 70.63 Favored 'General case' 0 C--N 1.312 -1.052 0 C-N-CA 118.985 -1.086 . . . . 0.0 110.903 174.756 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -75.42 -38.33 59.86 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.853 -0.53 . . . . 0.0 110.678 174.905 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.882 HD13 ' HB2' ' A' 1025 ' ' ALA . 1.7 tp -56.23 -44.85 80.0 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 120.968 0.413 . . . . 0.0 110.843 178.546 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.51 ' O ' ' HB2' ' A' 1003 ' ' LYS . 77.8 mt -61.21 -43.97 97.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.084 -176.493 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 32.0 m-80 -58.64 -37.49 76.06 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.251 0.548 . . . . 0.0 111.915 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.492 ' O ' ' HB3' ' A' 1017 ' ' TYR . 33.6 mmtp -79.1 -40.92 29.88 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 122.291 1.043 . . . . 0.0 108.656 -176.319 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.739 ' HG3' ' HB3' ' A' ' 951' ' ' TYR . 9.0 tpp -61.15 -30.09 70.18 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 113.693 -1.594 . . . . 0.0 109.461 176.635 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.563 ' O ' ' HG3' ' A' 1006 ' ' GLN . 4.8 tptm -75.41 -53.54 8.54 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 114.928 -1.033 . . . . 0.0 111.696 -166.652 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.752 ' HB3' HD23 ' A' 1013 ' ' LEU . 7.3 mp -76.61 -12.43 60.01 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.149 -178.593 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.677 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -67.91 -42.63 80.81 Favored 'General case' 0 C--O 1.212 -0.874 0 C-N-CA 119.525 -0.87 . . . . 0.0 109.153 177.034 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.879 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 1.2 pp0? -74.77 -33.16 62.25 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 119.024 -0.512 . . . . 0.0 111.668 170.3 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.602 ' CG ' ' HA ' ' A' 1004 ' ' LEU . 20.7 mm-40 -47.53 -53.37 14.62 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.116 0.484 . . . . 0.0 110.388 175.609 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.916 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 40.1 m-85 -119.6 40.35 3.4 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.277 -0.569 . . . . 0.0 110.407 175.249 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1009 ' ' VAL . . . . . 1.074 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 14.8 p -51.62 -22.29 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 121.382 0.611 . . . . 0.0 110.632 173.733 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 20.0 mmt -41.16 -38.18 1.03 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.242 -1.345 . . . . 0.0 111.706 175.486 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1011 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -174.47 -81.77 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 174.0 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 16.6 p -53.43 -73.52 0.04 OUTLIER 'General case' 0 C--O 1.241 0.649 0 CA-C-N 115.12 -0.945 . . . . 0.0 113.051 -166.0 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1013 ' ' LEU . . . . . 0.916 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 3.2 mp -46.1 -42.17 13.27 Favored 'General case' 0 CA--C 1.501 -0.921 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -179.502 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1014 ' ' GLN . . . . . 1.074 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 1.5 tt0 -57.33 -46.37 83.33 Favored 'General case' 0 N--CA 1.438 -1.035 0 O-C-N 123.753 0.658 . . . . 0.0 111.616 -166.552 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1015 ' ' GLN . . . . . 0.716 ' O ' ' HB3' ' A' 1019 ' ' LYS . 47.2 mt-30 -72.52 -34.46 67.6 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 121.013 0.435 . . . . 0.0 110.103 -174.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -71.17 -53.25 15.11 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.856 0.836 . . . . 0.0 110.466 176.952 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.717 ' CE2' ' HG ' ' A' 1013 ' ' LEU . 7.1 m-85 -67.77 -38.82 83.92 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.618 -1.174 . . . . 0.0 113.95 -172.479 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.513 ' HD2' ' SD ' ' A' 1021 ' ' MET . 24.0 tptm -80.03 -29.88 39.42 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.91 -176.216 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1019 ' ' LYS . . . . . 0.716 ' HB3' ' O ' ' A' 1015 ' ' GLN . 1.5 tmtt? -76.21 -40.32 52.51 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.73 176.552 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1020 ' ' GLN . . . . . 0.419 ' N ' ' HD3' ' A' 1019 ' ' LYS . 94.1 mt-30 -63.9 -28.48 69.86 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.731 162.84 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.733 ' HG2' HD12 ' A' ' 998' ' ' LEU . 1.6 ttp -65.61 -47.11 76.77 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 176.622 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1022 ' ' LEU . . . . . 0.701 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -79.19 -8.96 59.42 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 119.165 -1.014 . . . . 0.0 109.767 -179.249 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 92.2 m -77.0 -44.03 32.5 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 172.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.47 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -78.88 -21.1 47.96 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-O 121.383 0.611 . . . . 0.0 109.659 175.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.882 ' HB2' HD13 ' A' ' 998' ' ' LEU . . . -83.94 -24.01 30.88 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.128 170.464 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.539 ' HB2' ' O ' ' A' 1022 ' ' LEU . 4.4 t-80 -77.96 -22.66 49.15 Favored 'General case' 0 C--O 1.216 -0.658 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 165.846 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1027 ' ' ALA . . . . . 0.47 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -69.6 -42.39 74.47 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 123.094 0.558 . . . . 0.0 109.768 162.378 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.66 HD21 ' N ' ' A' ' 995' ' ' LEU . 34.7 mt -57.25 -49.48 75.93 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 169.696 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -58.05 -43.23 86.77 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 174.913 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.469 ' O ' ' HB2' ' A' 1033 ' ' LYS . 2.8 t -67.72 -51.01 55.23 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.234 0 CA-C-O 121.287 0.565 . . . . 0.0 110.394 -176.1 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.635 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 18.0 m-20 -76.6 -27.31 55.73 Favored 'General case' 0 C--O 1.213 -0.821 0 CA-C-N 115.475 -0.784 . . . . 0.0 112.024 -176.424 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.652 ' HA ' HD22 ' A' 1035 ' ' LEU . . . -61.47 -40.7 95.47 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 167.835 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.469 ' HB2' ' O ' ' A' 1030 ' ' VAL . 94.3 mttt -62.86 -39.72 95.27 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.444 0.64 . . . . 0.0 109.72 171.95 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.635 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 46.6 t30 -76.26 -54.67 6.45 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.856 -170.853 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.973 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 0.6 OUTLIER -61.71 -42.99 99.69 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 118.782 -0.628 . . . . 0.0 110.953 -173.307 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.656 HD22 HG23 ' A' ' 925' ' ' VAL . 4.6 pp -70.04 -39.87 75.46 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 116.472 -2.091 . . . . 0.0 109.628 -178.67 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.51 ' N ' HD12 ' A' 1036 ' ' LEU . 38.2 t70 -53.23 -43.33 67.21 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 122.098 0.951 . . . . 0.0 110.83 173.249 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.559 ' HB ' ' O ' ' A' 1035 ' ' LEU . 9.7 t -50.83 -48.82 27.99 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.585 0 CA-C-N 114.061 -1.427 . . . . 0.0 111.299 172.29 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.847 HG12 HG12 ' A' ' 984' ' ' ILE . 2.7 mp -74.95 -34.05 31.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 118.45 0.568 . . . . 0.0 110.912 178.36 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.511 ' O ' ' HG3' ' A' 1043 ' ' ARG . 83.5 m-20 -51.39 -53.9 31.94 Favored 'General case' 0 C--O 1.246 0.88 0 CA-C-O 122.403 1.097 . . . . 0.0 109.237 172.165 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -76.78 -32.14 57.48 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 115.122 -0.945 . . . . 0.0 110.9 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.661 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -54.82 -50.84 67.6 Favored 'General case' 0 CA--C 1.501 -0.922 0 C-N-CA 123.389 0.676 . . . . 0.0 111.62 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.663 ' HD3' ' N ' ' A' 1044 ' ' LEU . 0.0 OUTLIER -61.94 -37.66 85.54 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.723 -176.622 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A 1044 ' ' LEU . . . . . 0.663 ' N ' ' HD3' ' A' 1043 ' ' ARG . 15.4 mt . . . . . 0 CA--C 1.532 0.285 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.967 178.316 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.573 ' HB3' HG21 ' A' ' 968' ' ' THR . 51.2 mmtt . . . . . 0 N--CA 1.447 -0.6 0 CA-C-O 120.906 0.384 . . . . 0.0 111.249 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.67 ' CG2' ' HB2' ' A' 1036 ' ' LEU . 17.0 m -62.04 -35.06 66.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.365 0.602 . . . . 0.0 110.8 -178.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.5 -27.16 51.78 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 118.598 -0.715 . . . . 0.0 111.863 177.383 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 927' ' ' GLU . . . . . 0.484 ' O ' HG22 ' A' ' 930' ' ' THR . 6.6 pt-20 -75.75 -23.81 56.03 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 120.482 1.492 . . . . 0.0 109.784 178.774 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -76.36 -29.14 57.07 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 121.347 0.594 . . . . 0.0 110.19 172.324 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.636 HG21 HD23 ' A' 1036 ' ' LEU . 82.0 t -82.15 -31.99 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.729 175.678 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.484 HG22 ' O ' ' A' ' 927' ' ' GLU . 5.8 t -62.47 -29.34 70.46 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 120.349 1.432 . . . . 0.0 107.873 171.714 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -70.32 -52.22 18.41 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-N 114.452 -1.249 . . . . 0.0 113.17 171.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.461 HD21 HG22 ' A' ' 929' ' ' VAL . 2.0 pp -62.16 -48.31 80.66 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 117.648 0.724 . . . . 0.0 112.792 -178.03 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.701 ' O ' HG22 ' A' ' 936' ' ' VAL . 56.7 t -60.81 -41.83 90.06 Favored 'Isoleucine or valine' 0 C--O 1.239 0.535 0 CA-C-O 121.777 0.799 . . . . 0.0 109.703 -177.813 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 934' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -53.72 -43.3 68.92 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.7 -1.136 . . . . 0.0 110.322 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -67.89 -31.64 71.57 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -176.559 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.701 HG22 ' O ' ' A' ' 933' ' ' VAL . 2.9 m -61.59 -56.95 14.45 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.271 0 C-N-CA 121.004 -0.278 . . . . 0.0 111.048 -174.986 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.431 ' N ' HG23 ' A' ' 936' ' ' VAL . 7.1 pt -78.52 -40.32 24.3 Favored 'Isoleucine or valine' 0 C--O 1.25 1.118 0 CA-C-O 121.12 0.486 . . . . 0.0 111.257 -178.478 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -65.55 -49.21 69.75 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.696 -171.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 26.2 mmt -71.92 -26.18 62.2 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.6 -179.074 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 940' ' ' SER . . . . . . . . . . . . . 5.2 m . . . . . 0 CA--C 1.515 -0.368 0 CA-C-O 121.218 0.533 . . . . 0.0 111.421 -176.121 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.794 ' CE1' ' HD3' ' A' 1018 ' ' LYS . 39.0 m-85 . . . . . 0 N--CA 1.467 0.385 0 N-CA-C 114.397 1.258 . . . . 0.0 114.397 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 0.628 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 22.3 t -43.66 -48.45 19.72 Favored Pre-proline 0 C--N 1.322 -0.606 0 C-N-CA 122.793 0.437 . . . . 0.0 111.98 174.291 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 0.628 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 13.8 Cg_exo -47.6 -49.26 13.71 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 122.861 2.374 . . . . 0.0 113.995 178.303 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.621 ' HG3' ' O ' ' A' ' 951' ' ' TYR . 4.5 ppp? -76.43 -32.26 58.35 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.212 0.529 . . . . 0.0 110.54 179.297 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.51 ' HA ' HG12 ' A' ' 958' ' ' VAL . 78.5 t -57.42 -35.3 49.0 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.374 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.327 168.156 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.493 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 9.9 tmtt? -65.71 -32.25 73.7 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.626 0.25 . . . . 0.0 111.122 173.489 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -77.99 -45.45 23.74 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.831 0.348 . . . . 0.0 110.993 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.51 HG12 ' HA ' ' A' ' 955' ' ' VAL . 13.3 p -76.4 -31.95 21.21 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.19 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.069 178.386 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 959' ' ' GLY . . . . . 0.469 ' O ' ' HG2' ' A' ' 963' ' ' ARG . . . -61.21 -38.39 95.57 Favored Glycine 0 N--CA 1.446 -0.685 0 N-CA-C 110.867 -0.893 . . . . 0.0 110.867 173.938 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 960' ' ' LEU . . . . . 0.492 HD12 HH11 ' A' ' 963' ' ' ARG . 15.5 tp -64.26 -42.79 96.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.929 0.395 . . . . 0.0 110.506 175.285 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -73.28 -34.61 65.87 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.087 0.47 . . . . 0.0 111.936 -176.644 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.863 HD11 HD22 ' A' ' 995' ' ' LEU . 3.6 pp -80.83 -30.34 35.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.83 -179.092 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.492 HH11 HD12 ' A' ' 960' ' ' LEU . 9.8 ptp85 -72.71 -33.8 66.68 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 119.629 -0.828 . . . . 0.0 110.943 170.538 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 964' ' ' THR . . . . . 0.455 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 17.6 m -66.57 -33.52 75.85 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 119.603 -0.839 . . . . 0.0 108.974 176.845 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.487 ' O ' HG23 ' A' ' 969' ' ' VAL . 17.2 tp -60.84 -49.45 77.44 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.558 0.694 . . . . 0.0 109.612 170.306 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 0.573 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.4 tt -55.26 -45.34 76.1 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 114.459 -1.246 . . . . 0.0 109.735 -178.913 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -66.42 -42.01 88.39 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.007 -0.997 . . . . 0.0 112.131 178.896 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.573 HG21 ' HB3' ' A' ' 924' ' ' LYS . 0.8 OUTLIER -61.85 -34.91 76.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 119.193 0.906 . . . . 0.0 110.817 175.838 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.976 HG12 HG23 ' A' ' 984' ' ' ILE . 52.7 t -73.38 -42.03 57.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.916 175.54 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.471 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 31.4 t70 -69.9 -40.02 75.86 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 122.111 0.957 . . . . 0.0 109.228 -175.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.608 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 9.1 tp10 -66.69 -31.89 72.84 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.63 -1.168 . . . . 0.0 109.483 177.036 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.65 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 27.3 m -68.76 -17.35 64.02 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.256 174.681 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.753 ' HB2' HG21 ' A' ' 984' ' ' ILE . 9.0 tt -64.39 -51.94 57.07 Favored Pre-proline 0 C--O 1.226 -0.134 0 C-N-CA 120.451 -0.499 . . . . 0.0 109.969 -178.876 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.741 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 6.3 Cg_exo -80.99 -4.0 12.5 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 121.515 1.477 . . . . 0.0 113.262 171.571 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.65 ' HB ' ' HA ' ' A' ' 972' ' ' SER . 24.6 t . . . . . 0 C--N 1.329 -0.294 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.204 172.206 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.512 HG23 ' CB ' ' A' 1042 ' ' ALA . 20.6 m . . . . . 0 CA--C 1.532 0.255 0 CA-C-O 121.382 0.611 . . . . 0.0 110.308 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.623 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 11.6 m170 -50.88 -39.71 54.63 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 115.061 -0.972 . . . . 0.0 111.722 177.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 982' ' ' ARG . . . . . 0.428 ' HE ' ' HB3' ' A' ' 982' ' ' ARG . 5.6 ptp180 -83.41 -20.71 33.67 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.629 -0.428 . . . . 0.0 112.116 -173.03 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.599 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 1.3 mp0 -71.44 -34.7 70.51 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-O 121.614 0.721 . . . . 0.0 109.275 167.58 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.976 HG23 HG12 ' A' ' 969' ' ' VAL . 58.1 mt -72.24 -30.52 35.84 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-N 114.662 -1.154 . . . . 0.0 108.895 179.282 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 985' ' ' GLU . . . . . 0.623 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 35.5 mt-10 -65.41 -52.46 53.22 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.569 174.199 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 51.9 tpp -70.83 -42.52 70.09 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.913 -171.632 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.65 ' HB1' ' HB3' ' A' 1035 ' ' LEU . . . -74.21 -50.69 18.09 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.45 -172.263 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.631 ' O ' ' HB2' ' A' ' 992' ' ' ASN . 22.3 pt20 -65.48 -22.2 66.71 Favored 'General case' 0 C--O 1.226 -0.151 0 CA-C-O 121.617 0.723 . . . . 0.0 109.204 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 989' ' ' LYS . . . . . 0.723 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 9.0 ttmm -73.47 -44.42 58.01 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 114.786 -1.097 . . . . 0.0 112.018 171.214 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.67 ' HB3' HD21 ' A' 1035 ' ' LEU . 15.6 tp -57.39 -58.36 8.62 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 119.569 -0.852 . . . . 0.0 111.705 -179.173 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.525 ' HB3' HD23 ' A' 1035 ' ' LEU . 3.2 pp -57.86 -29.62 65.15 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.38 0.609 . . . . 0.0 110.358 177.82 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 992' ' ' ASN . . . . . 0.723 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 44.9 t-20 -55.55 -55.91 26.41 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.637 -1.165 . . . . 0.0 110.986 175.903 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 46.2 m -73.01 -32.98 65.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.997 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 994' ' ' ASP . . . . . 0.718 ' C ' HD22 ' A' ' 998' ' ' LEU . 2.6 m-20 -55.08 -62.5 1.62 Allowed 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.903 174.412 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 0.863 HD22 HD11 ' A' ' 962' ' ' LEU . 18.0 tp -48.2 -30.06 4.32 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 123.291 0.37 . . . . 0.0 111.165 175.894 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -69.74 -37.87 76.63 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 119.556 -0.858 . . . . 0.0 111.764 178.433 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -78.26 -39.55 39.81 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.523 0.677 . . . . 0.0 109.937 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 1.041 HD23 ' HG ' ' A' 1028 ' ' LEU . 0.0 OUTLIER -58.18 -34.18 70.05 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.086 179.746 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.693 ' O ' ' HG3' ' A' 1002 ' ' MET . 44.1 mt -67.1 -37.74 79.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 CA-C-N 115.11 -0.95 . . . . 0.0 111.78 172.881 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -60.56 -34.77 74.64 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.365 0.602 . . . . 0.0 111.668 179.159 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.723 ' HD2' ' OE1' ' A' 1020 ' ' GLN . 42.8 mmtm -82.61 -41.34 19.63 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.418 0.628 . . . . 0.0 110.904 -175.569 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.693 ' HG3' ' O ' ' A' ' 999' ' ' ILE . 0.0 OUTLIER -61.25 -25.95 67.43 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 122.248 1.023 . . . . 0.0 108.642 175.326 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.603 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 26.8 tptt -71.83 -54.07 11.29 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 113.913 -1.494 . . . . 0.0 110.458 -167.338 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.806 ' HB3' HD23 ' A' 1013 ' ' LEU . 8.7 mp -73.65 -13.48 61.0 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.671 -179.424 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.772 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -68.97 -44.98 71.82 Favored 'General case' 0 C--N 1.319 -0.747 0 C-N-CA 119.533 -0.867 . . . . 0.0 109.983 178.087 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.82 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 1.0 OUTLIER -74.44 -28.57 61.11 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 121.891 -0.506 . . . . 0.0 111.265 173.406 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.492 ' CG ' ' HA ' ' A' 1004 ' ' LEU . 15.3 mm-40 -50.16 -57.54 7.51 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.277 0.56 . . . . 0.0 110.25 173.995 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1008 ' ' TYR . . . . . 1.073 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 24.2 m-85 -107.16 35.06 3.17 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.984 175.355 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1009 ' ' VAL . . . . . 1.047 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 11.2 p -45.39 -29.11 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.494 0 O-C-N 123.536 0.522 . . . . 0.0 110.954 174.8 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 25.8 ttp -40.47 -45.78 2.31 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.52 -1.218 . . . . 0.0 111.599 178.745 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1011 ' ' THR . . . . . . . . . . . . . 28.1 m -161.53 -82.37 0.04 OUTLIER 'General case' 0 C--O 1.245 0.853 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 176.367 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 11.2 p -55.75 -71.64 0.08 Allowed 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.067 -0.97 . . . . 0.0 113.115 -164.328 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1013 ' ' LEU . . . . . 1.073 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 6.5 mp -51.84 -38.0 54.18 Favored 'General case' 0 CA--C 1.506 -0.736 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -178.207 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1014 ' ' GLN . . . . . 1.047 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.2 OUTLIER -55.19 -53.54 54.76 Favored 'General case' 0 N--CA 1.442 -0.837 0 O-C-N 123.423 0.452 . . . . 0.0 111.599 -168.264 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -73.45 -36.55 65.91 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.569 -175.677 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1016 ' ' GLU . . . . . 0.466 ' HG2' ' NE2' ' A' 1020 ' ' GLN . 36.5 tt0 -68.27 -57.63 5.67 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.566 178.775 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.772 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 7.3 m-85 -62.03 -33.15 73.82 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 113.696 0.999 . . . . 0.0 113.696 -176.324 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.794 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 35.0 tptt -80.24 -32.12 38.43 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.582 -176.545 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1019 ' ' LYS . . . . . 0.445 ' HA ' ' HD2' ' A' 1019 ' ' LYS . 0.2 OUTLIER -74.59 -35.37 63.0 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 176.347 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A 1020 ' ' GLN . . . . . 0.723 ' OE1' ' HD2' ' A' 1001 ' ' LYS . 77.5 mt-30 -56.59 -41.16 76.52 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.718 158.679 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.567 ' HG3' ' HB3' ' A' 1002 ' ' MET . 1.5 tmt? -65.99 -51.8 55.12 Favored 'General case' 0 C--O 1.219 -0.544 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -172.468 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.84 -18.5 53.91 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 119.676 -0.81 . . . . 0.0 110.394 -172.454 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 34.6 m -84.17 -27.02 28.36 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 175.209 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.754 ' HB1' ' CD1' ' A' ' 998' ' ' LEU . . . -81.36 -28.14 34.59 Favored 'General case' 0 C--O 1.212 -0.904 0 CA-C-N 115.454 -0.793 . . . . 0.0 109.596 172.542 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.484 ' HA ' ' HB2' ' A' 1028 ' ' LEU . . . -83.38 -19.6 35.76 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 169.399 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.522 ' O ' HG23 ' A' 1030 ' ' VAL . 32.7 t-80 -75.12 -21.75 58.65 Favored 'General case' 0 C--O 1.213 -0.863 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 161.522 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1027 ' ' ALA . . . . . 0.681 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -74.32 -39.46 62.84 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.33 0.652 . . . . 0.0 110.098 166.464 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1028 ' ' LEU . . . . . 1.041 ' HG ' HD23 ' A' ' 998' ' ' LEU . 23.0 mt -55.92 -49.59 73.03 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 164.037 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1029 ' ' ALA . . . . . 0.514 ' CB ' HG22 ' A' ' 933' ' ' VAL . . . -60.21 -38.79 84.4 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 112.64 0.607 . . . . 0.0 112.64 177.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.522 HG23 ' O ' ' A' 1026 ' ' HIS . 11.3 t -75.89 -51.46 20.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.358 0.599 . . . . 0.0 110.995 -175.763 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.591 ' O ' HD22 ' A' 1035 ' ' LEU . 6.6 m-20 -75.39 -33.59 61.02 Favored 'General case' 0 C--O 1.212 -0.907 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.149 -176.384 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.432 ' HB1' HD22 ' A' ' 965' ' ' LEU . . . -70.88 -24.99 62.6 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.559 -0.456 . . . . 0.0 109.938 174.333 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.501 ' HB3' ' O ' ' A' 1030 ' ' VAL . 50.6 tttm -63.38 -52.2 62.64 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 167.4 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.48 ' O ' HG23 ' A' 1038 ' ' VAL . 52.5 t30 -63.51 -50.12 70.84 Favored 'General case' 0 C--O 1.209 -1.038 0 CA-C-N 114.599 -1.182 . . . . 0.0 111.48 -177.834 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.67 HD21 ' HB3' ' A' ' 990' ' ' LEU . 0.0 OUTLIER -59.29 -42.07 90.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 119.395 -0.336 . . . . 0.0 110.498 -178.067 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.67 ' HB2' ' CG2' ' A' ' 925' ' ' VAL . 3.2 pp -69.69 -41.26 75.66 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 117.549 -1.66 . . . . 0.0 109.295 179.712 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 14.1 t70 -56.3 -40.0 73.64 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 114.37 -1.287 . . . . 0.0 109.786 175.246 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.542 ' HB ' ' O ' ' A' 1035 ' ' LEU . 6.6 t -53.47 -48.34 58.0 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.091 0 CA-C-N 113.822 -1.536 . . . . 0.0 111.053 174.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.601 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 2.0 mp -74.27 -33.96 35.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 118.792 0.723 . . . . 0.0 111.044 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.442 ' O ' ' HG3' ' A' 1043 ' ' ARG . 0.5 OUTLIER -62.06 -49.87 74.23 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.21 0.529 . . . . 0.0 110.084 174.353 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -63.7 -40.71 97.47 Favored 'General case' 0 C--O 1.213 -0.862 0 C-N-CA 120.334 -0.546 . . . . 0.0 109.612 172.488 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.601 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -53.3 -52.83 57.85 Favored 'General case' 0 CA--C 1.494 -1.205 0 C-N-CA 123.619 0.768 . . . . 0.0 112.115 -175.79 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.609 ' HD3' ' N ' ' A' 1044 ' ' LEU . 0.1 OUTLIER -61.93 -44.12 97.42 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.034 -174.83 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A 1044 ' ' LEU . . . . . 0.609 ' N ' ' HD3' ' A' 1043 ' ' ARG . 3.7 tt . . . . . 0 N--CA 1.445 -0.707 0 CA-C-O 121.484 0.659 . . . . 0.0 110.291 -175.387 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 924' ' ' LYS . . . . . . . . . . . . . 2.0 tppp? . . . . . 0 CA--C 1.535 0.368 0 CA-C-O 120.766 0.317 . . . . 0.0 111.38 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.726 HG21 HD23 ' A' 1036 ' ' LEU . 26.9 m -64.15 -29.34 47.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.316 0.579 . . . . 0.0 111.092 176.043 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -70.51 -32.93 70.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.441 -178.628 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 927' ' ' GLU . . . . . 0.691 ' HA ' ' HB ' ' A' ' 930' ' ' THR . 10.8 pt-20 -76.91 -24.22 52.47 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 118.951 -1.1 . . . . 0.0 111.004 176.059 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -69.14 -31.08 69.5 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 172.316 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.587 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 43.7 t -80.45 -30.76 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.516 173.174 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.691 ' HB ' ' HA ' ' A' ' 927' ' ' GLU . 6.2 m -56.09 -43.32 77.94 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 166.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -69.54 -52.9 18.91 Favored Glycine 0 CA--C 1.531 1.074 0 CA-C-N 114.744 -1.116 . . . . 0.0 113.941 175.518 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.587 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.9 pp -65.78 -45.88 80.83 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 117.508 0.654 . . . . 0.0 112.763 -174.893 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 56.0 t -66.05 -36.43 77.45 Favored 'Isoleucine or valine' 0 C--O 1.239 0.509 0 CA-C-O 121.21 0.529 . . . . 0.0 110.636 -177.159 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.519 ' O ' ' HB3' ' A' ' 938' ' ' GLU . 60.9 tttt -63.79 -31.88 73.2 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.574 179.15 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 0.608 ' O ' ' HB2' ' A' ' 939' ' ' MET . . . -66.27 -40.88 90.43 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 121.946 -0.472 . . . . 0.0 110.724 175.124 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.847 HG22 ' HB1' ' A' 1025 ' ' ALA . 54.1 t -50.38 -76.73 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.342 -177.919 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.442 HG13 ' N ' ' A' ' 938' ' ' GLU . 25.0 pt -80.35 -45.29 22.15 Favored 'Isoleucine or valine' 0 C--O 1.244 0.776 0 CA-C-O 121.191 0.52 . . . . 0.0 112.188 -173.539 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.519 ' HB3' ' O ' ' A' ' 934' ' ' LYS . 31.7 tt0 -67.92 -47.36 68.97 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-O 121.267 0.556 . . . . 0.0 109.665 -169.917 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.608 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 63.6 mtt -74.46 -23.94 58.97 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.814 178.896 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.659 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 29.1 p . . . . . 0 N--CA 1.471 0.576 0 CA-C-O 121.578 0.704 . . . . 0.0 110.512 -176.632 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.996 ' HB3' ' HG2' ' A' 1002 ' ' MET . 24.9 m-85 . . . . . 0 C--O 1.22 -0.495 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 0.716 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 64.4 t -60.54 -53.14 67.46 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 110.466 -0.198 . . . . 0.0 110.466 175.398 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 0.716 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 17.3 Cg_exo -48.55 -34.5 26.61 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 122.315 2.01 . . . . 0.0 113.03 167.169 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.49 ' O ' HG12 ' A' ' 958' ' ' VAL . 34.3 tpp -73.26 -31.99 64.42 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.145 177.049 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.549 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 89.0 t -52.33 -39.53 28.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 169.62 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.513 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 8.0 tttt -67.31 -37.36 83.21 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.692 174.992 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -78.68 -46.82 18.24 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.992 0.368 . . . . 0.0 111.992 -173.223 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.535 HG11 HD21 ' A' ' 998' ' ' LEU . 12.5 p -86.63 -24.87 6.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 -178.206 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -65.25 -27.13 72.05 Favored Glycine 0 N--CA 1.445 -0.754 0 N-CA-C 110.24 -1.144 . . . . 0.0 110.24 171.492 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 960' ' ' LEU . . . . . 0.571 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 10.3 tt -76.92 -35.14 57.54 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.253 -0.473 . . . . 0.0 109.957 175.911 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.417 ' HB1' ' HB3' ' A' ' 932' ' ' LEU . . . -71.17 -42.09 69.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.306 -175.749 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.855 HD13 HD22 ' A' ' 991' ' ' LEU . 0.5 OUTLIER -67.41 -42.83 82.62 Favored 'General case' 0 C--O 1.217 -0.628 0 CA-C-O 118.853 -0.594 . . . . 0.0 111.056 170.757 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.571 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 29.2 ptt180 -64.87 -31.55 72.84 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 119.912 1.233 . . . . 0.0 110.381 -179.067 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 34.2 m -68.79 -33.99 74.79 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.497 HD21 HD21 ' A' 1035 ' ' LEU . 22.0 tp -70.92 -36.27 72.6 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.581 -1.19 . . . . 0.0 109.556 176.027 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 0.6 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.5 tt -71.77 -39.5 69.92 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 114.828 -1.078 . . . . 0.0 108.399 -175.312 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -74.05 -28.05 61.22 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 114.986 -1.006 . . . . 0.0 112.155 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.51 ' OG1' HG12 ' A' ' 925' ' ' VAL . 5.2 p -74.46 -41.05 61.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 118.475 0.579 . . . . 0.0 110.164 175.324 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.898 HG12 HG23 ' A' ' 984' ' ' ILE . 60.8 t -68.73 -36.48 74.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.564 172.251 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.458 ' O ' ' HB3' ' A' ' 973' ' ' LEU . 24.1 t70 -70.87 -37.37 73.07 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.626 0.727 . . . . 0.0 109.175 179.652 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.615 ' O ' HG23 ' A' ' 975' ' ' VAL . 14.0 tp10 -65.88 -32.85 74.6 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.418 176.434 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.401 ' HA ' ' CG2' ' A' ' 975' ' ' VAL . 69.8 m -69.04 -17.59 63.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.055 175.406 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.724 ' HB2' HG21 ' A' ' 984' ' ' ILE . 9.2 tt -67.68 -51.42 30.79 Favored Pre-proline 0 CA--C 1.538 0.505 0 CA-C-O 119.543 -0.265 . . . . 0.0 110.43 -178.184 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.469 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 90.2 Cg_endo -82.9 2.07 8.72 Favored 'Trans proline' 0 C--N 1.356 0.932 0 C-N-CA 121.359 1.373 . . . . 0.0 112.955 170.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.615 HG23 ' O ' ' A' ' 971' ' ' GLU . 26.0 t . . . . . 0 C--N 1.33 -0.248 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 166.675 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.415 ' HA ' ' HB1' ' A' 1042 ' ' ALA . 89.7 m . . . . . 0 C--O 1.232 0.179 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.568 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 0.3 OUTLIER -58.12 -33.43 69.14 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 114.152 -1.386 . . . . 0.0 111.669 -179.861 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -84.25 -21.02 31.28 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 120.29 -0.564 . . . . 0.0 112.404 -176.168 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.516 ' HG3' HG13 ' A' 1038 ' ' VAL . 0.3 OUTLIER -73.14 -33.62 65.62 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 168.382 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.898 HG23 HG12 ' A' ' 969' ' ' VAL . 52.6 mt -68.66 -31.99 53.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.213 176.812 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 985' ' ' GLU . . . . . 0.568 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 46.2 mt-10 -62.69 -53.48 53.8 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.348 0.594 . . . . 0.0 109.751 175.687 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 89.8 mtp -69.84 -43.45 71.9 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.557 -171.688 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 1.065 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -67.78 -51.03 53.64 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.062 -0.972 . . . . 0.0 112.636 -171.842 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.6 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 25.3 pt20 -63.52 -28.39 69.92 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 119.815 -0.754 . . . . 0.0 111.232 -179.33 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 989' ' ' LYS . . . . . 0.721 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 90.9 mttt -70.04 -40.95 74.84 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.59 0.709 . . . . 0.0 111.492 172.46 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.62 HD23 ' HB3' ' A' 1035 ' ' LEU . 14.2 tp -49.6 -60.81 2.53 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 114.799 -1.092 . . . . 0.0 113.013 -176.963 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.855 HD22 HD13 ' A' ' 962' ' ' LEU . 5.1 tt -69.14 -27.45 65.57 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.239 0.542 . . . . 0.0 109.547 -179.53 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 992' ' ' ASN . . . . . 0.721 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 33.1 t-20 -51.08 -50.67 58.27 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.355 177.371 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 14.6 m -76.85 -33.32 57.9 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -65.31 -40.82 94.28 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 120.499 -0.481 . . . . 0.0 111.872 177.428 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 0.573 ' N ' HD21 ' A' 1028 ' ' LEU . 6.3 tt -71.28 -14.33 62.18 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 174.16 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -76.51 -26.27 55.09 Favored 'General case' 0 C--N 1.315 -0.893 0 C-N-CA 119.633 -0.827 . . . . 0.0 110.023 167.643 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.656 ' O ' ' HG2' ' A' 1001 ' ' LYS . 5.4 mm-40 -74.4 -43.75 54.98 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 173.223 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.678 HD13 ' HB2' ' A' 1025 ' ' ALA . 0.1 OUTLIER -55.08 -46.45 75.44 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.162 -0.926 . . . . 0.0 111.205 -178.657 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.495 ' O ' ' HB2' ' A' 1003 ' ' LYS . 95.1 mt -64.97 -42.66 95.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.666 -176.292 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -60.82 -41.62 96.08 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.174 0.511 . . . . 0.0 111.829 -178.386 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.871 ' HB3' ' HG3' ' A' 1020 ' ' GLN . 59.8 mmtt -73.86 -42.86 60.19 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 122.63 1.205 . . . . 0.0 108.457 -176.168 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.996 ' HG2' ' HB3' ' A' ' 951' ' ' TYR . 31.6 ttp -62.09 -28.57 69.71 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 113.101 -1.863 . . . . 0.0 109.307 179.499 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 8.7 tptm -69.43 -52.66 24.74 Favored 'General case' 0 N--CA 1.439 -0.999 0 CA-C-N 114.17 -1.377 . . . . 0.0 110.726 -169.172 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.613 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 93.1 mt -74.7 -13.24 60.59 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.443 -179.103 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.56 ' HB2' ' CB ' ' A' 1017 ' ' TYR . . . -66.72 -46.95 73.86 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 119.585 -0.846 . . . . 0.0 109.797 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.913 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 3.5 pp0? -70.61 -31.41 68.37 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 118.942 -0.551 . . . . 0.0 112.145 171.003 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.584 ' HG3' HD23 ' A' 1004 ' ' LEU . 12.7 mm100 -48.76 -51.1 30.83 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.149 0.499 . . . . 0.0 111.287 178.321 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.901 ' HB2' ' HG ' ' A' 1013 ' ' LEU . 89.2 m-85 -121.87 43.13 2.93 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 120.279 -0.569 . . . . 0.0 109.861 172.033 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1009 ' ' VAL . . . . . 0.992 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 7.7 p -51.71 -19.9 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.515 -0.4 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.81 172.944 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 87.6 mmm -32.09 -53.61 0.29 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.055 -1.43 . . . . 0.0 111.065 170.727 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1011 ' ' THR . . . . . . . . . . . . . 23.9 m -161.66 -80.77 0.04 OUTLIER 'General case' 0 C--O 1.246 0.878 0 CA-C-O 121.188 0.518 . . . . 0.0 112.265 176.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 3.2 p -55.51 -65.45 0.59 Allowed 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.256 -0.883 . . . . 0.0 113.224 -167.67 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1013 ' ' LEU . . . . . 0.901 ' HG ' ' HB2' ' A' 1008 ' ' TYR . 1.9 mm? -44.81 -45.38 10.06 Favored 'General case' 0 CA--C 1.508 -0.649 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 178.155 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1014 ' ' GLN . . . . . 0.992 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.6 OUTLIER -59.58 -48.13 82.87 Favored 'General case' 0 N--CA 1.442 -0.843 0 C-N-CA 119.985 -0.686 . . . . 0.0 110.941 -164.984 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -70.44 -40.42 73.77 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.639 -174.49 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -73.89 -41.04 62.72 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.286 0.565 . . . . 0.0 111.558 -177.783 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.746 ' CE1' HD13 ' A' 1013 ' ' LEU . 19.2 m-85 -81.1 -28.97 34.98 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 122.019 0.914 . . . . 0.0 112.442 -170.874 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.659 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 38.0 tptt -78.71 -28.4 45.08 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 113.933 -1.485 . . . . 0.0 110.29 178.775 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -71.86 -56.86 4.97 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.398 176.808 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1020 ' ' GLN . . . . . 0.871 ' HG3' ' HB3' ' A' 1001 ' ' LYS . 10.3 pt20 -53.69 -26.21 21.72 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 119.708 -0.187 . . . . 0.0 110.799 166.726 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.565 ' HB3' ' HA ' ' A' 1018 ' ' LYS . 2.1 tmt? -66.51 -51.75 53.3 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 118.207 0.458 . . . . 0.0 110.62 173.705 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1022 ' ' LEU . . . . . 0.835 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.2 OUTLIER -88.63 -1.76 58.24 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 119.205 -0.998 . . . . 0.0 109.84 -175.234 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A 1023 ' ' THR . . . . . 0.42 ' HB ' ' HA ' ' A' 1020 ' ' GLN . 33.1 m -87.1 -39.15 15.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.447 171.99 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.531 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -76.92 -21.24 55.16 Favored 'General case' 0 C--O 1.222 -0.356 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 170.636 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.847 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -84.52 -25.44 28.79 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.169 169.624 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.623 ' O ' HG23 ' A' 1030 ' ' VAL . 29.0 t-80 -74.17 -26.82 60.52 Favored 'General case' 0 C--O 1.217 -0.639 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 167.045 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1027 ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -68.01 -42.46 80.67 Favored 'General case' 0 C--N 1.321 -0.654 0 C-N-CA 123.454 0.701 . . . . 0.0 110.327 164.318 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.628 HD11 HD22 ' A' ' 998' ' ' LEU . 20.3 mt -57.08 -46.61 82.39 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 170.463 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -58.07 -41.75 84.04 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 111.711 0.263 . . . . 0.0 111.711 173.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' 1026 ' ' HIS . 19.3 t -67.8 -51.79 46.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 121.276 0.56 . . . . 0.0 110.952 -175.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.508 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 12.9 m-20 -76.64 -28.9 56.21 Favored 'General case' 0 C--O 1.217 -0.611 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.882 -175.833 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.577 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -59.38 -38.29 80.14 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 168.729 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 65.2 tttp -65.45 -47.42 76.2 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.748 0.785 . . . . 0.0 109.621 172.432 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.508 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 38.2 t30 -68.13 -52.38 35.5 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 114.319 -1.31 . . . . 0.0 112.202 -172.076 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1035 ' ' LEU . . . . . 1.065 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 3.8 pp -60.67 -37.05 80.27 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 -176.166 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.726 HD23 HG21 ' A' ' 925' ' ' VAL . 0.3 OUTLIER -68.17 -46.38 70.9 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 117.521 -1.672 . . . . 0.0 109.638 176.077 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 19.1 t70 -49.66 -39.15 35.28 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 122.238 1.018 . . . . 0.0 110.299 176.848 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.516 HG13 ' HG3' ' A' ' 983' ' ' GLU . 19.0 t -58.35 -45.25 89.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 113.665 -1.607 . . . . 0.0 112.38 175.716 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.642 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 2.0 mp -78.32 -31.59 16.23 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 CA-C-N 118.599 0.636 . . . . 0.0 110.722 177.504 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -58.42 -40.58 82.9 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-O 120.945 0.403 . . . . 0.0 110.377 172.289 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -76.12 -37.94 57.48 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.642 0.258 . . . . 0.0 110.689 172.102 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.642 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -54.48 -46.36 73.37 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.908 -179.681 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.624 ' HG2' ' O ' ' A' 1039 ' ' ILE . 11.5 ptm180 -71.97 -42.53 66.41 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.205 -176.662 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 1044 ' ' LEU . . . . . 0.416 ' O ' HD23 ' A' 1044 ' ' LEU . 3.3 tt . . . . . 0 C--N 1.332 -0.182 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 177.402 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 924' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp . . . . . 0 N--CA 1.455 -0.224 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.511 HG21 ' HB2' ' A' 1036 ' ' LEU . 28.6 m -55.19 -41.41 60.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-N 117.959 0.345 . . . . 0.0 111.312 -179.695 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 926' ' ' TYR . . . . . 0.493 ' HA ' ' HB ' ' A' ' 929' ' ' VAL . 0.2 OUTLIER -79.26 -20.25 48.57 Favored 'General case' 0 CA--C 1.504 -0.801 0 O-C-N 122.105 -0.372 . . . . 0.0 111.003 179.583 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.73 -24.07 45.08 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 118.09 -1.444 . . . . 0.0 112.541 171.891 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -70.9 -26.78 63.37 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 167.604 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.553 HG21 HD23 ' A' 1036 ' ' LEU . 53.7 t -74.99 -32.22 26.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 114.223 -1.353 . . . . 0.0 110.419 174.67 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.499 ' O ' ' HB2' ' A' ' 934' ' ' LYS . 9.7 m -59.82 -42.99 94.75 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 119.032 0.833 . . . . 0.0 108.986 170.584 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -69.58 -52.46 20.85 Favored Glycine 0 CA--C 1.528 0.86 0 CA-C-N 115.242 -0.89 . . . . 0.0 113.557 178.31 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.55 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.9 pp -65.73 -49.39 68.61 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -176.097 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.546 HG22 ' HA ' ' A' 1029 ' ' ALA . 54.0 t -66.86 -40.85 86.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-O 120.872 0.368 . . . . 0.0 111.186 -173.806 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.654 ' O ' ' HG2' ' A' ' 938' ' ' GLU . 0.1 OUTLIER -58.3 -47.08 84.81 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.206 179.984 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -57.13 -43.19 82.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.19 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.828 HG22 ' HB1' ' A' 1025 ' ' ALA . 70.9 t -43.53 -68.32 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.892 177.731 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 13.7 pt -71.11 -49.69 47.18 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 N-CA-C 112.802 0.668 . . . . 0.0 112.802 -176.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.654 ' HG2' ' O ' ' A' ' 934' ' ' LYS . 11.6 pt-20 -73.06 -34.93 66.57 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 119.779 -0.768 . . . . 0.0 111.295 -169.142 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 62.5 mtt -74.33 -36.74 63.68 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 118.388 -1.325 . . . . 0.0 109.356 177.537 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.668 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 44.8 t . . . . . 0 CA--C 1.516 -0.355 0 CA-C-N 114.609 -1.178 . . . . 0.0 113.082 -168.522 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.576 ' HB3' ' CG ' ' A' 1002 ' ' MET . 0.3 OUTLIER . . . . . 0 C--O 1.22 -0.453 0 CA-C-O 120.89 0.376 . . . . 0.0 109.989 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 0.659 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 59.0 t -53.7 -48.23 94.02 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.867 170.762 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 0.659 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 81.7 Cg_exo -53.07 -34.16 66.72 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 121.917 1.744 . . . . 0.0 112.499 172.547 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.531 ' HA ' ' HB2' ' A' ' 957' ' ' GLU . 6.9 tpt -76.19 -31.43 58.46 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.065 177.641 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.513 HG22 ' HE3' ' A' 1002 ' ' MET . 75.4 t -53.39 -44.05 53.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 173.666 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 6.1 tmtt? -67.81 -34.01 75.91 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.828 -1.078 . . . . 0.0 112.055 175.009 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 957' ' ' GLU . . . . . 0.531 ' HB2' ' HA ' ' A' ' 954' ' ' MET . 25.3 mm-40 -77.63 -46.87 20.76 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -175.923 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.504 HG12 ' O ' ' A' ' 954' ' ' MET . 12.0 p -80.17 -31.86 13.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -59.35 -40.1 95.58 Favored Glycine 0 N--CA 1.444 -0.767 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 175.525 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 960' ' ' LEU . . . . . 0.543 HD12 ' HD3' ' A' ' 963' ' ' ARG . 23.7 tp -67.1 -33.6 75.83 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.66 -0.27 . . . . 0.0 111.112 176.917 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -80.38 -59.33 2.74 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.829 0.347 . . . . 0.0 110.696 -176.126 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.98 HD13 HD22 ' A' ' 995' ' ' LEU . 3.3 pp -50.76 -35.27 30.8 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.547 -0.751 . . . . 0.0 112.512 172.451 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.543 ' HD3' HD12 ' A' ' 960' ' ' LEU . 12.2 ptm180 -71.67 -38.77 70.6 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 119.958 1.254 . . . . 0.0 110.825 174.24 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 41.7 m -62.89 -34.42 77.35 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 176.188 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.891 HD23 HD22 ' A' ' 991' ' ' LEU . 26.3 tp -66.84 -45.31 78.65 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 114.845 -1.071 . . . . 0.0 111.021 176.044 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 0.632 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.4 tt -66.98 -36.14 81.53 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 -176.4 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 967' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 971' ' ' GLU . . . -72.66 -34.44 67.25 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 115.168 -0.923 . . . . 0.0 112.15 178.336 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 1.9 p -67.71 -37.63 82.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 119.031 0.832 . . . . 0.0 109.9 174.129 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.612 HG12 HG23 ' A' ' 984' ' ' ILE . 84.6 t -69.29 -40.6 80.43 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.535 172.518 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 970' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -68.17 -39.67 82.51 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.876 0.846 . . . . 0.0 109.216 -178.26 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.587 ' O ' HG23 ' A' ' 975' ' ' VAL . 6.8 tp10 -61.78 -36.56 81.44 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.553 -1.203 . . . . 0.0 109.135 176.082 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.446 ' HB2' ' O ' ' A' ' 969' ' ' VAL . 71.5 m -65.66 -19.56 65.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.361 176.23 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.662 ' HA ' HD13 ' A' ' 984' ' ' ILE . 51.7 tp -66.75 -52.31 34.29 Favored Pre-proline 0 CA--C 1.53 0.187 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.539 -174.145 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.625 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 95.7 Cg_endo -85.37 2.65 7.67 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 121.055 1.17 . . . . 0.0 112.996 172.148 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.587 HG23 ' O ' ' A' ' 971' ' ' GLU . 33.8 t . . . . . 0 C--N 1.328 -0.326 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 166.564 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.523 HG23 ' HB1' ' A' 1042 ' ' ALA . 65.4 m . . . . . 0 C--O 1.227 -0.094 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 981' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -55.19 -35.87 65.3 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 113.772 -1.558 . . . . 0.0 111.264 176.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 982' ' ' ARG . . . . . 0.517 ' HA ' ' HG2' ' A' ' 985' ' ' GLU . 1.5 ptp180 -82.99 -19.79 36.36 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.408 -0.517 . . . . 0.0 111.124 -178.276 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.533 ' HG3' HG13 ' A' 1038 ' ' VAL . 1.2 mp0 -77.17 -33.64 56.5 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 119.69 -0.804 . . . . 0.0 109.126 171.178 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.755 ' HA ' HD11 ' A' 1039 ' ' ILE . 67.9 mt -71.87 -34.78 52.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 CA-C-N 114.952 -1.022 . . . . 0.0 109.909 179.34 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 985' ' ' GLU . . . . . 0.517 ' HG2' ' HA ' ' A' ' 982' ' ' ARG . 10.7 pt-20 -70.21 -44.96 67.56 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.697 0.76 . . . . 0.0 109.563 -179.252 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 986' ' ' MET . . . . . 0.551 ' HA ' ' HD3' ' A' ' 989' ' ' LYS . 66.3 mtt -73.63 -42.92 60.79 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 114.786 -1.097 . . . . 0.0 111.715 -172.966 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.843 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -68.24 -51.37 46.03 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.809 -173.824 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.632 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 25.9 pt20 -61.44 -24.32 66.47 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 120.497 -0.481 . . . . 0.0 110.754 177.727 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 989' ' ' LYS . . . . . 0.655 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 0.0 OUTLIER -76.12 -38.86 56.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.011 0.434 . . . . 0.0 111.181 173.842 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 12.3 tp -53.24 -59.74 4.18 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.692 -0.686 . . . . 0.0 112.107 178.622 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.891 HD22 HD23 ' A' ' 965' ' ' LEU . 9.9 tp -57.82 -38.5 75.72 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-O 121.529 0.68 . . . . 0.0 109.711 177.682 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 992' ' ' ASN . . . . . 0.655 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 42.4 t-20 -49.34 -51.32 35.26 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 113.895 -1.502 . . . . 0.0 111.549 -176.396 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 993' ' ' SER . . . . . 0.456 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 28.7 t -78.17 -31.53 49.68 Favored 'General case' 0 C--N 1.319 -0.717 0 C-N-CA 120.163 -0.615 . . . . 0.0 111.969 179.267 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 994' ' ' ASP . . . . . 0.4 ' O ' ' HB2' ' A' ' 997' ' ' GLU . 0.1 OUTLIER -71.32 -34.6 70.72 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 119.146 -1.021 . . . . 0.0 111.76 -179.925 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 0.98 HD22 HD13 ' A' ' 962' ' ' LEU . 3.0 pp -71.71 -16.95 62.25 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 171.22 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -78.59 -27.0 45.58 Favored 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 119.981 -0.688 . . . . 0.0 109.898 167.552 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.456 ' HG2' ' O ' ' A' ' 993' ' ' SER . 5.0 mm-40 -72.15 -45.29 61.09 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 173.012 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.882 HD13 ' HB2' ' A' 1025 ' ' ALA . 0.1 OUTLIER -56.17 -48.03 77.12 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.941 -176.074 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.585 ' O ' ' HB2' ' A' 1003 ' ' LYS . 91.6 mt -66.75 -40.59 86.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.265 -175.329 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 16.7 m-80 -62.04 -40.15 94.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.344 0.592 . . . . 0.0 111.709 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.866 ' HD3' ' HG2' ' A' 1020 ' ' GLN . 86.6 mttt -79.84 -40.84 27.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 122.097 0.951 . . . . 0.0 109.288 -175.806 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.576 ' CG ' ' HB3' ' A' ' 951' ' ' TYR . 22.5 ttp -61.06 -26.38 67.6 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.232 -1.349 . . . . 0.0 109.637 175.18 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.585 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 11.5 tptp -74.12 -54.96 6.69 Favored 'General case' 0 N--CA 1.438 -1.037 0 CA-C-N 114.894 -1.048 . . . . 0.0 111.551 -171.43 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.73 ' HA ' ' HB2' ' A' 1007 ' ' GLN . 7.6 mp -68.05 -13.73 62.43 Favored 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 120.305 -0.558 . . . . 0.0 110.73 179.389 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.885 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -69.86 -42.2 73.84 Favored 'General case' 0 C--O 1.213 -0.841 0 C-N-CA 119.768 -0.773 . . . . 0.0 109.326 176.075 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.954 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -77.35 -34.57 55.09 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 119.063 -0.494 . . . . 0.0 111.754 171.224 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.73 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 14.7 mm100 -46.14 -49.01 17.26 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.399 0.618 . . . . 0.0 110.637 175.107 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.553 ' HB2' HD22 ' A' 1013 ' ' LEU . 60.0 m-85 -126.99 46.28 2.54 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.602 0.715 . . . . 0.0 110.584 172.738 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1009 ' ' VAL . . . . . 1.11 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 10.7 p -54.05 -18.53 2.45 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.352 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.219 170.255 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 84.5 mtp -49.32 -38.17 26.82 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 113.796 -1.547 . . . . 0.0 111.731 174.725 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1011 ' ' THR . . . . . 0.419 ' O ' ' HB3' ' A' 1014 ' ' GLN . 0.0 OUTLIER -162.55 -102.82 0.02 OUTLIER 'General case' 0 C--O 1.245 0.862 0 N-CA-C 114.976 1.473 . . . . 0.0 114.976 179.729 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 19.7 m -57.7 -60.52 3.56 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.906 -164.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1013 ' ' LEU . . . . . 0.713 ' HG ' ' CE2' ' A' 1017 ' ' TYR . 3.1 mp -45.85 -43.09 13.21 Favored 'General case' 0 CA--C 1.506 -0.734 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 177.08 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1014 ' ' GLN . . . . . 1.11 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 1.4 tt0 -54.99 -50.21 69.57 Favored 'General case' 0 N--CA 1.443 -0.822 0 O-C-N 123.752 0.658 . . . . 0.0 111.879 -168.972 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1015 ' ' GLN . . . . . 0.687 ' O ' ' HB3' ' A' 1019 ' ' LYS . 78.3 mm-40 -70.26 -41.62 73.25 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.433 -174.383 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1016 ' ' GLU . . . . . 0.476 ' O ' ' HD3' ' A' 1019 ' ' LYS . 30.2 tt0 -69.3 -55.04 11.65 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.338 0.59 . . . . 0.0 110.833 178.531 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.885 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 9.9 m-85 -60.08 -38.8 83.98 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -176.602 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.601 ' HA ' ' HB3' ' A' 1021 ' ' MET . 23.5 tptm -81.21 -30.45 34.26 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.539 -178.406 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1019 ' ' LYS . . . . . 0.687 ' HB3' ' O ' ' A' 1015 ' ' GLN . 0.1 OUTLIER -73.34 -39.04 65.53 Favored 'General case' 0 C--O 1.222 -0.36 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 175.17 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A 1020 ' ' GLN . . . . . 0.866 ' HG2' ' HD3' ' A' 1001 ' ' LYS . 61.8 tt0 -63.66 -32.41 73.88 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.424 165.24 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.601 ' HB3' ' HA ' ' A' 1018 ' ' LYS . 2.0 tmt? -64.25 -51.12 65.19 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 177.538 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1022 ' ' LEU . . . . . 0.555 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -81.82 -6.82 59.4 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 119.343 -0.943 . . . . 0.0 109.919 -175.005 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 62.8 m -87.33 -36.75 17.66 Favored 'General case' 0 C--O 1.223 -0.313 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 173.728 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.514 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -79.08 -22.72 44.88 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 172.74 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.882 ' HB2' HD13 ' A' ' 998' ' ' LEU . . . -86.14 -22.44 27.05 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.113 169.612 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.591 ' O ' HG23 ' A' 1030 ' ' VAL . 83.7 t60 -76.43 -25.0 53.99 Favored 'General case' 0 C--O 1.214 -0.792 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 165.319 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1027 ' ' ALA . . . . . 0.514 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -69.14 -41.09 77.77 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 123.783 0.833 . . . . 0.0 109.959 163.332 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.681 ' CD1' HD22 ' A' ' 998' ' ' LEU . 18.0 mt -60.44 -45.58 93.14 Favored 'General case' 0 C--N 1.314 -0.95 0 C-N-CA 119.933 -0.707 . . . . 0.0 109.259 170.072 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1029 ' ' ALA . . . . . 0.546 ' HA ' HG22 ' A' ' 933' ' ' VAL . . . -57.55 -42.91 83.93 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.41 0.148 . . . . 0.0 111.274 173.41 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' 1026 ' ' HIS . 12.3 t -67.4 -52.16 44.84 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 CA-C-O 121.652 0.739 . . . . 0.0 110.648 -177.781 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.503 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 38.8 m-20 -77.34 -29.39 53.44 Favored 'General case' 0 C--O 1.216 -0.681 0 CA-C-N 114.742 -1.117 . . . . 0.0 112.207 -174.51 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.945 ' HA ' HD22 ' A' 1035 ' ' LEU . . . -71.82 -29.9 64.92 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 170.87 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.418 ' O ' ' HG ' ' A' 1036 ' ' LEU . 87.9 tttt -65.68 -49.36 68.86 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.823 0.821 . . . . 0.0 109.18 168.304 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.503 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 10.6 t30 -68.74 -44.3 74.08 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 114.383 -1.28 . . . . 0.0 112.8 -174.856 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.945 HD22 ' HA ' ' A' 1032 ' ' ALA . 0.2 OUTLIER -64.52 -37.63 88.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 118.039 0.382 . . . . 0.0 110.099 -176.75 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.553 HD23 HG21 ' A' ' 929' ' ' VAL . 4.0 pp -72.03 -41.57 67.37 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 117.25 -1.78 . . . . 0.0 108.888 178.408 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.495 ' HB3' ' O ' ' A' 1034 ' ' ASN . 7.6 t70 -49.85 -46.23 51.18 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 114.272 -1.331 . . . . 0.0 110.117 172.479 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.533 HG13 ' HG3' ' A' ' 983' ' ' GLU . 15.5 t -54.51 -47.28 71.42 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.643 0 CA-C-N 114.004 -1.453 . . . . 0.0 111.822 174.935 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.755 HD11 ' HA ' ' A' ' 984' ' ' ILE . 1.4 mp -77.77 -35.68 21.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 118.775 0.716 . . . . 0.0 112.076 179.338 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.777 ' HA ' ' HE ' ' A' 1043 ' ' ARG . 1.9 m-20 -59.23 -45.9 89.92 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-O 120.73 0.3 . . . . 0.0 110.832 173.985 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1041 ' ' GLN . . . . . 0.413 ' HB3' ' O ' ' A' 1037 ' ' ASP . 0.0 OUTLIER -77.73 -26.33 49.91 Favored 'General case' 0 N--CA 1.432 -1.353 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 176.294 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.569 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.29 -48.45 71.24 Favored 'General case' 0 CA--C 1.505 -0.773 0 C-N-CA 122.997 0.519 . . . . 0.0 111.804 175.929 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.777 ' HE ' ' HA ' ' A' 1040 ' ' ASP . 3.2 ptt180 -70.61 -40.5 73.15 Favored 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 120.432 -0.507 . . . . 0.0 109.75 -177.962 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 12.3 tp . . . . . 0 C--O 1.221 -0.432 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.104 173.608 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.458 ' HA ' ' HG2' ' A' ' 927' ' ' GLU . 12.2 mmtp . . . . . 0 N--CA 1.456 -0.169 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.619 HG23 HD22 ' A' 1036 ' ' LEU . 33.9 m -62.22 -29.86 47.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 176.788 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.02 -32.95 57.42 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 118.854 -0.594 . . . . 0.0 111.651 176.535 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 927' ' ' GLU . . . . . 0.826 ' HA ' ' HB ' ' A' ' 930' ' ' THR . 4.1 pt-20 -75.64 -25.59 56.98 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.833 1.197 . . . . 0.0 111.268 176.808 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.589 ' OD1' ' HB ' ' A' ' 964' ' ' THR . 69.8 m-80 -75.63 -26.89 58.15 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 119.338 0.972 . . . . 0.0 110.582 173.013 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.728 HG22 ' HB1' ' A' 1032 ' ' ALA . 98.4 t -75.15 -30.1 22.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 167.189 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.826 ' HB ' ' HA ' ' A' ' 927' ' ' GLU . 0.9 OUTLIER -63.26 -42.85 99.2 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 169.907 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -72.56 -54.02 7.97 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 120.667 -0.778 . . . . 0.0 113.585 176.551 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.556 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.8 pp -62.33 -48.47 79.67 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -176.577 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 79.7 t -67.28 -39.89 83.82 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 CA-C-O 121.103 0.477 . . . . 0.0 110.913 -175.87 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.602 ' HB2' ' O ' ' A' ' 930' ' ' THR . 0.2 OUTLIER -62.07 -35.38 78.47 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.683 179.036 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -64.16 -42.18 96.86 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.832 176.754 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.746 HG22 ' HB1' ' A' 1025 ' ' ALA . 49.6 t -49.76 -85.01 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 C-N-CA 123.36 0.664 . . . . 0.0 112.218 -179.114 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.452 ' O ' ' HB2' ' A' ' 940' ' ' SER . 15.8 pt -61.61 -42.47 94.24 Favored 'Isoleucine or valine' 0 C--O 1.248 1.005 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -173.03 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.523 ' HB3' ' O ' ' A' ' 934' ' ' LYS . 23.9 tp10 -61.5 -53.2 59.61 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.271 -172.504 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 78.4 mtp -71.3 -26.55 62.91 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.36 -177.076 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.452 ' HB2' ' O ' ' A' ' 937' ' ' ILE . 6.9 m . . . . . 0 CA--C 1.514 -0.441 0 O-C-N 124.238 0.961 . . . . 0.0 112.122 -172.45 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 1.119 ' HA ' ' HB3' ' A' ' 954' ' ' MET . 0.4 OUTLIER . . . . . 0 C--O 1.216 -0.67 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 0.698 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 56.8 t -64.42 -52.41 53.49 Favored Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 166.332 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 0.698 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 25.6 Cg_exo -50.01 -37.81 47.88 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 121.845 1.696 . . . . 0.0 112.474 162.944 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 954' ' ' MET . . . . . 1.119 ' HB3' ' HA ' ' A' ' 951' ' ' TYR . 3.6 tpt -64.96 -32.73 74.59 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 122.764 0.426 . . . . 0.0 110.825 174.359 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.624 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 87.9 t -53.75 -41.65 48.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 169.336 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.507 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 8.9 tmtt? -67.78 -32.04 72.35 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.482 176.071 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -78.0 -48.06 17.07 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.967 0.413 . . . . 0.0 111.597 -175.624 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.559 HG22 HD23 ' A' ' 962' ' ' LEU . 12.5 p -84.99 -35.52 10.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.279 -178.453 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -62.26 -41.25 99.73 Favored Glycine 0 N--CA 1.448 -0.546 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 179.182 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 960' ' ' LEU . . . . . 0.57 ' O ' ' HG3' ' A' ' 963' ' ' ARG . 24.9 tp -71.75 -31.2 66.41 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.667 -0.123 . . . . 0.0 110.667 178.039 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -73.7 -60.83 2.07 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.968 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 1.058 HD13 HD22 ' A' ' 995' ' ' LEU . 4.0 pp -50.64 -35.35 30.11 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 172.039 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.604 ' N ' HD12 ' A' ' 962' ' ' LEU . 0.0 OUTLIER -71.09 -36.21 72.11 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 120.173 1.351 . . . . 0.0 111.022 175.2 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 964' ' ' THR . . . . . 0.589 ' HB ' ' OD1' ' A' ' 928' ' ' ASN . 17.6 m -71.56 -27.0 62.86 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.281 -0.567 . . . . 0.0 109.498 177.563 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.635 HD23 HD22 ' A' ' 991' ' ' LEU . 36.8 tp -65.65 -45.55 82.54 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-O 122.103 0.954 . . . . 0.0 109.566 169.303 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 0.717 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 9.2 tt -65.54 -37.25 86.19 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 114.484 -1.235 . . . . 0.0 108.664 -176.084 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 967' ' ' ALA . . . . . 0.585 ' O ' ' HB2' ' A' ' 971' ' ' GLU . . . -75.53 -29.47 59.44 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.492 179.277 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 1.1 p -72.03 -36.48 69.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 118.497 0.59 . . . . 0.0 110.029 174.726 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.702 HG12 HG23 ' A' ' 984' ' ' ILE . 96.9 t -72.43 -39.25 62.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.311 171.677 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.583 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 26.1 t70 -65.9 -38.15 87.98 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 122.19 0.995 . . . . 0.0 108.435 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.687 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 4.9 tp10 -63.56 -37.0 85.67 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.045 -1.434 . . . . 0.0 109.496 176.376 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.469 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 24.1 m -63.26 -17.97 63.07 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.559 175.596 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.765 ' HA ' HD13 ' A' ' 984' ' ' ILE . 8.4 tt -68.88 -52.62 16.73 Favored Pre-proline 0 CA--C 1.535 0.372 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.265 -177.199 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.736 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 1.8 Cg_endo -87.8 -14.3 3.65 Favored 'Trans proline' 0 C--N 1.358 1.036 0 C-N-CA 121.667 1.578 . . . . 0.0 113.676 174.409 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.498 HG23 ' O ' ' A' ' 971' ' ' GLU . 13.7 t . . . . . 0 C--O 1.233 0.2 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 173.035 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.486 HG23 ' HB1' ' A' 1042 ' ' ALA . 16.1 m . . . . . 0 CA--C 1.538 0.5 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 981' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -50.27 -36.26 30.62 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 -171.692 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 982' ' ' ARG . . . . . 0.534 ' HA ' ' HG2' ' A' ' 985' ' ' GLU . 7.0 ptp180 -83.2 -22.36 33.19 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 118.986 -1.085 . . . . 0.0 112.142 -168.74 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.515 ' OE2' HG13 ' A' 1038 ' ' VAL . 2.0 mt-10 -80.03 -35.74 36.81 Favored 'General case' 0 CA--C 1.501 -0.931 0 C-N-CA 119.39 -0.924 . . . . 0.0 109.734 171.095 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.765 HD13 ' HA ' ' A' ' 973' ' ' LEU . 48.7 mt -64.97 -37.44 80.25 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-N 114.795 -1.093 . . . . 0.0 108.927 178.863 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 985' ' ' GLU . . . . . 0.722 ' HA ' HE21 ' A' ' 988' ' ' GLN . 11.3 pt-20 -74.09 -38.52 63.85 Favored 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 118.317 -1.353 . . . . 0.0 110.362 -177.835 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 986' ' ' MET . . . . . 0.654 ' O ' ' HB3' ' A' ' 989' ' ' LYS . 26.3 ttt -72.22 -37.28 69.24 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.889 -173.746 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.995 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -76.34 -49.74 16.08 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.878 -1.056 . . . . 0.0 111.879 -172.528 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.722 HE21 ' HA ' ' A' ' 985' ' ' GLU . 28.0 pt20 -59.73 -26.15 65.41 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.559 0.695 . . . . 0.0 109.629 173.378 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 989' ' ' LYS . . . . . 0.796 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 7.8 tmtm? -71.11 -39.73 71.9 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.586 -1.188 . . . . 0.0 111.287 172.992 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 18.2 tp -55.97 -58.36 8.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.569 176.627 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.635 HD22 HD23 ' A' ' 965' ' ' LEU . 13.0 tp -55.19 -36.07 65.5 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.557 0.694 . . . . 0.0 109.804 177.068 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 992' ' ' ASN . . . . . 0.796 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 25.4 t-20 -48.86 -52.04 26.43 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 113.751 -1.568 . . . . 0.0 112.119 -177.106 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 32.1 t -74.39 -35.83 63.49 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.33 -36.69 77.2 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 119.246 -0.982 . . . . 0.0 111.829 -178.358 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 1.058 HD22 HD13 ' A' ' 962' ' ' LEU . 3.2 pp -70.45 -23.47 62.72 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 122.808 0.443 . . . . 0.0 110.416 172.294 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -73.44 -28.1 61.78 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 119.527 -0.869 . . . . 0.0 109.978 170.318 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.766 ' O ' ' HG2' ' A' 1001 ' ' LYS . 17.0 mt-10 -75.25 -41.72 56.74 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 172.091 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.648 ' HB3' ' HA ' ' A' ' 995' ' ' LEU . 0.4 OUTLIER -54.78 -46.76 74.47 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.968 -175.611 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 995' ' ' LEU . 71.5 mt -66.84 -43.28 89.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.199 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 10.3 m-80 -58.5 -44.89 89.61 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.453 0.644 . . . . 0.0 112.34 -178.343 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.766 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 28.5 mmtp -74.7 -40.38 61.38 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 122.29 1.043 . . . . 0.0 108.381 -171.624 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.569 ' HG2' ' CG ' ' A' ' 951' ' ' TYR . 16.2 ttp -57.03 -43.89 82.36 Favored 'General case' 0 N--CA 1.428 -1.531 0 CA-C-N 113.894 -1.503 . . . . 0.0 108.419 176.841 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.494 ' HA ' ' CE1' ' A' ' 951' ' ' TYR . 1.5 tptm -64.0 -33.0 74.75 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 114.141 -1.391 . . . . 0.0 112.313 -168.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.801 HD13 ' HG3' ' A' 1007 ' ' GLN . 4.2 mm? -84.06 -14.87 49.39 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.007 -0.677 . . . . 0.0 110.948 177.273 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.64 ' HB1' ' HA ' ' A' 1014 ' ' GLN . . . -63.45 -50.81 68.26 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 119.391 -0.924 . . . . 0.0 110.55 -177.944 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1006 ' ' GLN . . . . . 1.026 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 2.2 pp0? -76.99 -24.66 52.23 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 118.979 0.809 . . . . 0.0 110.936 177.328 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.801 ' HG3' HD13 ' A' 1004 ' ' LEU . 18.4 mm-40 -41.75 -40.08 1.91 Allowed 'General case' 0 C--N 1.344 0.336 0 CA-C-O 121.363 0.601 . . . . 0.0 109.795 169.737 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.921 ' HD2' HD22 ' A' 1013 ' ' LEU . 82.7 m-85 -132.1 45.1 2.81 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.631 166.829 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1009 ' ' VAL . . . . . 1.032 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 7.3 p -49.48 -22.96 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 CA-C-O 121.251 0.548 . . . . 0.0 109.987 171.469 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 21.6 mmt -42.7 -45.83 4.86 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.938 174.043 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1011 ' ' THR . . . . . . . . . . . . . 15.9 m -162.23 -84.24 0.03 OUTLIER 'General case' 0 C--O 1.248 0.987 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 176.937 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1012 ' ' SER . . . . . 0.454 ' O ' ' HG2' ' A' 1015 ' ' GLN . 15.6 m -55.27 -73.41 0.05 Allowed 'General case' 0 C--O 1.234 0.256 0 CA-C-N 114.807 -1.088 . . . . 0.0 112.844 -164.803 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1013 ' ' LEU . . . . . 0.921 HD22 ' HD2' ' A' 1008 ' ' TYR . 8.7 mp -47.72 -42.85 26.22 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -177.823 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1014 ' ' GLN . . . . . 1.032 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.7 OUTLIER -55.8 -45.73 78.16 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.206 -0.598 . . . . 0.0 111.083 -169.403 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A 1015 ' ' GLN . . . . . 0.46 ' O ' ' HD3' ' A' 1019 ' ' LYS . 11.0 pt20 -75.57 -41.04 55.76 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.153 -176.287 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -72.39 -56.33 5.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.328 0.585 . . . . 0.0 110.834 -178.184 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.695 ' CE2' ' HG ' ' A' 1013 ' ' LEU . 8.7 m-85 -58.03 -39.01 77.32 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.097 -0.956 . . . . 0.0 113.241 -178.12 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.572 ' HA ' ' CB ' ' A' 1021 ' ' MET . 8.4 ttpp -82.17 -24.59 34.91 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.844 -176.557 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1019 ' ' LYS . . . . . 0.46 ' HD3' ' O ' ' A' 1015 ' ' GLN . 4.0 mptp? -71.57 -46.12 60.28 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 171.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -56.19 -31.93 63.9 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 114.867 -1.061 . . . . 0.0 110.986 164.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.587 ' HG2' HD22 ' A' ' 998' ' ' LEU . 18.2 tmm? -69.21 -53.69 18.66 Favored 'General case' 0 CA--C 1.509 -0.611 0 O-C-N 122.16 -0.337 . . . . 0.0 110.793 176.076 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1022 ' ' LEU . . . . . 0.5 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.3 OUTLIER -80.29 -8.55 59.52 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 119.478 -0.889 . . . . 0.0 109.78 -171.229 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 85.3 m -88.83 -31.43 18.32 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.725 172.879 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.474 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -79.42 -24.73 42.32 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-O 121.419 0.628 . . . . 0.0 109.444 171.489 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.746 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -86.44 -24.74 25.55 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.222 170.59 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.563 ' O ' HG23 ' A' 1030 ' ' VAL . 47.0 t-80 -74.6 -26.73 60.1 Favored 'General case' 0 C--O 1.214 -0.765 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 164.533 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1027 ' ' ALA . . . . . 0.47 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -68.97 -40.72 78.67 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 123.664 0.785 . . . . 0.0 110.118 163.576 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.668 HD21 ' N ' ' A' ' 995' ' ' LEU . 22.6 mt -59.81 -44.69 93.86 Favored 'General case' 0 C--N 1.315 -0.898 0 C-N-CA 119.996 -0.682 . . . . 0.0 109.456 169.638 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -58.46 -43.25 88.8 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.755 0.312 . . . . 0.0 111.383 173.09 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.563 HG23 ' O ' ' A' 1026 ' ' HIS . 13.2 t -67.79 -50.55 59.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.168 0.509 . . . . 0.0 110.747 -177.113 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.6 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 47.0 m-20 -75.32 -28.93 59.85 Favored 'General case' 0 C--O 1.214 -0.804 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.551 -175.961 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.766 ' HA ' HD12 ' A' 1035 ' ' LEU . . . -64.35 -39.58 94.16 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 168.635 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.404 ' HE2' ' HB3' ' A' 1033 ' ' LYS . 13.4 ttpt -63.1 -43.94 97.07 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 122.092 0.948 . . . . 0.0 109.25 171.905 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.6 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 51.2 t30 -72.93 -52.56 14.15 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-N 113.975 -1.466 . . . . 0.0 112.465 -171.47 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.995 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 0.0 OUTLIER -64.32 -34.95 79.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 119.468 -0.301 . . . . 0.0 110.759 -173.284 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.678 ' N ' HD13 ' A' 1035 ' ' LEU . 4.6 pp -72.97 -36.47 67.11 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 116.88 -1.928 . . . . 0.0 109.673 177.252 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.541 ' HB3' ' O ' ' A' 1034 ' ' ASN . 20.5 t70 -55.24 -43.54 74.68 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 122.336 1.065 . . . . 0.0 110.087 172.637 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.547 ' HB ' ' O ' ' A' 1035 ' ' LEU . 15.2 t -51.95 -58.18 2.69 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.512 0 CA-C-N 113.302 -1.772 . . . . 0.0 111.019 172.854 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.763 HG12 HG12 ' A' ' 984' ' ' ILE . 2.5 mp -67.52 -23.87 30.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 118.188 0.449 . . . . 0.0 111.604 179.371 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 1.5 t0 -62.3 -48.98 77.48 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.694 0.759 . . . . 0.0 110.285 171.79 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -72.58 -36.31 68.13 Favored 'General case' 0 C--N 1.31 -1.136 0 O-C-N 122.021 -0.424 . . . . 0.0 109.951 176.183 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.702 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -53.02 -48.93 67.18 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 123.462 0.705 . . . . 0.0 112.499 -179.544 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.617 ' HG2' ' O ' ' A' 1039 ' ' ILE . 9.7 ptp180 -61.07 -51.8 67.62 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.353 179.444 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 3.2 tm? . . . . . 0 N--CA 1.464 0.246 0 CA-C-O 121.213 0.53 . . . . 0.0 109.836 179.612 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 924' ' ' LYS . . . . . . . . . . . . . 15.0 tptp . . . . . 0 N--CA 1.466 0.347 0 N-CA-C 111.779 0.289 . . . . 0.0 111.779 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.639 ' CG2' ' HB3' ' A' 1036 ' ' LEU . 1.5 p -61.11 -31.83 51.09 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 CA-C-O 121.295 0.569 . . . . 0.0 110.894 174.764 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -36.64 82.04 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 123.591 0.756 . . . . 0.0 111.882 178.031 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -75.04 -23.41 58.13 Favored 'General case' 0 C--N 1.313 -1.001 0 C-N-CA 118.374 -1.33 . . . . 0.0 110.195 -179.36 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.44 ' O ' ' HB1' ' A' ' 961' ' ' ALA . 1.6 m120 -69.21 -31.11 69.48 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 173.916 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.586 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 46.6 t -81.13 -28.87 10.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 114.79 -1.095 . . . . 0.0 110.154 174.898 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 930' ' ' THR . . . . . . . . . . . . . 22.3 m -55.61 -43.12 75.79 Favored 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 165.547 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -71.03 -53.13 11.26 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-N 115.318 -0.855 . . . . 0.0 114.087 178.05 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.586 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.4 pp -62.22 -47.92 82.29 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 117.513 0.657 . . . . 0.0 112.694 -176.817 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 75.9 t -65.32 -36.12 76.95 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 CA-C-O 121.083 0.468 . . . . 0.0 110.862 -176.483 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.525 ' HD2' ' C ' ' A' ' 934' ' ' LYS . 0.1 OUTLIER -55.35 -45.39 76.46 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.822 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 935' ' ' ALA . . . . . 0.4 ' HB3' HG12 ' A' ' 958' ' ' VAL . . . -63.26 -34.15 77.06 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.625 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.769 HG22 ' HB1' ' A' 1025 ' ' ALA . 59.0 t -54.03 -76.03 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 CA-C-O 121.11 0.481 . . . . 0.0 112.166 -179.391 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 21.0 pt -68.7 -38.63 79.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -175.24 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -66.45 -52.22 48.61 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.613 0.72 . . . . 0.0 110.288 -175.174 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 23.2 mmt -69.66 -24.35 63.6 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 119.596 -0.842 . . . . 0.0 109.231 -179.048 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.523 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 5.7 p . . . . . 0 C--N 1.343 0.284 0 CA-C-O 121.187 0.518 . . . . 0.0 110.022 -175.642 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.597 ' O ' HG23 ' A' ' 955' ' ' VAL . 27.4 m-85 . . . . . 0 N--CA 1.469 0.479 0 N-CA-C 116.222 1.934 . . . . 0.0 116.222 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 0.601 ' O ' ' HB ' ' A' ' 955' ' ' VAL . 43.2 t -49.76 -45.56 79.68 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 118.667 0.667 . . . . 0.0 112.041 174.601 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 0.619 ' O ' ' HB3' ' A' ' 956' ' ' LYS . 36.3 Cg_exo -50.01 -44.55 36.91 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 122.089 1.859 . . . . 0.0 112.899 174.162 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.561 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 4.4 ptp -75.32 -29.75 60.12 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 178.158 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.601 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 99.2 t -54.67 -36.5 36.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.145 168.802 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.619 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 23.2 ttpt -59.07 -43.44 91.77 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.886 171.636 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 957' ' ' GLU . . . . . 0.52 ' HG2' ' HA ' ' A' ' 954' ' ' MET . 14.6 pt-20 -79.63 -43.41 22.9 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 119.75 -0.78 . . . . 0.0 112.087 -178.133 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.534 HG22 ' HA ' ' A' ' 955' ' ' VAL . 16.7 m -76.52 -33.04 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-O 120.689 0.281 . . . . 0.0 110.904 -179.042 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -68.88 -35.77 80.23 Favored Glycine 0 N--CA 1.436 -1.33 0 N-CA-C 110.474 -1.05 . . . . 0.0 110.474 175.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 960' ' ' LEU . . . . . 0.607 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 16.5 tp -65.73 -38.33 88.86 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 172.712 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.44 ' HB1' ' O ' ' A' ' 928' ' ' ASN . . . -68.45 -58.46 4.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.647 -0.251 . . . . 0.0 110.757 -177.998 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.576 HD22 HD22 ' A' ' 995' ' ' LEU . 0.1 OUTLIER -43.54 -49.91 7.32 Favored 'General case' 0 C--O 1.215 -0.748 0 CA-C-O 118.596 -0.716 . . . . 0.0 112.698 167.591 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.607 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 6.4 ptp180 -68.43 -29.0 67.56 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 120.303 1.41 . . . . 0.0 110.805 -179.163 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 964' ' ' THR . . . . . 0.408 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 43.7 m -68.24 -37.99 81.37 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 174.572 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.619 HD11 HD21 ' A' 1035 ' ' LEU . 0.0 OUTLIER -66.28 -40.01 89.79 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.17 174.423 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 0.422 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.4 tt -67.91 -41.45 82.64 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 114.727 -1.124 . . . . 0.0 108.307 -175.669 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 967' ' ' ALA . . . . . 0.579 ' O ' ' HB2' ' A' ' 971' ' ' GLU . . . -72.59 -38.77 67.75 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-N 114.966 -1.015 . . . . 0.0 112.021 -179.508 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 9.8 p -61.92 -40.98 97.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 118.657 0.662 . . . . 0.0 110.3 177.161 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.985 HG12 HG23 ' A' ' 984' ' ' ILE . 67.7 t -73.94 -38.54 49.99 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.712 174.493 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.53 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 12.1 t70 -67.75 -44.38 77.66 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.805 0.812 . . . . 0.0 109.585 -177.741 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.592 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 0.6 OUTLIER -63.83 -32.5 74.04 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 114.667 -1.152 . . . . 0.0 109.26 177.536 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.631 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 39.8 m -65.3 -18.02 64.98 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.53 175.397 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.753 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 9.7 tt -69.62 -52.65 13.77 Favored Pre-proline 0 CA--C 1.532 0.262 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.087 -179.171 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.753 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 3.0 Cg_exo -80.36 -2.12 11.77 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.627 1.551 . . . . 0.0 113.116 172.54 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.631 ' HB ' ' HA ' ' A' ' 972' ' ' SER . 15.0 t . . . . . 0 C--N 1.329 -0.321 0 N-CA-C 110.094 -0.336 . . . . 0.0 110.094 173.585 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.414 ' HB ' ' HB1' ' A' 1042 ' ' ALA . 40.9 p . . . . . 0 CA--C 1.52 -0.184 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.714 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 0.3 OUTLIER -55.56 -34.34 64.65 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.345 -178.65 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 982' ' ' ARG . . . . . 0.457 HH11 ' HD3' ' A' ' 982' ' ' ARG . 9.5 ptp180 -84.48 -19.21 33.71 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.477 -178.479 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.733 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 0.5 OUTLIER -73.98 -38.85 64.04 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 172.586 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.985 HG23 HG12 ' A' ' 969' ' ' VAL . 65.6 mt -72.01 -29.51 33.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 114.225 -1.352 . . . . 0.0 109.206 179.387 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 985' ' ' GLU . . . . . 0.714 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 26.6 mt-10 -65.0 -51.63 60.63 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.402 0.62 . . . . 0.0 110.444 174.162 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 25.5 ttt -70.23 -43.28 70.95 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.311 -170.749 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.982 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -74.54 -50.85 16.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.066 -0.97 . . . . 0.0 112.827 -171.236 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.599 ' O ' ' HB2' ' A' ' 992' ' ' ASN . 24.5 pt20 -65.29 -23.04 66.93 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 119.817 -0.753 . . . . 0.0 109.94 179.432 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 989' ' ' LYS . . . . . 0.772 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 6.8 tttp -74.31 -40.67 62.07 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.327 171.816 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.422 ' HB3' ' O ' ' A' ' 987' ' ' ALA . 27.5 tp -52.19 -59.79 3.97 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.208 178.675 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.648 ' HB2' ' CD2' ' A' 1035 ' ' LEU . 0.3 OUTLIER -66.04 -28.91 69.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.519 0.676 . . . . 0.0 109.789 179.059 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 992' ' ' ASN . . . . . 0.772 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 23.7 t-20 -52.05 -56.39 14.65 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.436 -1.257 . . . . 0.0 111.485 179.752 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 34.1 t -77.84 -33.99 52.07 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 111.776 0.288 . . . . 0.0 111.776 -178.42 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 994' ' ' ASP . . . . . 0.433 ' O ' ' HB3' ' A' ' 997' ' ' GLU . 0.6 OUTLIER -66.99 -36.34 81.95 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 120.176 -0.61 . . . . 0.0 112.354 -179.823 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 0.627 HD12 HD13 ' A' 1028 ' ' LEU . 8.4 tt -73.7 -17.45 61.13 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 173.041 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -75.29 -26.46 58.76 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 119.77 -0.772 . . . . 0.0 109.77 167.84 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.433 ' HB3' ' O ' ' A' ' 994' ' ' ASP . 3.8 tp10 -74.51 -40.63 61.67 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 173.14 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.95 HD13 ' HB2' ' A' 1025 ' ' ALA . 2.2 tp -55.91 -46.98 78.25 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.039 0.447 . . . . 0.0 110.747 178.058 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.78 ' HA ' ' SD ' ' A' 1002 ' ' MET . 80.1 mt -68.57 -38.5 79.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.881 -171.093 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -60.59 -46.86 88.65 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.442 0.639 . . . . 0.0 111.254 -177.914 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.531 ' O ' ' HB3' ' A' 1017 ' ' TYR . 89.7 mttt -84.62 -31.8 24.06 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.962 -173.165 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.78 ' SD ' ' HA ' ' A' ' 999' ' ' ILE . 13.1 ptm -64.29 -27.81 69.29 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 122.099 0.952 . . . . 0.0 108.512 173.47 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.616 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 9.4 tptp -67.26 -54.01 24.73 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 114.145 -1.389 . . . . 0.0 110.352 -171.255 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.578 ' HA ' ' HG3' ' A' 1007 ' ' GLN . 9.1 mp -71.14 -13.8 62.07 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.388 -178.68 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.628 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -69.26 -55.15 11.37 Favored 'General case' 0 C--O 1.217 -0.638 0 C-N-CA 119.888 -0.725 . . . . 0.0 110.289 179.554 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.968 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -63.88 -24.91 67.93 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 118.871 -0.585 . . . . 0.0 112.467 171.787 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.578 ' HG3' ' HA ' ' A' 1004 ' ' LEU . 58.0 mt-30 -51.98 -50.22 61.73 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.625 0.726 . . . . 0.0 110.07 175.528 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.738 ' HB2' ' HG ' ' A' 1013 ' ' LEU . 76.5 m-85 -124.99 49.74 1.83 Allowed 'General case' 0 N--CA 1.442 -0.835 0 CA-C-O 121.588 0.709 . . . . 0.0 109.617 172.361 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1009 ' ' VAL . . . . . 1.052 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 9.3 p -55.41 -19.27 5.29 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.282 0 CA-C-N 114.157 -1.383 . . . . 0.0 109.678 170.954 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 65.0 mtt -40.01 -51.31 2.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.55 -1.204 . . . . 0.0 110.655 171.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1011 ' ' THR . . . . . . . . . . . . . 41.6 m -162.54 -75.66 0.05 OUTLIER 'General case' 0 C--O 1.239 0.52 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 175.815 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 13.1 p -55.93 -79.9 0.02 OUTLIER 'General case' 0 C--O 1.248 0.986 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -163.622 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1013 ' ' LEU . . . . . 0.738 ' HG ' ' HB2' ' A' 1008 ' ' TYR . 13.0 mt -48.19 -42.62 30.39 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.453 -175.82 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1014 ' ' GLN . . . . . 1.052 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 6.7 tp60 -52.66 -59.15 4.82 Favored 'General case' 0 N--CA 1.437 -1.113 0 O-C-N 123.989 0.806 . . . . 0.0 110.477 -165.73 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1015 ' ' GLN . . . . . 0.514 ' O ' ' HD3' ' A' 1019 ' ' LYS . 77.5 mt-30 -65.92 -38.21 88.07 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.651 -169.201 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -70.03 -44.94 68.22 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.468 0.652 . . . . 0.0 110.574 178.164 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.628 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 13.4 m-85 -71.94 -30.76 65.65 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.758 -176.808 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.596 ' HD3' ' CZ ' ' A' ' 951' ' ' TYR . 23.4 tptm -78.86 -33.99 45.4 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 114.172 -1.376 . . . . 0.0 109.951 -176.001 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1019 ' ' LYS . . . . . 0.514 ' HD3' ' O ' ' A' 1015 ' ' GLN . 4.6 mptp? -71.1 -44.65 65.21 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 175.924 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -57.8 -33.01 68.12 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.72 165.679 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.548 ' HB3' ' HA ' ' A' 1018 ' ' LYS . 1.9 tmt? -65.85 -51.5 58.31 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 110.294 -0.262 . . . . 0.0 110.294 179.21 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1022 ' ' LEU . . . . . 0.542 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -81.15 -9.69 59.76 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 119.423 -0.911 . . . . 0.0 109.869 -175.713 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 72.7 m -81.97 -41.11 21.22 Favored 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 173.822 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.503 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -78.51 -22.13 47.84 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-O 121.139 0.495 . . . . 0.0 109.843 174.733 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.95 ' HB2' HD13 ' A' ' 998' ' ' LEU . . . -85.57 -23.57 27.57 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.216 170.441 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.51 ' O ' HG23 ' A' 1030 ' ' VAL . 22.2 t-80 -76.04 -25.92 56.09 Favored 'General case' 0 C--O 1.214 -0.779 0 C-N-CA 120.164 -0.614 . . . . 0.0 109.422 164.154 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1027 ' ' ALA . . . . . 0.503 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -66.5 -40.15 89.07 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 162.552 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.627 HD13 HD12 ' A' ' 995' ' ' LEU . 16.6 mt -60.17 -49.16 78.73 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 170.629 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -57.11 -41.02 78.18 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 175.29 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.51 HG23 ' O ' ' A' 1026 ' ' HIS . 10.6 t -71.88 -51.55 30.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.44 0.638 . . . . 0.0 110.794 -176.17 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1031 ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -77.11 -30.12 55.11 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.907 -174.651 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.516 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -70.7 -32.83 70.2 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 172.342 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 52.5 tttm -62.81 -45.69 91.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.768 0.794 . . . . 0.0 109.37 169.062 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.506 ' O ' ' HB3' ' A' 1037 ' ' ASP . 53.7 t30 -68.14 -50.32 55.35 Favored 'General case' 0 C--O 1.218 -0.595 0 CA-C-N 114.369 -1.287 . . . . 0.0 111.738 -176.408 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.982 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 1.9 pp -62.52 -40.84 98.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 119.084 -0.484 . . . . 0.0 111.047 -171.971 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.639 ' HB3' ' CG2' ' A' ' 925' ' ' VAL . 3.9 pp -66.26 -42.34 88.63 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 117.66 -1.616 . . . . 0.0 109.587 177.656 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.506 ' HB3' ' O ' ' A' 1034 ' ' ASN . 23.6 t70 -54.47 -38.36 66.29 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-N 113.982 -1.463 . . . . 0.0 110.128 175.663 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' 1034 ' ' ASN . 27.3 t -63.93 -36.5 76.95 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.614 0 CA-C-N 114.453 -1.249 . . . . 0.0 112.366 177.078 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.611 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 1.7 mp -86.56 -32.37 6.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 119.04 0.836 . . . . 0.0 111.094 177.452 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.524 ' O ' ' HG3' ' A' 1043 ' ' ARG . 4.0 m-20 -62.9 -41.27 99.38 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 169.599 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -68.2 -39.25 82.5 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.056 170.204 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.733 ' HB2' ' HG2' ' A' ' 983' ' ' GLU . . . -55.41 -48.75 73.91 Favored 'General case' 0 CA--C 1.49 -1.339 0 C-N-CA 123.066 0.546 . . . . 0.0 110.782 -176.742 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.639 ' HD3' ' N ' ' A' 1044 ' ' LEU . 0.0 OUTLIER -65.01 -34.97 79.7 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.402 -174.08 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A 1044 ' ' LEU . . . . . 0.639 ' N ' ' HD3' ' A' 1043 ' ' ARG . 3.1 tm? . . . . . 0 N--CA 1.45 -0.466 0 CA-C-O 121.567 0.698 . . . . 0.0 110.123 179.7 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.501 ' HA ' ' HG2' ' A' ' 927' ' ' GLU . 16.4 mmtp . . . . . 0 C--O 1.223 -0.29 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.627 HG23 HD22 ' A' 1036 ' ' LEU . 20.7 m -57.87 -29.12 34.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.709 0.766 . . . . 0.0 110.352 -179.73 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 926' ' ' TYR . . . . . 0.433 ' O ' HG23 ' A' ' 930' ' ' THR . 14.3 m-85 -72.94 -39.78 65.93 Favored 'General case' 0 CA--C 1.483 -1.603 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.582 175.503 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 927' ' ' GLU . . . . . 0.506 ' HA ' ' OG1' ' A' ' 930' ' ' THR . 9.3 pt-20 -74.38 -22.29 59.26 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 117.749 -1.58 . . . . 0.0 109.982 -176.406 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -75.05 -32.04 61.43 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.038 -0.726 . . . . 0.0 109.038 172.095 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.672 HG22 ' HB1' ' A' 1032 ' ' ALA . 85.4 t -81.13 -29.79 11.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.244 175.536 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.506 ' OG1' ' HA ' ' A' ' 927' ' ' GLU . 66.5 p -68.82 -29.28 67.58 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 169.351 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -70.19 -53.26 14.6 Favored Glycine 0 CA--C 1.529 0.958 0 CA-C-N 115.113 -0.949 . . . . 0.0 113.14 172.92 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.661 HD21 HG22 ' A' ' 929' ' ' VAL . 2.6 pp -65.28 -49.32 70.0 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -178.453 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.426 HG22 ' HA ' ' A' 1029 ' ' ALA . 88.6 t -64.27 -41.18 91.58 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-O 121.069 0.461 . . . . 0.0 110.238 -176.906 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 934' ' ' LYS . . . . . . . . . . . . . 1.4 ttpt -54.73 -39.92 68.74 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.133 -0.939 . . . . 0.0 109.958 177.952 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -66.72 -39.95 88.21 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.613 0.227 . . . . 0.0 111.613 -178.541 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.751 HG22 ' HB1' ' A' 1025 ' ' ALA . 59.7 t -47.46 -68.32 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 O-C-N 123.81 0.694 . . . . 0.0 111.3 179.506 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 26.5 pt -65.45 -37.29 79.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.905 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -58.89 -56.55 20.81 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.57 0.7 . . . . 0.0 110.747 -172.937 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.431 ' HB2' ' HE3' ' A' ' 954' ' ' MET . 13.3 mmt -76.52 -25.82 54.56 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.52 -0.763 . . . . 0.0 110.394 -177.076 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.546 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 76.9 p . . . . . 0 CA--C 1.516 -0.34 0 CA-C-O 121.447 0.642 . . . . 0.0 110.995 -169.842 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.992 ' HB3' ' HG3' ' A' 1002 ' ' MET . 22.9 m-85 . . . . . 0 N--CA 1.47 0.567 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 0.653 ' O ' ' HB ' ' A' ' 955' ' ' VAL . 61.4 t -43.87 -46.12 19.63 Favored Pre-proline 0 C--N 1.32 -0.709 0 C-N-CA 122.868 0.467 . . . . 0.0 111.65 172.297 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 0.635 ' HA ' ' HD3' ' A' ' 956' ' ' LYS . 14.1 Cg_exo -45.5 -51.07 8.47 Favored 'Trans proline' 0 CA--C 1.544 0.987 0 C-N-CA 122.434 2.089 . . . . 0.0 113.59 173.591 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.431 ' HE3' ' HB2' ' A' ' 939' ' ' MET . 6.8 ptm -69.56 -30.96 68.87 Favored 'General case' 0 N--CA 1.463 0.199 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 177.615 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.653 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 73.5 t -54.13 -36.68 32.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.778 171.723 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.635 ' HD3' ' HA ' ' A' ' 953' ' ' PRO . 2.4 mptp? -59.22 -41.63 89.09 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 119.097 -0.477 . . . . 0.0 111.371 171.179 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -77.54 -39.6 45.41 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 118.929 -1.108 . . . . 0.0 111.378 -177.548 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.649 HG22 ' HA ' ' A' ' 955' ' ' VAL . 24.3 m -73.97 -35.33 41.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 O-C-N 122.208 -0.308 . . . . 0.0 111.2 179.716 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -66.07 -34.96 89.87 Favored Glycine 0 N--CA 1.44 -1.082 0 N-CA-C 110.672 -0.971 . . . . 0.0 110.672 177.318 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 960' ' ' LEU . . . . . 0.545 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 9.4 tt -71.29 -33.11 69.43 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.127 -0.537 . . . . 0.0 109.803 176.007 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 961' ' ' ALA . . . . . 0.415 ' HB1' ' HB3' ' A' ' 932' ' ' LEU . . . -73.83 -37.8 64.74 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.513 -176.519 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.874 HD13 HD22 ' A' ' 991' ' ' LEU . 0.2 OUTLIER -66.5 -49.38 66.76 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-O 119.303 -0.38 . . . . 0.0 110.638 171.792 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.545 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 12.7 ptm180 -64.24 -30.29 71.35 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 118.856 0.753 . . . . 0.0 111.042 -177.416 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 964' ' ' THR . . . . . 0.402 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 38.7 m -69.14 -33.89 74.15 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 176.641 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.466 ' CD1' ' HB ' ' A' ' 925' ' ' VAL . 31.9 tp -71.34 -39.87 71.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 122.053 0.93 . . . . 0.0 109.669 175.176 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 10.4 tt -63.18 -43.94 96.82 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 114.505 -1.225 . . . . 0.0 108.812 -177.251 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -70.19 -38.61 75.38 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 114.787 -1.097 . . . . 0.0 111.977 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 3.2 p -65.46 -44.17 88.03 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.544 177.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.869 HG12 HG23 ' A' ' 984' ' ' ILE . 61.2 t -68.35 -36.41 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.246 175.134 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 970' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -69.38 -41.96 75.8 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 122.24 1.019 . . . . 0.0 109.031 -179.547 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.619 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 39.1 tt0 -73.24 -22.31 60.44 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 114.482 -1.236 . . . . 0.0 109.476 -179.324 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.699 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 58.7 m -72.9 -15.97 61.57 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.925 172.324 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.764 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 8.1 tt -64.08 -50.65 67.8 Favored Pre-proline 0 C--N 1.329 -0.302 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 175.717 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.764 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 13.2 Cg_exo -72.34 -11.85 27.01 Favored 'Trans proline' 0 C--N 1.355 0.916 0 C-N-CA 121.705 1.603 . . . . 0.0 113.396 169.766 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.699 ' HB ' ' HA ' ' A' ' 972' ' ' SER . 45.9 t . . . . . 0 C--N 1.328 -0.366 0 O-C-N 122.034 -0.416 . . . . 0.0 110.269 174.112 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 980' ' ' THR . . . . . . . . . . . . . 88.4 m . . . . . 0 CA--C 1.535 0.397 0 CA-C-O 121.104 0.478 . . . . 0.0 110.369 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.47 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 14.1 p80 -50.36 -57.37 8.09 Favored 'General case' 0 C--O 1.219 -0.517 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 -176.118 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 5.5 ptp180 -56.23 -22.65 30.9 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 113.974 1.101 . . . . 0.0 113.974 -176.587 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.54 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 2.6 mp0 -77.08 -38.21 52.92 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 119.11 0.868 . . . . 0.0 109.97 174.796 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.869 HG23 HG12 ' A' ' 969' ' ' VAL . 32.7 mt -71.11 -30.68 41.91 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.935 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.096 177.408 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 985' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 42.7 mt-10 -66.88 -51.77 51.45 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.437 177.511 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 986' ' ' MET . . . . . 0.414 ' O ' ' HB3' ' A' ' 989' ' ' LYS . 68.5 mtt -70.79 -42.08 70.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 114.64 -1.163 . . . . 0.0 111.468 -175.387 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 1.053 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -69.4 -51.64 34.61 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.457 -0.792 . . . . 0.0 112.225 -170.957 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.51 ' O ' ' HB2' ' A' ' 992' ' ' ASN . 23.0 pt20 -62.87 -21.82 66.26 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.375 177.661 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 989' ' ' LYS . . . . . 0.765 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 12.0 ttmt -70.29 -42.36 72.14 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.565 171.34 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 2.6 mp -55.35 -53.9 50.42 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.874 HD22 HD13 ' A' ' 962' ' ' LEU . 2.3 tt -67.88 -25.7 65.65 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 178.5 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 992' ' ' ASN . . . . . 0.765 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 25.3 t-20 -53.17 -56.74 14.0 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.29 178.532 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 3.8 p -79.14 -34.07 43.61 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -177.713 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.07 -41.99 97.13 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.335 -0.546 . . . . 0.0 111.407 178.301 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 0.63 ' N ' HD21 ' A' 1028 ' ' LEU . 2.3 tm? -64.03 -23.88 67.5 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 122.576 0.35 . . . . 0.0 110.184 173.16 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -70.91 -32.74 69.77 Favored 'General case' 0 C--N 1.313 -0.994 0 C-N-CA 119.274 -0.971 . . . . 0.0 110.835 169.722 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.518 ' O ' ' HG2' ' A' 1001 ' ' LYS . 74.1 mm-40 -76.29 -38.09 56.59 Favored 'General case' 0 CA--C 1.512 -0.505 0 O-C-N 121.858 -0.526 . . . . 0.0 110.1 177.279 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.636 HD21 ' SD ' ' A' 1021 ' ' MET . 1.1 tm? -56.24 -47.13 79.09 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.339 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.613 ' O ' ' HB2' ' A' 1003 ' ' LYS . 72.7 mt -65.71 -31.82 55.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.728 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -62.67 -38.82 91.85 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.872 0.368 . . . . 0.0 111.676 176.778 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.518 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 54.8 mmtt -77.5 -43.02 33.51 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 122.529 1.157 . . . . 0.0 108.46 -177.519 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.992 ' HG3' ' HB3' ' A' ' 951' ' ' TYR . 12.0 tpp -57.8 -29.96 65.32 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 113.482 -1.69 . . . . 0.0 109.2 177.532 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.613 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 15.7 tptt -73.28 -55.11 6.86 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 114.162 -1.381 . . . . 0.0 111.037 -167.155 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.855 ' HB3' HD23 ' A' 1013 ' ' LEU . 3.9 mm? -71.4 -13.66 61.92 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.32 -178.535 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.744 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -69.86 -45.22 68.23 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 119.366 -0.933 . . . . 0.0 109.477 179.705 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.942 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 3.4 pp0? -75.75 -26.73 57.67 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 120.071 -0.652 . . . . 0.0 111.718 172.362 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.691 ' HG3' HD13 ' A' 1004 ' ' LEU . 14.5 mm100 -52.0 -54.61 27.79 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.152 0.501 . . . . 0.0 110.581 174.271 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.806 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 72.1 m-85 -114.98 41.15 2.46 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.229 -0.588 . . . . 0.0 109.96 173.573 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1009 ' ' VAL . . . . . 1.053 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 14.7 p -49.41 -22.16 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.603 172.389 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 20.6 mmt -30.96 -57.13 0.22 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.202 173.096 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1011 ' ' THR . . . . . . . . . . . . . 97.9 m -164.98 -72.32 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 O-C-N 123.122 0.263 . . . . 0.0 111.646 173.034 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 32.5 t -50.8 -74.92 0.03 OUTLIER 'General case' 0 C--O 1.24 0.595 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.8 -169.02 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1013 ' ' LEU . . . . . 0.855 HD23 ' HB3' ' A' 1004 ' ' LEU . 7.6 mp -50.46 -39.08 46.89 Favored 'General case' 0 CA--C 1.504 -0.812 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -178.235 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1014 ' ' GLN . . . . . 1.053 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.2 OUTLIER -54.62 -49.25 70.94 Favored 'General case' 0 N--CA 1.442 -0.838 0 O-C-N 123.505 0.503 . . . . 0.0 111.465 -168.186 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A 1015 ' ' GLN . . . . . 0.429 ' O ' ' HD3' ' A' 1019 ' ' LYS . 12.1 pt20 -74.67 -38.8 62.33 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.607 -176.466 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 53.5 tt0 -66.75 -53.75 30.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.583 0.706 . . . . 0.0 110.592 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.744 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 5.9 m-85 -65.67 -34.32 77.94 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.73 -1.123 . . . . 0.0 113.651 -174.177 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.515 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 51.4 tptt -80.32 -29.19 38.06 Favored 'General case' 0 N--CA 1.461 0.102 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.199 -177.7 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1019 ' ' LYS . . . . . 0.429 ' HD3' ' O ' ' A' 1015 ' ' GLN . 3.4 mptp? -72.52 -50.73 23.77 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 173.821 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -54.4 -31.84 55.87 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.086 166.496 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.636 ' SD ' HD21 ' A' ' 998' ' ' LEU . 10.9 tmm? -65.51 -52.32 53.53 Favored 'General case' 0 C--O 1.217 -0.651 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 174.092 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1022 ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' 1022 ' ' LEU . 0.0 OUTLIER -74.08 -12.17 60.53 Favored 'General case' 0 C--O 1.218 -0.591 0 C-N-CA 119.258 -0.977 . . . . 0.0 109.806 -176.762 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 92.5 m -82.21 -41.86 19.74 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.205 175.711 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.548 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.12 -22.04 49.44 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-O 120.972 0.415 . . . . 0.0 109.937 174.134 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.751 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -84.7 -22.05 29.91 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.929 169.704 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.515 ' O ' HG23 ' A' 1030 ' ' VAL . 47.6 t60 -76.55 -25.62 54.26 Favored 'General case' 0 C--O 1.213 -0.854 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 164.587 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1027 ' ' ALA . . . . . 0.452 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -69.52 -41.4 76.07 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 122.746 0.419 . . . . 0.0 110.168 163.59 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.63 HD21 ' N ' ' A' ' 995' ' ' LEU . 21.0 mt -60.33 -46.56 89.46 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 170.921 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1029 ' ' ALA . . . . . 0.426 ' HA ' HG22 ' A' ' 933' ' ' VAL . . . -57.57 -43.04 84.22 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 123.192 0.308 . . . . 0.0 111.456 173.306 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.515 HG23 ' O ' ' A' 1026 ' ' HIS . 4.9 t -66.55 -50.74 64.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-O 120.916 0.389 . . . . 0.0 110.47 -176.663 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.69 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 14.0 m-20 -75.02 -29.1 60.72 Favored 'General case' 0 C--O 1.212 -0.871 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.212 -176.475 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.672 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -58.97 -45.82 89.58 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 168.438 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 56.1 tttm -65.29 -41.98 93.57 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.768 0.794 . . . . 0.0 109.877 175.448 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.69 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 38.9 t30 -70.5 -53.76 14.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.002 -1.454 . . . . 0.0 112.09 -172.823 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1035 ' ' LEU . . . . . 1.053 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 2.5 pp -62.79 -38.57 91.19 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 119.332 -0.366 . . . . 0.0 110.599 -174.878 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.627 HD22 HG23 ' A' ' 925' ' ' VAL . 4.3 pp -71.43 -36.4 71.27 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 116.933 -1.907 . . . . 0.0 109.734 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.61 ' N ' HD12 ' A' 1036 ' ' LEU . 11.5 t70 -57.92 -39.76 78.77 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.749 174.291 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.54 ' HB ' ' O ' ' A' 1035 ' ' LEU . 13.1 t -55.86 -33.49 34.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 114.124 -1.398 . . . . 0.0 111.578 173.807 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.592 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 1.9 mp -86.44 -33.94 7.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 117.944 0.338 . . . . 0.0 111.486 175.19 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.467 ' O ' ' HG3' ' A' 1043 ' ' ARG . 1.0 OUTLIER -53.18 -49.45 66.64 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 166.424 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -69.2 -39.92 78.35 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.371 -0.832 . . . . 0.0 111.205 175.223 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.592 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -54.63 -49.28 70.89 Favored 'General case' 0 CA--C 1.497 -1.081 0 C-N-CA 122.932 0.493 . . . . 0.0 111.782 -175.637 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.548 ' HD3' ' N ' ' A' 1044 ' ' LEU . 0.0 OUTLIER -63.68 -38.52 91.42 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.818 -178.319 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A 1044 ' ' LEU . . . . . 0.548 ' N ' ' HD3' ' A' 1043 ' ' ARG . 56.4 tp . . . . . 0 N--CA 1.448 -0.527 0 CA-C-O 121.768 0.794 . . . . 0.0 109.566 178.56 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.766 ' HB3' HG21 ' A' ' 968' ' ' THR . 16.8 tppt? . . . . . 0 C--O 1.225 -0.222 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.525 ' O ' HG23 ' A' ' 929' ' ' VAL . 29.0 m -61.7 -29.8 46.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-O 121.079 0.466 . . . . 0.0 110.304 177.291 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -78.2 -26.28 47.46 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 176.356 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -76.02 -25.7 55.95 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.035 174.474 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.571 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 5.1 m120 -77.29 -29.84 53.94 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 121.663 0.744 . . . . 0.0 109.032 173.712 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.593 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 81.8 t -76.68 -29.48 18.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.329 174.642 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 930' ' ' THR . . . . . 0.439 ' O ' ' HB3' ' A' ' 934' ' ' LYS . 36.1 m -60.49 -39.98 89.64 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 170.217 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -72.32 -53.25 9.11 Favored Glycine 0 CA--C 1.524 0.629 0 CA-C-N 115.103 -0.953 . . . . 0.0 113.708 178.547 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.593 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.8 pp -65.05 -47.61 76.76 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -175.667 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 933' ' ' VAL . . . . . 0.433 HG23 HG13 ' A' ' 929' ' ' VAL . 73.6 t -63.25 -42.9 98.12 Favored 'Isoleucine or valine' 0 C--O 1.24 0.582 0 CA-C-O 121.407 0.622 . . . . 0.0 110.52 -177.797 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.759 ' O ' ' HB2' ' A' ' 938' ' ' GLU . 16.0 ttpt -60.51 -40.22 90.62 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.655 178.449 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -58.59 -46.59 86.63 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.499 -0.48 . . . . 0.0 111.083 175.174 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.818 HG22 ' HB1' ' A' 1025 ' ' ALA . 57.8 t -45.05 -83.65 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 123.274 0.63 . . . . 0.0 112.386 -179.075 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 19.4 pt -64.6 -43.41 96.73 Favored 'Isoleucine or valine' 0 C--O 1.248 0.997 0 N-CA-C 112.316 0.488 . . . . 0.0 112.316 -173.41 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.759 ' HB2' ' O ' ' A' ' 934' ' ' LYS . 6.2 mm-40 -67.84 -51.29 50.17 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.855 -169.576 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 939' ' ' MET . . . . . 0.53 ' HB3' ' HE1' ' A' ' 954' ' ' MET . 30.8 ttm -72.78 -27.81 62.22 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 120.093 -0.643 . . . . 0.0 109.686 -175.71 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 940' ' ' SER . . . . . . . . . . . . . 2.8 m . . . . . 0 C--N 1.346 0.441 0 O-C-N 123.97 0.793 . . . . 0.0 112.501 -174.057 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.904 ' HB3' ' HG3' ' A' 1002 ' ' MET . 20.6 m-30 . . . . . 0 N--CA 1.479 1.022 0 N-CA-C 115.789 1.774 . . . . 0.0 115.789 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 0.507 ' O ' ' HB ' ' A' ' 955' ' ' VAL . 45.4 t -54.79 -40.6 84.9 Favored Pre-proline 0 C--N 1.32 -0.688 0 O-C-N 122.076 -0.39 . . . . 0.0 111.019 168.842 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 0.745 ' HA ' ' HD2' ' A' ' 956' ' ' LYS . 8.2 Cg_exo -44.57 -51.32 7.25 Favored 'Trans proline' 0 C--N 1.357 0.985 0 C-N-CA 122.468 2.112 . . . . 0.0 112.836 170.927 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.53 ' HE1' ' HB3' ' A' ' 939' ' ' MET . 0.4 OUTLIER -62.66 -41.76 99.24 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.884 172.144 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.507 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 54.9 t -52.4 -36.88 22.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.886 176.342 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 956' ' ' LYS . . . . . 0.745 ' HD2' ' HA ' ' A' ' 953' ' ' PRO . 59.6 mttt -66.12 -41.89 89.92 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 111.599 0.222 . . . . 0.0 111.599 173.15 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -77.32 -44.82 28.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.754 0.311 . . . . 0.0 111.356 -172.061 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.54 ' O ' ' HG ' ' A' ' 962' ' ' LEU . 14.4 p -75.1 -34.47 31.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 176.915 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -64.44 -43.72 96.32 Favored Glycine 0 N--CA 1.448 -0.56 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 177.266 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 960' ' ' LEU . . . . . 0.565 HD12 ' HD2' ' A' ' 963' ' ' ARG . 16.3 tp -63.14 -38.47 91.31 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.925 -0.137 . . . . 0.0 110.678 175.23 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -69.84 -60.02 2.57 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 120.898 0.38 . . . . 0.0 111.012 -177.345 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.857 HD13 HD22 ' A' ' 995' ' ' LEU . 4.1 pp -56.54 -29.66 62.19 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 173.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.565 ' HD2' HD12 ' A' ' 960' ' ' LEU . 9.9 ptp180 -73.77 -36.39 65.08 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 120.195 1.361 . . . . 0.0 110.637 172.027 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 32.2 m -62.72 -33.52 75.29 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 174.136 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.571 ' HA ' ' OD1' ' A' ' 928' ' ' ASN . 25.8 tp -61.65 -54.35 44.0 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.487 174.132 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 0.767 ' HG ' ' NE2' ' A' ' 988' ' ' GLN . 8.0 tt -54.95 -41.04 70.6 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.185 -1.37 . . . . 0.0 109.38 178.826 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -68.8 -35.07 76.57 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.034 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.766 HG21 ' HB3' ' A' ' 924' ' ' LYS . 23.2 m -73.17 -39.21 65.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 118.809 0.731 . . . . 0.0 110.675 177.305 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.773 HG12 HG23 ' A' ' 984' ' ' ILE . 27.1 t -67.31 -36.67 77.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 CA-C-O 120.726 0.298 . . . . 0.0 110.519 173.255 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.422 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 20.4 t70 -68.63 -42.37 78.14 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 179.217 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.664 ' O ' HG23 ' A' ' 975' ' ' VAL . 31.7 tp10 -68.34 -24.8 64.86 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 113.857 -1.52 . . . . 0.0 109.69 179.738 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 58.8 m -73.54 -17.59 61.19 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.366 177.584 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.687 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 35.0 tp -67.72 -52.81 24.25 Favored Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 119.741 -0.783 . . . . 0.0 110.284 172.683 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.687 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 19.2 Cg_exo -70.14 -11.31 30.1 Favored 'Trans proline' 0 C--N 1.358 1.041 0 C-N-CA 121.404 1.403 . . . . 0.0 113.502 172.905 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.664 HG23 ' O ' ' A' ' 971' ' ' GLU . 38.8 t . . . . . 0 N--CA 1.466 0.356 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 173.228 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.687 ' OG1' ' HB1' ' A' 1042 ' ' ALA . 6.0 t . . . . . 0 N--CA 1.455 -0.18 0 N-CA-C 110.856 -0.053 . . . . 0.0 110.856 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.495 ' O ' ' HG2' ' A' ' 985' ' ' GLU . 1.9 p80 -49.69 -49.14 48.82 Favored 'General case' 0 C--O 1.208 -1.101 0 O-C-N 123.224 0.327 . . . . 0.0 110.984 -177.675 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.65 -21.42 3.95 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 179.426 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.68 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 0.3 OUTLIER -80.08 -49.53 11.63 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 118.747 0.703 . . . . 0.0 111.45 171.071 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.773 HG23 HG12 ' A' ' 969' ' ' VAL . 2.9 mp -63.52 -30.94 51.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 178.174 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 985' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 981' ' ' HIS . 70.4 mm-40 -58.9 -46.17 88.52 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.083 175.718 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 24.6 mmt -73.13 -42.74 62.56 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.205 -176.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 0.814 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -65.65 -49.32 69.09 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 114.713 -1.131 . . . . 0.0 111.971 -176.384 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.784 ' O ' ' HB2' ' A' ' 992' ' ' ASN . 12.8 mm100 -56.02 -40.81 73.98 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.035 177.533 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 989' ' ' LYS . . . . . 0.592 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 0.0 OUTLIER -72.35 -39.2 68.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.297 -178.784 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.605 HD23 ' HB3' ' A' 1035 ' ' LEU . 26.7 tp -55.0 -59.12 5.18 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.921 179.702 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.619 ' HB3' ' CD2' ' A' 1035 ' ' LEU . 3.2 pp -63.08 -31.62 72.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.868 0.842 . . . . 0.0 109.741 179.007 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 992' ' ' ASN . . . . . 0.784 ' HB2' ' O ' ' A' ' 988' ' ' GLN . 20.6 t-20 -53.58 -57.33 11.13 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 113.564 -1.653 . . . . 0.0 112.747 -174.589 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 25.0 m -79.71 -25.34 41.2 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 -177.569 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -72.58 -38.03 68.01 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 119.346 -0.941 . . . . 0.0 111.404 177.714 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 0.857 HD22 HD13 ' A' ' 962' ' ' LEU . 0.5 OUTLIER -66.91 -24.25 66.07 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.132 171.033 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -78.19 -26.3 47.52 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 119.47 -0.892 . . . . 0.0 109.708 172.435 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 997' ' ' GLU . . . . . 0.53 ' O ' ' HG2' ' A' 1001 ' ' LYS . 6.8 tp10 -74.41 -42.69 58.79 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 173.636 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.761 HD22 HD11 ' A' 1028 ' ' LEU . 0.0 OUTLIER -56.99 -47.25 81.27 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.649 -178.89 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.644 ' O ' ' HB2' ' A' 1003 ' ' LYS . 82.6 mt -66.64 -39.26 83.38 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.332 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.246 -174.532 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 21.2 m-80 -62.18 -36.75 82.84 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.072 0.463 . . . . 0.0 111.633 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.53 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 72.3 mmtt -78.28 -40.61 36.41 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 122.133 0.968 . . . . 0.0 109.422 -177.42 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.904 ' HG3' ' HB3' ' A' ' 951' ' ' TYR . 5.0 tpt -63.86 -27.32 69.08 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.28 -1.327 . . . . 0.0 109.049 178.168 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.644 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 12.4 tptp -73.28 -53.09 11.71 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.031 -1.44 . . . . 0.0 110.506 -167.4 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.588 ' O ' HD23 ' A' 1013 ' ' LEU . 7.2 mp -77.4 -12.03 59.91 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.142 179.545 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.748 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -67.56 -40.74 84.93 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 119.526 -0.87 . . . . 0.0 109.526 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.76 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.3 pp0? -75.04 -32.72 61.63 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 119.115 -0.469 . . . . 0.0 111.69 169.56 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.57 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 10.6 mm-40 -46.37 -49.51 17.76 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.04 0.447 . . . . 0.0 110.588 175.925 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.904 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 49.7 m-85 -126.86 48.3 2.2 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 119.844 -0.743 . . . . 0.0 110.542 171.246 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1009 ' ' VAL . . . . . 0.954 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 11.9 p -50.94 -21.54 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.593 167.711 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 87.8 mtp -37.9 -49.35 1.22 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.161 -1.382 . . . . 0.0 111.574 172.509 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1011 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -171.76 -81.8 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 177.338 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 2.5 m -49.89 -71.46 0.06 Allowed 'General case' 0 C--O 1.246 0.911 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.829 -168.879 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1013 ' ' LEU . . . . . 0.904 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 4.8 mp -46.56 -42.82 16.45 Favored 'General case' 0 CA--C 1.498 -1.047 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 179.539 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1014 ' ' GLN . . . . . 0.954 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.82 -58.01 9.26 Favored 'General case' 0 N--CA 1.438 -1.048 0 C-N-CA 119.827 -0.749 . . . . 0.0 110.769 -166.833 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A 1015 ' ' GLN . . . . . 0.622 ' O ' ' HB3' ' A' 1019 ' ' LYS . 40.3 mt-30 -67.83 -34.79 77.42 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.02 -169.452 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1016 ' ' GLU . . . . . 0.468 ' OE2' ' HE3' ' A' 1019 ' ' LYS . 18.4 tp10 -73.96 -41.64 61.68 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.307 -0.557 . . . . 0.0 111.142 177.517 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.748 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 6.1 m-85 -75.14 -34.4 61.64 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.93 0.871 . . . . 0.0 111.834 -173.927 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.517 ' HB2' ' NE2' ' A' 1014 ' ' GLN . 13.7 tptm -79.79 -40.86 27.7 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 113.414 -1.721 . . . . 0.0 110.825 -175.958 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1019 ' ' LYS . . . . . 0.622 ' HB3' ' O ' ' A' 1015 ' ' GLN . 0.0 OUTLIER -71.38 -35.19 71.0 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -179.58 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A 1020 ' ' GLN . . . . . 0.599 ' N ' ' HD3' ' A' 1019 ' ' LYS . 9.4 tt0 -69.99 -30.25 67.53 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.098 -1.41 . . . . 0.0 110.49 167.328 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.759 ' HG3' ' SD ' ' A' 1002 ' ' MET . 14.8 tmm? -69.02 -54.03 17.32 Favored 'General case' 0 CA--C 1.507 -0.702 0 C-N-CA 120.977 -0.289 . . . . 0.0 111.034 -179.616 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1022 ' ' LEU . . . . . 0.676 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.2 OUTLIER -83.63 -2.72 56.72 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 119.485 -0.886 . . . . 0.0 109.462 -172.43 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 46.1 m -86.11 -34.09 20.73 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 168.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.53 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -79.09 -22.6 45.0 Favored 'General case' 0 C--O 1.221 -0.425 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 173.015 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.818 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -85.9 -26.56 25.52 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.005 169.567 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.525 ' O ' HG23 ' A' 1030 ' ' VAL . 12.9 t60 -70.86 -30.7 67.17 Favored 'General case' 0 C--O 1.215 -0.762 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 165.234 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1027 ' ' ALA . . . . . 0.53 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -64.91 -42.46 94.71 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 123.975 0.91 . . . . 0.0 110.755 163.966 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.761 HD11 HD22 ' A' ' 998' ' ' LEU . 30.2 mt -58.13 -46.69 85.18 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 119.923 -0.711 . . . . 0.0 109.472 171.507 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1029 ' ' ALA . . . . . 0.426 ' CB ' HG22 ' A' ' 933' ' ' VAL . . . -59.09 -43.51 91.83 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 173.565 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.581 ' O ' ' HB3' ' A' 1033 ' ' LYS . 12.2 t -68.01 -51.23 51.4 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.211 0 CA-C-O 121.675 0.75 . . . . 0.0 110.863 -176.54 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.4 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 21.3 m-20 -76.76 -29.5 56.14 Favored 'General case' 0 C--O 1.214 -0.814 0 CA-C-N 115.056 -0.974 . . . . 0.0 112.158 -175.114 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.625 ' HA ' ' CD2' ' A' 1035 ' ' LEU . . . -71.28 -27.67 63.59 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.509 -0.476 . . . . 0.0 109.741 171.413 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.581 ' HB3' ' O ' ' A' 1030 ' ' VAL . 84.9 tttt -65.54 -45.92 81.57 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 122.091 0.948 . . . . 0.0 109.22 168.287 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.609 ' O ' ' HB3' ' A' 1037 ' ' ASP . 56.4 t30 -70.87 -46.61 62.32 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 113.967 -1.469 . . . . 0.0 112.599 -176.026 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1035 ' ' LEU . . . . . 0.814 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 4.0 pp -63.9 -36.38 83.76 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 122.156 -0.34 . . . . 0.0 110.627 -177.128 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.463 HD12 ' N ' ' A' 1037 ' ' ASP . 4.7 pp -72.36 -35.87 68.62 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 117.282 -1.767 . . . . 0.0 109.745 178.173 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.696 ' HA ' ' OD2' ' A' 1040 ' ' ASP . 19.3 t70 -54.88 -30.93 59.18 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 122.999 1.38 . . . . 0.0 110.585 168.716 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.534 ' HB ' ' O ' ' A' 1035 ' ' LEU . 14.3 t -73.57 -36.96 48.94 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.54 177.479 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.708 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 2.0 mp -79.31 -26.05 12.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 C-N-CA 121.123 -0.231 . . . . 0.0 111.573 172.894 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1040 ' ' ASP . . . . . 0.696 ' OD2' ' HA ' ' A' 1037 ' ' ASP . 0.2 OUTLIER -59.93 -44.69 94.19 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 171.48 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A 1041 ' ' GLN . . . . . 0.408 ' N ' ' OD1' ' A' 1040 ' ' ASP . 12.4 mt-30 -76.55 -31.22 57.45 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.718 174.885 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.708 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -56.29 -55.97 26.84 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 120.973 0.416 . . . . 0.0 111.818 -179.275 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.569 ' HG2' ' O ' ' A' 1039 ' ' ILE . 11.8 ptm180 -65.73 -34.52 78.38 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.535 -176.045 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 49.5 tp . . . . . 0 C--O 1.216 -0.707 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.772 171.705 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 924' ' ' LYS . . . . . 0.526 ' HB3' HG21 ' A' ' 968' ' ' THR . 31.0 mmtp . . . . . 0 N--CA 1.468 0.468 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 925' ' ' VAL . . . . . 0.583 ' O ' HG23 ' A' ' 929' ' ' VAL . 35.0 m -56.94 -34.95 45.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.116 0.484 . . . . 0.0 110.641 177.355 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 926' ' ' TYR . . . . . 0.494 ' CZ ' ' HG3' ' A' ' 927' ' ' GLU . 0.1 OUTLIER -74.08 -37.28 64.25 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.405 174.952 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 927' ' ' GLU . . . . . 0.494 ' HG3' ' CZ ' ' A' ' 926' ' ' TYR 0.257 1.9 tt0 -78.38 -23.78 46.65 Favored 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 118.399 -1.32 . . . . 0.0 113.758 -177.334 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 928' ' ' ASN . . . . . 0.445 ' ND2' HG22 ' A' ' 964' ' ' THR . 87.1 m-20 -72.2 -27.77 62.77 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.22 0.533 . . . . 0.0 110.097 169.504 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 929' ' ' VAL . . . . . 0.588 HG22 ' HB1' ' A' 1032 ' ' ALA . 98.7 t -77.0 -29.38 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.953 171.776 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 930' ' ' THR . . . . . . . . . . . . . 25.7 m -61.48 -40.38 94.33 Favored 'General case' 0 C--N 1.311 -1.088 0 C-N-CA 119.507 -0.877 . . . . 0.0 108.898 171.121 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -71.57 -53.05 10.53 Favored Glycine 0 CA--C 1.527 0.786 0 CA-C-N 115.172 -0.922 . . . . 0.0 113.689 176.467 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 932' ' ' LEU . . . . . 0.565 ' CD2' ' HA ' ' A' ' 929' ' ' VAL . 1.8 pp -61.73 -46.67 88.65 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.94 0.718 . . . . 0.0 112.94 -176.19 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 73.5 t -68.99 -39.24 79.49 Favored 'Isoleucine or valine' 0 C--O 1.241 0.605 0 CA-C-O 121.154 0.502 . . . . 0.0 110.906 -176.039 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 934' ' ' LYS . . . . . 0.471 ' HD3' ' HG3' ' A' ' 938' ' ' GLU . 5.2 tppp? -55.63 -44.11 76.8 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.679 -178.939 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -60.13 -45.19 93.86 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.462 177.727 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 936' ' ' VAL . . . . . 0.693 HG22 ' HB1' ' A' 1025 ' ' ALA . 85.4 t -45.17 -74.32 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 123.6 0.76 . . . . 0.0 112.879 -176.928 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 937' ' ' ILE . . . . . 0.511 HG22 HD12 ' A' 1022 ' ' LEU . 14.5 pt -77.32 -42.53 30.76 Favored 'Isoleucine or valine' 0 C--O 1.245 0.849 0 CA-C-N 115.927 -0.579 . . . . 0.0 112.546 -174.171 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 938' ' ' GLU . . . . . 0.471 ' HG3' ' HD3' ' A' ' 934' ' ' LYS . 35.4 mm-40 -66.65 -43.41 84.69 Favored 'General case' 0 C--N 1.316 -0.867 0 C-N-CA 120.53 -0.468 . . . . 0.0 111.105 -173.059 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 11.1 ttp -75.59 -27.28 58.48 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 119.225 -0.99 . . . . 0.0 110.615 176.238 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 940' ' ' SER . . . . . 0.655 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 32.5 t . . . . . 0 C--O 1.236 0.393 0 O-C-N 123.8 0.687 . . . . 0.0 112.101 -170.452 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 951' ' ' TYR . . . . . 0.552 ' CD1' ' N ' ' A' ' 951' ' ' TYR . 0.4 OUTLIER . . . . . 0 C--O 1.216 -0.699 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 952' ' ' VAL . . . . . 1.005 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -59.85 -42.69 92.24 Favored Pre-proline 0 CA--C 1.542 0.665 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.41 172.342 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 953' ' ' PRO . . . . . 1.005 ' HD3' HG13 ' A' ' 952' ' ' VAL . 87.1 Cg_exo -55.21 -38.76 93.43 Favored 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 121.212 1.274 . . . . 0.0 111.735 167.572 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 954' ' ' MET . . . . . 0.46 ' O ' HG22 ' A' ' 958' ' ' VAL . 4.0 ttm -66.38 -30.56 70.97 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.874 176.082 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 955' ' ' VAL . . . . . 0.648 HG23 ' HA ' ' A' ' 952' ' ' VAL . 69.4 t -53.53 -42.99 51.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 174.68 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.41 -36.0 80.4 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.464 175.29 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -78.46 -45.93 20.96 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 111.911 0.338 . . . . 0.0 111.911 -174.226 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 958' ' ' VAL . . . . . 0.685 ' O ' ' HG ' ' A' ' 962' ' ' LEU . 17.7 m -81.63 -34.7 13.15 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.663 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -60.13 -35.59 88.11 Favored Glycine 0 N--CA 1.437 -1.241 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 178.959 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 960' ' ' LEU . . . . . 0.56 HD12 ' HD3' ' A' ' 963' ' ' ARG . 19.5 tp -76.77 -36.57 56.94 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-O 120.697 0.284 . . . . 0.0 110.682 176.219 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -72.11 -44.21 63.54 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.097 0.475 . . . . 0.0 111.93 -173.11 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 962' ' ' LEU . . . . . 0.89 HD11 ' HG ' ' A' ' 995' ' ' LEU . 4.6 pp -87.16 -18.09 31.21 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.843 -177.853 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 963' ' ' ARG . . . . . 0.56 ' HD3' HD12 ' A' ' 960' ' ' LEU . 12.0 ptm180 -72.79 -38.01 67.38 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 118.834 -1.147 . . . . 0.0 110.119 165.782 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 964' ' ' THR . . . . . 0.498 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 23.9 m -65.62 -31.27 72.2 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.171 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 965' ' ' LEU . . . . . 0.701 HD23 ' HG ' ' A' ' 991' ' ' LEU . 17.7 tp -62.6 -50.16 72.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.089 171.837 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 966' ' ' LEU . . . . . 0.789 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 9.8 tt -64.21 -36.37 83.84 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.08 -0.963 . . . . 0.0 108.489 -174.696 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 967' ' ' ALA . . . . . 0.426 ' HA ' ' HB3' ' A' ' 970' ' ' ASP . . . -71.87 -39.19 69.8 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.925 178.496 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 968' ' ' THR . . . . . 0.526 HG21 ' HB3' ' A' ' 924' ' ' LYS . 2.2 p -61.48 -35.81 78.7 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 118.945 0.793 . . . . 0.0 110.212 174.049 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 969' ' ' VAL . . . . . 0.909 HG12 HG23 ' A' ' 984' ' ' ILE . 49.1 t -74.43 -36.61 42.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.208 174.168 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 970' ' ' ASP . . . . . 0.57 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 17.3 t70 -70.13 -42.04 73.14 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 122.04 0.924 . . . . 0.0 109.201 -178.629 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 971' ' ' GLU . . . . . 0.603 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 7.9 tp10 -67.2 -31.18 71.38 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.258 -1.337 . . . . 0.0 109.904 176.898 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 972' ' ' SER . . . . . 0.479 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 46.9 m -68.38 -18.04 64.37 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.939 174.642 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 973' ' ' LEU . . . . . 0.907 ' HG ' ' HB2' ' A' ' 981' ' ' HIS . 10.4 tt -66.74 -51.67 38.13 Favored Pre-proline 0 CA--C 1.53 0.194 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 -177.89 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 974' ' ' PRO . . . . . 0.745 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 5.0 Cg_exo -79.61 -4.77 13.75 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 121.388 1.392 . . . . 0.0 113.004 172.322 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 975' ' ' VAL . . . . . 0.586 HG23 ' O ' ' A' ' 971' ' ' GLU . 40.1 t . . . . . 0 C--N 1.329 -0.287 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.125 171.608 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 980' ' ' THR . . . . . 0.509 HG23 ' CB ' ' A' 1042 ' ' ALA . 54.4 m . . . . . 0 CA--C 1.535 0.386 0 CA-C-O 120.661 0.267 . . . . 0.0 111.144 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 981' ' ' HIS . . . . . 0.907 ' HB2' ' HG ' ' A' ' 973' ' ' LEU . 0.1 OUTLIER -69.0 -18.4 64.05 Favored 'General case' 0 C--O 1.218 -0.554 0 O-C-N 121.934 -0.479 . . . . 0.0 112.187 -174.653 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -83.2 -21.65 33.39 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 119.849 -0.74 . . . . 0.0 110.87 177.557 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 983' ' ' GLU . . . . . 0.545 ' CB ' ' HB2' ' A' 1042 ' ' ALA . 3.0 mp0 -76.15 -33.51 59.38 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 165.046 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 984' ' ' ILE . . . . . 0.909 HG23 HG12 ' A' ' 969' ' ' VAL . 69.6 mt -68.36 -30.39 47.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.569 178.326 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 985' ' ' GLU . . . . . 0.636 ' HG2' ' O ' ' A' ' 981' ' ' HIS . 72.5 mm-40 -62.45 -53.16 58.88 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.269 176.054 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 20.5 ttt -69.82 -39.98 76.16 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.831 -172.639 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 987' ' ' ALA . . . . . 1.065 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -76.44 -53.41 8.17 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.099 -1.409 . . . . 0.0 112.624 -167.638 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 988' ' ' GLN . . . . . 0.789 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 25.2 pt20 -65.04 -21.77 66.88 Favored 'General case' 0 C--O 1.226 -0.167 0 C-N-CA 120.126 -0.629 . . . . 0.0 109.592 178.464 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 989' ' ' LYS . . . . . 0.59 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 34.0 tttp -73.3 -43.26 61.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.124 -0.944 . . . . 0.0 112.178 173.78 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 990' ' ' LEU . . . . . 0.595 ' O ' ' HB2' ' A' ' 994' ' ' ASP . 16.0 mt -52.54 -53.73 42.22 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.235 174.34 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 991' ' ' LEU . . . . . 0.707 HD11 ' HB2' ' A' ' 962' ' ' LEU . 0.4 OUTLIER -59.82 -39.54 85.41 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 175.946 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 992' ' ' ASN . . . . . 0.59 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 40.9 t-20 -52.88 -57.29 10.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.006 -0.997 . . . . 0.0 111.565 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 26.6 p -80.05 -31.24 39.5 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.211 0.448 . . . . 0.0 112.211 -178.342 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 994' ' ' ASP . . . . . 0.595 ' HB2' ' O ' ' A' ' 990' ' ' LEU . 0.1 OUTLIER -65.91 -42.07 90.62 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 120.272 -0.571 . . . . 0.0 110.87 178.72 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 995' ' ' LEU . . . . . 0.89 ' HG ' HD11 ' A' ' 962' ' ' LEU . 1.8 tm? -59.42 -32.86 70.57 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.486 0.715 . . . . 0.0 110.691 168.108 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -67.77 -28.34 67.53 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 118.8 -1.16 . . . . 0.0 110.28 174.454 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -75.26 -43.11 53.22 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 120.638 0.256 . . . . 0.0 110.337 175.518 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 998' ' ' LEU . . . . . 0.889 HD13 ' HB2' ' A' 1025 ' ' ALA . 8.3 tp -55.8 -47.55 76.94 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.168 0.509 . . . . 0.0 110.998 -179.059 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 999' ' ' ILE . . . . . 0.536 ' O ' ' HB2' ' A' 1003 ' ' LYS . 39.9 mm -68.12 -34.1 64.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 115.296 -0.866 . . . . 0.0 111.738 -172.099 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 3.0 m120 -63.05 -38.62 91.91 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.179 0.514 . . . . 0.0 111.618 179.095 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1001 ' ' LYS . . . . . 0.517 ' HA ' ' HD1' ' A' 1017 ' ' TYR . 14.3 mptt -83.63 -36.74 23.62 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.826 0.822 . . . . 0.0 109.402 -176.121 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1002 ' ' MET . . . . . 0.465 ' HB2' ' HG2' ' A' 1021 ' ' MET . 46.3 ttm -59.87 -30.81 69.24 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 114.349 -1.296 . . . . 0.0 109.684 174.079 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1003 ' ' LYS . . . . . 0.619 ' O ' ' HG3' ' A' 1006 ' ' GLN . 4.6 tptp -74.24 -53.54 9.56 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 114.694 -1.139 . . . . 0.0 111.699 -170.595 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1004 ' ' LEU . . . . . 0.882 HD23 ' HG3' ' A' 1007 ' ' GLN . 86.4 mt -72.48 -13.69 61.49 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.461 -179.459 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1005 ' ' ALA . . . . . 0.661 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -70.36 -42.48 71.75 Favored 'General case' 0 C--O 1.216 -0.692 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 177.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1006 ' ' GLN . . . . . 0.901 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 5.1 pp0? -75.86 -31.73 59.42 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 119.034 -0.508 . . . . 0.0 111.938 172.699 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1007 ' ' GLN . . . . . 0.882 ' HG3' HD23 ' A' 1004 ' ' LEU . 13.2 mm100 -48.36 -51.43 26.4 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.265 0.555 . . . . 0.0 110.045 175.491 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1008 ' ' TYR . . . . . 0.762 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 69.6 m-85 -120.74 45.85 2.14 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.368 173.178 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1009 ' ' VAL . . . . . 1.099 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 10.8 p -52.2 -20.54 1.91 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 CA-C-N 114.847 -1.069 . . . . 0.0 110.183 170.14 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1010 ' ' MET . . . . . 0.45 ' O ' ' HB ' ' A' 1011 ' ' THR . 24.3 mmt -38.53 -44.09 0.92 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 113.843 -1.526 . . . . 0.0 111.298 172.69 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1011 ' ' THR . . . . . 0.497 HG23 ' N ' ' A' 1012 ' ' SER . 8.1 t -178.76 -65.16 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 171.619 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1012 ' ' SER . . . . . 0.497 ' N ' HG23 ' A' 1011 ' ' THR . 6.9 m -57.65 -73.85 0.07 Allowed 'General case' 0 C--O 1.242 0.676 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -167.857 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1013 ' ' LEU . . . . . 0.762 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 7.8 mp -49.89 -37.1 29.88 Favored 'General case' 0 CA--C 1.504 -0.821 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.226 178.67 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1014 ' ' GLN . . . . . 1.099 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.9 OUTLIER -54.88 -48.73 72.62 Favored 'General case' 0 N--CA 1.443 -0.815 0 O-C-N 123.633 0.583 . . . . 0.0 111.472 -167.088 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A 1015 ' ' GLN . . . . . 0.642 ' O ' ' HB3' ' A' 1019 ' ' LYS . 14.1 pt20 -76.27 -36.83 58.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.967 -176.102 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -74.11 -40.57 62.59 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.765 0.793 . . . . 0.0 110.836 -176.877 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1017 ' ' TYR . . . . . 0.661 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 5.3 m-85 -78.31 -37.92 43.59 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 115.441 -0.799 . . . . 0.0 112.7 -176.706 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1018 ' ' LYS . . . . . 0.612 ' HA ' ' CB ' ' A' 1021 ' ' MET . 35.7 ttpt -81.96 -25.52 34.75 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.733 -175.425 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1019 ' ' LYS . . . . . 0.642 ' HB3' ' O ' ' A' 1015 ' ' GLN . 0.0 OUTLIER -73.33 -32.47 64.59 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 174.883 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A 1020 ' ' GLN . . . . . 0.475 ' N ' ' HD3' ' A' 1019 ' ' LYS . 49.1 mt-30 -68.32 -32.89 73.33 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.652 162.957 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1021 ' ' MET . . . . . 0.612 ' CB ' ' HA ' ' A' 1018 ' ' LYS . 18.2 tmm? -64.9 -53.55 44.83 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 -179.7 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1022 ' ' LEU . . . . . 0.511 HD12 HG22 ' A' ' 937' ' ' ILE . 0.2 OUTLIER -78.15 -11.83 59.95 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 119.248 -0.981 . . . . 0.0 109.821 -173.069 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 63.0 m -86.57 -33.95 20.06 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.761 175.433 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1024 ' ' ALA . . . . . 0.484 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -79.32 -23.58 43.39 Favored 'General case' 0 C--O 1.221 -0.432 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 172.878 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1025 ' ' ALA . . . . . 0.889 ' HB2' HD13 ' A' ' 998' ' ' LEU . . . -86.28 -24.74 25.83 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.619 170.215 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1026 ' ' HIS . . . . . 0.545 ' O ' HG23 ' A' 1030 ' ' VAL . 47.0 t60 -73.37 -28.5 62.07 Favored 'General case' 0 C--O 1.217 -0.644 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 164.287 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1027 ' ' ALA . . . . . 0.484 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -66.19 -40.9 90.76 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 123.586 0.755 . . . . 0.0 110.418 163.419 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1028 ' ' LEU . . . . . 0.766 HD12 HD22 ' A' ' 998' ' ' LEU . 25.4 mt -61.83 -43.72 98.28 Favored 'General case' 0 C--N 1.313 -0.983 0 C-N-CA 119.919 -0.712 . . . . 0.0 109.89 170.985 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -58.29 -40.85 83.03 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.645 0.26 . . . . 0.0 110.884 171.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1030 ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' 1026 ' ' HIS . 4.7 t -67.27 -52.05 46.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 121.111 0.482 . . . . 0.0 110.742 -176.999 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1031 ' ' ASP . . . . . 0.654 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 1.4 m-20 -77.43 -27.85 52.36 Favored 'General case' 0 C--O 1.207 -1.144 0 CA-C-N 115.758 -0.656 . . . . 0.0 112.435 -177.944 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1032 ' ' ALA . . . . . 0.621 ' O ' HD12 ' A' 1036 ' ' LEU . . . -66.76 -32.7 74.16 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 121.769 -0.582 . . . . 0.0 109.438 169.939 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1033 ' ' LYS . . . . . 0.412 ' HB3' ' O ' ' A' 1030 ' ' VAL . 87.7 tttt -68.51 -39.66 81.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.894 0.854 . . . . 0.0 109.523 170.216 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1034 ' ' ASN . . . . . 0.654 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 36.6 t30 -71.21 -52.69 17.65 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 114.787 -1.097 . . . . 0.0 111.444 -177.267 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1035 ' ' LEU . . . . . 1.065 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 3.7 pp -64.14 -42.2 96.88 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 118.911 -0.566 . . . . 0.0 111.671 -171.29 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1036 ' ' LEU . . . . . 0.671 HD13 ' H ' ' A' 1037 ' ' ASP . 0.0 OUTLIER -71.76 -33.05 68.32 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 116.416 -2.114 . . . . 0.0 109.056 -178.573 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A 1037 ' ' ASP . . . . . 0.671 ' H ' HD13 ' A' 1036 ' ' LEU . 22.0 t70 -57.28 -44.93 84.46 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.073 171.034 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1038 ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' 1034 ' ' ASN . 37.4 t -56.15 -38.29 53.32 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.61 0 CA-C-N 114.193 -1.367 . . . . 0.0 111.812 175.705 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1039 ' ' ILE . . . . . 0.69 HD11 ' HA ' ' A' ' 984' ' ' ILE . 1.6 mp -80.61 -32.39 13.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 118.451 0.569 . . . . 0.0 111.814 175.332 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.19 -38.57 89.59 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.55 0.691 . . . . 0.0 109.859 170.526 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -76.11 -33.13 59.46 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.779 173.372 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 1042 ' ' ALA . . . . . 0.55 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -55.89 -55.46 32.36 Favored 'General case' 0 CA--C 1.501 -0.94 0 C-N-CA 123.101 0.56 . . . . 0.0 111.984 178.249 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 1043 ' ' ARG . . . . . 0.71 ' HD3' ' N ' ' A' 1044 ' ' LEU . 0.0 OUTLIER -65.03 -34.61 78.84 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 -176.877 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A 1044 ' ' LEU . . . . . 0.71 ' N ' ' HD3' ' A' 1043 ' ' ARG . 30.8 tp . . . . . 0 N--CA 1.435 -1.176 0 CA-C-N 115.05 -0.977 . . . . 0.0 109.054 177.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.818 0 N-CA-C 112.02 -0.432 . . . . 0.0 112.02 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 909' ' ' SER . . . . . 0.424 ' HA ' ' HD3' ' A' ' 910' ' ' PRO . 9.6 t -103.62 118.49 57.36 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 910' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 909' ' ' SER . 28.0 Cg_endo -90.33 127.79 1.43 Allowed 'Trans proline' 0 N--CA 1.454 -0.851 0 C-N-CA 122.997 2.464 . . . . 0.0 112.421 178.591 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -143.51 24.31 2.17 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.088 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 8.0 tp -70.84 -29.72 38.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.036 0.446 . . . . 0.0 110.866 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 13.2 p -139.99 147.82 41.0 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.61 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 169.46 -71.26 0.14 Allowed Glycine 0 N--CA 1.448 -0.52 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.9 178.37 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 121.37 -153.56 16.66 Favored Glycine 0 N--CA 1.445 -0.734 0 C-N-CA 120.939 -0.648 . . . . 0.0 111.867 -178.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . -86.56 60.87 4.47 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.254 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . 135.01 -148.93 19.76 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.978 -0.629 . . . . 0.0 112.529 178.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . 90.62 -168.9 33.59 Favored Glycine 0 N--CA 1.45 -0.431 0 N-CA-C 111.384 -0.687 . . . . 0.0 111.384 -177.19 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 919' ' ' ILE . . . . . 0.617 ' HB ' ' HB3' ' A' 1040 ' ' ASP . 2.1 pp -95.09 125.98 47.62 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 CA-C-N 117.039 0.42 . . . . 0.0 109.878 175.817 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.688 ' HB3' HD11 ' A' 1044 ' ' LEU . 60.7 ttp180 -158.72 109.64 2.1 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -176.264 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 921' ' ' SER . . . . . 0.404 ' HB3' ' HD2' ' A' 1043 ' ' ARG . 62.5 p -176.16 -50.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.773 167.354 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 56.74 53.92 7.81 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 122.077 0.941 . . . . 0.0 109.012 -174.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.571 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 18.8 t0 -76.51 -174.41 2.9 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 113.879 -1.51 . . . . 0.0 111.438 -172.267 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.791 ' HB2' HG21 ' A' ' 968' ' ' THR . 33.4 mmtp -52.87 -27.92 20.7 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.711 176.021 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.607 ' O ' HG23 ' A' ' 929' ' ' VAL . 16.6 m -55.38 -31.84 28.15 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.396 0 CA-C-O 121.02 0.438 . . . . 0.0 110.528 175.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.571 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -77.79 -32.76 52.6 Favored 'General case' 0 CA--C 1.501 -0.938 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.585 177.175 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -77.53 -23.94 50.04 Favored 'General case' 0 C--N 1.3 -1.558 0 C-N-CA 118.261 -1.376 . . . . 0.0 112.397 178.204 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.516 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 2.7 m120 -72.44 -30.19 64.37 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 121.863 0.839 . . . . 0.0 108.848 171.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.651 ' HA ' HD23 ' A' ' 932' ' ' LEU . 90.2 t -79.51 -28.45 13.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 114.666 -1.152 . . . . 0.0 110.362 176.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.602 ' O ' ' HD2' ' A' ' 934' ' ' LYS . 53.2 m -57.47 -49.26 76.84 Favored 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 119.561 -0.856 . . . . 0.0 108.786 170.162 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -64.11 -51.4 53.33 Favored Glycine 0 CA--C 1.525 0.707 0 CA-C-N 115.355 -0.838 . . . . 0.0 113.459 177.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.651 HD23 ' HA ' ' A' ' 929' ' ' VAL . 0.3 OUTLIER -61.91 -49.02 77.85 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 112.751 0.648 . . . . 0.0 112.751 -175.882 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.47 HG23 HG13 ' A' ' 929' ' ' VAL . 53.0 t -70.17 -38.27 74.26 Favored 'Isoleucine or valine' 0 C--O 1.24 0.576 0 CA-C-O 120.947 0.403 . . . . 0.0 111.446 -174.162 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.602 ' HD2' ' O ' ' A' ' 930' ' ' THR . 0.2 OUTLIER -58.92 -37.15 76.01 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.492 179.208 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 0.491 ' HA ' ' SD ' ' A' ' 939' ' ' MET . . . -64.03 -42.01 97.22 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.607 -0.269 . . . . 0.0 111.066 177.483 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.77 HG22 ' HB1' ' A' 1025 ' ' ALA . 99.3 t -47.55 -69.79 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.065 -178.148 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 26.7 pt -71.95 -39.76 67.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 N-CA-C 112.489 0.551 . . . . 0.0 112.489 -176.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.412 ' O ' ' HG3' ' A' ' 942' ' ' LYS . 41.3 mt-10 -72.52 -52.19 16.76 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 119.722 -0.791 . . . . 0.0 111.37 -173.039 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.529 ' HA ' ' HD2' ' A' ' 942' ' ' LYS . 1.0 OUTLIER -68.59 -24.78 64.63 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.252 -0.579 . . . . 0.0 109.57 -179.065 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.743 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 8.7 p -53.9 -39.47 65.81 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.206 -179.079 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 11.9 m -94.97 -8.76 36.01 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.753 -179.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.529 ' HD2' ' HA ' ' A' ' 939' ' ' MET . 55.0 mttm -81.24 -13.59 58.35 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 175.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.772 HG21 ' HE1' ' A' ' 951' ' ' TYR . 2.0 pp -78.7 -2.59 5.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.117 169.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.737 ' HB3' ' HD3' ' A' ' 945' ' ' PRO . 63.1 tt0 -75.94 -53.74 2.29 Favored Pre-proline 0 CA--C 1.54 0.576 0 O-C-N 122.302 -0.249 . . . . 0.0 111.173 178.498 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.737 ' HD3' ' HB3' ' A' ' 944' ' ' GLN . 36.5 Cg_exo -62.12 -47.61 9.94 Favored 'Trans proline' 0 C--N 1.358 1.07 0 C-N-CA 121.896 1.73 . . . . 0.0 111.571 174.405 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 946' ' ' ALA . . . . . . . . . . . . . . . -109.38 99.07 35.09 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 176.13 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.796 ' HB2' ' HD3' ' A' ' 948' ' ' PRO . 54.0 Cg_exo -49.68 -61.49 0.56 Allowed 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 122.932 2.421 . . . . 0.0 113.718 -172.525 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.817 ' HB3' HG11 ' A' 1009 ' ' VAL . 5.6 Cg_endo -88.19 100.56 0.43 Allowed 'Trans proline' 0 N--CA 1.442 -1.547 0 C-N-CA 121.207 1.271 . . . . 0.0 112.298 178.418 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.709 ' HB2' HG22 ' A' ' 943' ' ' ILE . 55.4 tt0 -67.94 -13.53 62.24 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 114.471 -1.241 . . . . 0.0 108.699 168.275 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.516 ' HB2' ' O ' ' A' ' 949' ' ' GLU . 47.2 mt-10 72.2 -9.29 1.03 Allowed 'General case' 0 C--N 1.349 0.544 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.567 -165.431 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.989 ' HB3' ' HG2' ' A' 1002 ' ' MET . 22.4 m-85 52.18 -46.78 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.899 1.679 . . . . 0.0 114.774 178.327 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 0.604 ' O ' ' HB ' ' A' ' 955' ' ' VAL . 45.8 t -50.57 -43.13 79.9 Favored Pre-proline 0 C--N 1.322 -0.63 0 C-N-CA 122.861 0.464 . . . . 0.0 111.703 173.43 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 0.634 ' O ' ' HB3' ' A' ' 956' ' ' LYS . 24.3 Cg_exo -49.31 -43.05 39.14 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 122.022 1.815 . . . . 0.0 112.831 172.162 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.421 ' O ' HG12 ' A' ' 958' ' ' VAL . 21.2 ttt -76.26 -31.09 58.11 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.566 176.287 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.604 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 78.9 t -52.96 -35.77 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 167.741 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.634 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 11.1 tmtt? -66.58 -36.43 82.61 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.119 172.776 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -76.93 -47.0 22.24 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.908 0.385 . . . . 0.0 111.554 -174.546 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.619 HG22 HD23 ' A' ' 962' ' ' LEU . 14.1 p -85.4 -33.51 7.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.063 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -60.44 -43.11 99.09 Favored Glycine 0 N--CA 1.447 -0.59 0 N-CA-C 110.8 -0.92 . . . . 0.0 110.8 176.063 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 960' ' ' LEU . . . . . 0.419 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 14.7 tp -63.57 -36.76 84.87 Favored 'General case' 0 C--O 1.22 -0.468 0 C-N-CA 122.235 0.214 . . . . 0.0 110.716 176.385 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -75.72 -38.12 58.83 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.266 0.555 . . . . 0.0 111.046 -174.454 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.881 HD21 HD13 ' A' ' 995' ' ' LEU . 4.3 pp -87.37 -20.26 26.96 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.613 -178.203 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.419 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 15.3 ptm180 -77.01 -35.93 56.67 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 119.574 -0.85 . . . . 0.0 110.668 165.71 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 85.8 m -61.5 -36.02 79.34 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 173.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.516 ' HA ' ' OD1' ' A' ' 928' ' ' ASN . 18.5 tp -61.77 -47.85 83.34 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.293 -1.321 . . . . 0.0 110.207 173.675 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 0.768 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.4 tt -66.04 -37.85 86.89 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.191 -173.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -71.91 -31.15 66.1 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.901 178.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.791 HG21 ' HB2' ' A' ' 924' ' ' LYS . 23.5 m -71.22 -36.91 72.03 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 119.668 -0.813 . . . . 0.0 109.553 173.371 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.843 HG12 HG23 ' A' ' 984' ' ' ILE . 61.7 t -68.47 -39.78 81.19 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.338 172.458 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.51 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 10.3 t70 -67.23 -40.23 86.34 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.85 0.833 . . . . 0.0 108.758 -178.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.655 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 8.1 tp10 -68.28 -29.47 68.26 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 114.561 -1.2 . . . . 0.0 109.726 177.776 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.686 ' HA ' HG22 ' A' ' 975' ' ' VAL . 70.8 m -69.52 -17.91 63.62 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.879 175.65 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.899 ' HB2' HG21 ' A' ' 984' ' ' ILE . 10.5 tt -68.81 -52.78 16.81 Favored Pre-proline 0 N--CA 1.449 -0.493 0 C-N-CA 120.973 -0.291 . . . . 0.0 110.324 -177.675 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.655 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 90.4 Cg_endo -90.91 0.75 4.94 Favored 'Trans proline' 0 C--N 1.357 0.991 0 C-N-CA 121.357 1.371 . . . . 0.0 114.72 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.686 HG22 ' HA ' ' A' ' 972' ' ' SER . 27.4 m -84.94 -26.52 6.73 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 O-C-N 121.427 -0.795 . . . . 0.0 111.298 172.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.578 ' HG ' ' HD2' ' A' ' 977' ' ' PRO . 1.1 tp -108.17 160.02 28.52 Favored Pre-proline 0 C--N 1.327 -0.384 0 C-N-CA 120.664 -0.414 . . . . 0.0 111.303 178.343 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 0.578 ' HD2' ' HG ' ' A' ' 976' ' ' LEU . 72.9 Cg_exo -53.13 167.08 0.8 Allowed 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 123.619 2.879 . . . . 0.0 113.703 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -53.43 -32.7 50.96 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.032 -0.986 . . . . 0.0 113.436 -170.27 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.733 ' HB2' ' SD ' ' A' 1046 ' ' MET . 5.1 p -60.0 -53.12 61.52 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.818 HG23 ' HB1' ' A' 1042 ' ' ALA . 25.8 m -59.79 -21.75 61.25 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 122.488 0.315 . . . . 0.0 111.816 -176.49 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.518 ' O ' ' HG2' ' A' ' 985' ' ' GLU . 1.7 m80 -50.56 -40.54 52.39 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -177.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 982' ' ' ARG . . . . . 0.467 ' HA ' ' CG ' ' A' ' 985' ' ' GLU . 11.1 ptt180 -83.52 -18.75 37.37 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 -171.227 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.454 ' HG3' HG13 ' A' 1038 ' ' VAL . 0.4 OUTLIER -74.3 -34.6 63.57 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 171.7 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.899 HG21 ' HB2' ' A' ' 973' ' ' LEU . 1.8 mp -70.99 -32.75 49.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 176.058 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 985' ' ' GLU . . . . . 0.518 ' HG2' ' O ' ' A' ' 981' ' ' HIS . 64.5 mm-40 -57.6 -54.19 49.63 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.325 174.76 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 48.0 ttm -68.47 -45.59 72.03 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.246 -172.159 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.681 ' HB1' ' HB3' ' A' 1035 ' ' LEU . . . -68.69 -52.2 33.54 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.299 -0.864 . . . . 0.0 112.737 -171.834 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.768 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 25.5 pt20 -65.13 -26.98 68.42 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 119.759 -0.776 . . . . 0.0 111.446 -177.156 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 989' ' ' LYS . . . . . 0.821 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 54.9 mtpt -75.15 -42.31 56.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.282 0.563 . . . . 0.0 111.697 175.479 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.546 HD23 HD11 ' A' 1035 ' ' LEU . 39.3 tp -54.0 -58.19 8.25 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -178.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.881 HD11 ' HA ' ' A' 1028 ' ' LEU . 11.4 tp -68.3 -23.12 64.7 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 120.336 -0.545 . . . . 0.0 110.169 179.496 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 992' ' ' ASN . . . . . 0.821 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 25.2 t-20 -51.77 -54.13 32.05 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.82 174.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 6.8 p -76.49 -26.1 54.95 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.355 177.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -64.19 -52.46 58.79 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.323 0.582 . . . . 0.0 110.198 177.173 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 0.881 HD13 HD21 ' A' ' 962' ' ' LEU . 0.3 OUTLIER -51.95 -28.36 16.34 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.704 168.598 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -70.29 -35.77 73.93 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 118.789 -1.164 . . . . 0.0 111.291 176.416 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.546 ' O ' ' HD3' ' A' 1001 ' ' LYS . 3.9 pt-20 -78.06 -29.51 49.25 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 121.134 -0.979 . . . . 0.0 110.912 175.863 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.842 HD22 HD11 ' A' 1028 ' ' LEU . 0.1 OUTLIER -56.15 -47.08 78.91 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 121.296 0.569 . . . . 0.0 110.062 178.513 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.502 ' O ' ' HB2' ' A' 1003 ' ' LYS . 75.2 mt -70.66 -32.99 51.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 114.927 -1.033 . . . . 0.0 111.522 -174.552 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -65.46 -41.29 93.55 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.995 0.426 . . . . 0.0 111.879 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.546 ' HD3' ' O ' ' A' ' 997' ' ' GLU . 0.6 OUTLIER -78.39 -34.56 48.09 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 122.332 1.063 . . . . 0.0 108.742 -178.964 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.989 ' HG2' ' HB3' ' A' ' 951' ' ' TYR . 12.5 ttt -62.57 -27.74 69.39 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 113.977 -1.465 . . . . 0.0 109.046 176.256 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.502 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 2.6 tptp -74.84 -53.05 9.81 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 113.753 -1.567 . . . . 0.0 110.623 -167.869 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.561 ' HA ' ' HG2' ' A' 1007 ' ' GLN . 7.4 mp -75.15 -12.32 60.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.87 -179.024 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.754 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -70.28 -50.03 43.67 Favored 'General case' 0 C--O 1.216 -0.698 0 C-N-CA 119.364 -0.934 . . . . 0.0 109.747 177.316 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.927 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.3 pp0? -71.71 -30.64 65.87 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 174.852 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.561 ' HG2' ' HA ' ' A' 1004 ' ' LEU . 4.7 pt20 -57.87 -48.15 80.65 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 119.989 -0.684 . . . . 0.0 109.703 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.663 ' HB2' HD12 ' A' 1013 ' ' LEU . 14.0 m-30 -115.22 42.01 2.32 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 173.564 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1009 ' ' VAL . . . . . 1.033 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 12.4 p -54.0 -24.56 11.14 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.301 0 CA-C-O 122.319 1.057 . . . . 0.0 109.743 173.259 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 49.3 mtt -55.96 -20.72 17.39 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 113.687 -1.597 . . . . 0.0 111.529 174.294 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1011 ' ' THR . . . . . 0.542 ' HB ' ' H ' ' A' 1012 ' ' SER . 16.9 p -142.87 -153.08 0.44 Allowed 'General case' 0 C--O 1.262 1.713 0 CA-C-O 123.596 1.665 . . . . 0.0 115.276 -172.068 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1012 ' ' SER . . . . . 0.542 ' H ' ' HB ' ' A' 1011 ' ' THR . 26.2 p -55.04 -37.99 67.4 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 113.048 -1.887 . . . . 0.0 112.743 -173.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.74 ' O ' ' HB2' ' A' 1017 ' ' TYR . 6.6 mt -52.9 -40.32 63.44 Favored 'General case' 0 CA--C 1.494 -1.185 0 C-N-CA 120.196 -0.602 . . . . 0.0 110.507 178.14 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1014 ' ' GLN . . . . . 1.033 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 1.3 tt0 -54.09 -53.7 49.56 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-O 121.699 0.761 . . . . 0.0 109.398 -173.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1015 ' ' GLN . . . . . 0.508 ' O ' ' HD3' ' A' 1019 ' ' LYS . 0.9 OUTLIER -72.61 -41.14 65.89 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 114.587 -1.188 . . . . 0.0 112.231 -177.273 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -70.64 -55.47 8.69 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 122.818 0.447 . . . . 0.0 112.041 -178.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.754 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 7.3 m-85 -62.11 -33.33 74.25 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -177.205 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.631 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 54.3 tptt -78.93 -27.8 43.74 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.492 -177.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1019 ' ' LYS . . . . . 0.508 ' HD3' ' O ' ' A' 1015 ' ' GLN . 4.3 mptp? -71.68 -50.23 32.33 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 172.183 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1020 ' ' GLN . . . . . 0.409 ' HB3' ' HG2' ' A' 1001 ' ' LYS . 51.3 mt-30 -52.23 -31.41 32.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.83 165.241 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.568 ' HG3' ' CB ' ' A' 1002 ' ' MET . 2.3 ttp -67.81 -49.23 63.45 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 178.252 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1022 ' ' LEU . . . . . 0.769 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -81.92 -8.58 59.69 Favored 'General case' 0 C--O 1.218 -0.586 0 C-N-CA 118.987 -1.085 . . . . 0.0 109.41 -177.16 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 52.4 m -76.8 -45.74 27.64 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.718 171.242 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.56 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -74.85 -21.46 59.25 Favored 'General case' 0 C--O 1.213 -0.845 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 173.459 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.77 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -84.56 -25.94 28.34 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.223 172.428 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.466 ' O ' HG23 ' A' 1030 ' ' VAL . 42.4 t-80 -78.32 -22.71 47.69 Favored 'General case' 0 C--O 1.214 -0.793 0 O-C-N 121.845 -0.534 . . . . 0.0 109.641 167.257 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -69.84 -42.55 73.45 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 123.421 0.688 . . . . 0.0 109.82 162.372 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.881 ' HA ' HD11 ' A' ' 991' ' ' LEU . 49.7 mt -56.12 -50.05 72.17 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 168.871 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1029 ' ' ALA . . . . . 0.441 ' HA ' HG22 ' A' ' 933' ' ' VAL . . . -59.6 -43.48 93.7 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 175.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' 1026 ' ' HIS . 3.7 t -66.98 -50.82 60.92 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.305 0 CA-C-O 121.019 0.438 . . . . 0.0 110.564 -176.407 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.617 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 4.0 m-20 -76.36 -29.1 57.06 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.83 -178.576 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.531 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -67.22 -27.43 67.23 Favored 'General case' 0 C--N 1.321 -0.645 0 O-C-N 121.426 -0.796 . . . . 0.0 109.749 172.344 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.457 ' C ' ' HD3' ' A' 1033 ' ' LYS . 12.7 tmtt? -70.36 -51.86 26.76 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 167.735 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.617 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 36.1 t30 -63.37 -56.66 14.55 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 114.838 -1.074 . . . . 0.0 112.569 -174.669 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.681 ' HB3' ' HB1' ' A' ' 987' ' ' ALA . 0.2 OUTLIER -60.24 -35.85 76.41 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.775 -0.193 . . . . 0.0 110.578 -179.865 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.538 ' C ' HD23 ' A' 1036 ' ' LEU . 0.8 OUTLIER -67.57 -47.27 70.27 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 118.987 -1.085 . . . . 0.0 108.712 179.122 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.5 ' O ' ' HB2' ' A' 1041 ' ' GLN . 13.4 t70 -51.32 -28.35 11.99 Favored 'General case' 0 C--O 1.215 -0.729 0 CA-C-N 113.873 -1.512 . . . . 0.0 109.977 172.258 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.557 ' HB ' ' O ' ' A' 1035 ' ' LEU . 30.1 t -75.19 -29.95 22.36 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.536 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.778 178.404 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.545 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 1.8 mp -85.78 -34.75 8.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 CA-C-N 118.221 0.464 . . . . 0.0 111.577 172.094 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.617 ' HB3' ' HB ' ' A' ' 919' ' ' ILE . 0.9 OUTLIER -59.65 -42.86 93.75 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 167.221 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.5 ' HB2' ' O ' ' A' 1037 ' ' ASP . 1.7 mt-30 -58.53 -54.09 51.02 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.894 168.566 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.818 ' HB1' HG23 ' A' ' 980' ' ' THR . . . -53.19 -47.12 69.14 Favored 'General case' 0 CA--C 1.499 -1.017 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.735 -170.501 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.589 ' O ' HG12 ' A' 1047 ' ' ILE . 13.8 ptp180 -67.56 -46.69 71.96 Favored 'General case' 0 N--CA 1.432 -1.364 0 C-N-CA 119.91 -0.716 . . . . 0.0 110.668 -172.478 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.688 HD11 ' HB3' ' A' ' 920' ' ' ARG . 36.5 mt -80.49 -32.93 36.88 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 120.233 -0.587 . . . . 0.0 112.069 -178.646 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1045 ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -68.22 -34.51 76.37 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 122.652 0.381 . . . . 0.0 111.056 -179.591 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.733 ' SD ' ' HB2' ' A' ' 979' ' ' SER . 24.1 mmt -73.83 -28.62 61.7 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.758 0.313 . . . . 0.0 110.755 176.215 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.589 HG12 ' O ' ' A' 1043 ' ' ARG . 49.0 mm -75.66 -33.71 27.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 121.23 0.538 . . . . 0.0 110.274 172.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 47.1 m -78.25 -11.43 59.93 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.832 178.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -84.97 151.58 24.11 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.068 -176.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 48.3 t -109.42 -37.94 5.6 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.688 -176.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1051 ' ' ARG . . . . . 0.601 ' CB ' ' HD3' ' A' 1052 ' ' PRO . 0.6 OUTLIER -76.48 -69.37 0.24 Allowed Pre-proline 0 CA--C 1.535 0.39 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.513 -173.75 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A 1052 ' ' PRO . . . . . 0.601 ' HD3' ' CB ' ' A' 1051 ' ' ARG . 66.0 Cg_endo -98.02 129.18 0.25 Allowed 'Trans proline' 0 N--CA 1.447 -1.243 0 C-N-CA 121.685 1.59 . . . . 0.0 112.377 178.425 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 55.4 t-80 . . . . . 0 C--N 1.324 -0.542 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.009 178.863 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.755 0 N-CA-C 111.987 -0.445 . . . . 0.0 111.987 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 909' ' ' SER . . . . . 0.464 ' HA ' ' HD3' ' A' ' 910' ' ' PRO . 27.5 t -126.95 137.03 29.73 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 179.15 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 910' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 909' ' ' SER . 12.6 Cg_exo -71.73 -2.42 11.39 Favored 'Trans proline' 0 CA--C 1.531 0.355 0 C-N-CA 123.18 2.586 . . . . 0.0 113.046 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -86.73 61.82 4.32 Favored Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 120.795 -0.716 . . . . 0.0 111.89 179.082 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 36.0 pt -102.23 -12.55 8.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 -176.249 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 8.8 p -130.19 -43.79 1.17 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.016 0.436 . . . . 0.0 111.1 -177.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . -174.73 -115.63 0.41 Allowed Glycine 0 N--CA 1.445 -0.716 0 N-CA-C 111.274 -0.73 . . . . 0.0 111.274 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 143.23 94.4 0.2 Allowed Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.434 178.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . -130.85 48.43 0.97 Allowed Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.363 -0.695 . . . . 0.0 111.363 177.472 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . 115.81 74.45 0.56 Allowed Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 110.76 -0.936 . . . . 0.0 110.76 -175.424 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -65.52 -17.65 64.71 Favored Glycine 0 N--CA 1.454 -0.133 0 C-N-CA 121.435 -0.412 . . . . 0.0 113.739 -174.127 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 919' ' ' ILE . . . . . 0.931 HG13 ' HG3' ' A' ' 920' ' ' ARG . 0.0 OUTLIER -77.58 137.98 21.27 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.226 0 CA-C-O 122.212 1.006 . . . . 0.0 111.4 179.436 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.931 ' HG3' HG13 ' A' ' 919' ' ' ILE . 58.4 mtt180 79.65 86.44 0.06 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 112.676 -2.056 . . . . 0.0 111.992 174.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 60.6 p -153.73 -12.45 0.14 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.779 -1.101 . . . . 0.0 111.222 173.413 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -94.93 -59.68 1.85 Allowed 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.272 -179.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.77 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 28.7 m-20 73.36 -10.53 1.02 Allowed 'General case' 0 C--O 1.213 -0.817 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 169.102 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.704 ' HG3' HG21 ' A' ' 968' ' ' THR . 17.9 tppt? -57.25 -33.68 67.84 Favored 'General case' 0 C--N 1.315 -0.898 0 O-C-N 120.937 -1.102 . . . . 0.0 111.927 -172.563 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.62 ' O ' HG23 ' A' ' 929' ' ' VAL . 12.3 t -65.7 -28.22 43.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.191 0.52 . . . . 0.0 110.691 177.374 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.77 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -75.94 -26.42 56.87 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.398 0.679 . . . . 0.0 111.66 -177.514 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 927' ' ' GLU . . . . . 0.515 ' O ' HG22 ' A' ' 930' ' ' THR . 7.8 pt-20 -76.74 -24.13 53.01 Favored 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 118.743 -1.183 . . . . 0.0 109.853 172.65 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.47 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 1.7 m120 -71.33 -30.72 66.54 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 170.304 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.62 HG23 ' O ' ' A' ' 925' ' ' VAL . 68.6 t -80.88 -30.53 11.88 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-N 114.811 -1.086 . . . . 0.0 111.68 177.742 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.515 HG22 ' O ' ' A' ' 927' ' ' GLU . 3.6 t -66.29 -30.8 71.3 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 120.222 1.374 . . . . 0.0 107.759 170.733 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -72.53 -52.73 9.6 Favored Glycine 0 CA--C 1.526 0.727 0 CA-C-N 115.35 -0.841 . . . . 0.0 113.239 175.655 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.547 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.1 pp -66.99 -49.35 65.64 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -177.372 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.576 HG22 ' HA ' ' A' 1029 ' ' ALA . 79.0 t -68.42 -37.18 77.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-O 121.038 0.446 . . . . 0.0 111.151 -174.267 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.43 ' O ' ' HB2' ' A' ' 938' ' ' GLU . 30.2 ttpt -58.26 -46.31 86.24 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.159 179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -56.17 -36.68 68.61 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.671 176.442 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.792 HG22 ' HB1' ' A' 1025 ' ' ALA . 85.0 t -52.85 -75.45 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-O 121.12 0.486 . . . . 0.0 112.086 -178.775 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 30.7 pt -68.01 -41.68 84.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.328 -176.168 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.43 ' HB2' ' O ' ' A' ' 934' ' ' LYS . 9.2 mm-40 -64.49 -49.63 70.6 Favored 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.908 -174.201 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.567 ' HB3' ' OE1' ' A' ' 949' ' ' GLU . 25.0 mmt -74.53 -24.94 59.03 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.336 -179.503 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.59 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 24.8 p -52.87 -38.64 61.85 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.384 0.611 . . . . 0.0 111.078 -174.094 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 44.6 m -107.34 -18.09 13.96 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 114.932 -1.031 . . . . 0.0 112.453 -176.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 942' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -82.81 -7.68 59.64 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 119.554 -0.858 . . . . 0.0 110.292 -177.503 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.815 HD13 ' HG2' ' A' 1018 ' ' LYS . 41.0 pt -62.37 -26.49 40.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.331 165.759 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.671 ' HB3' ' HD3' ' A' ' 945' ' ' PRO . 6.5 tp-100 -65.2 -57.72 14.49 Favored Pre-proline 0 CA--C 1.54 0.561 0 N-CA-C 112.378 0.511 . . . . 0.0 112.378 -172.251 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.671 ' HD3' ' HB3' ' A' ' 944' ' ' GLN . 85.1 Cg_endo -85.17 16.26 2.02 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 121.882 1.721 . . . . 0.0 113.179 -178.493 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.586 ' HB1' ' HD2' ' A' ' 947' ' ' PRO . . . -135.58 170.17 11.79 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 116.614 -0.267 . . . . 0.0 110.546 -176.171 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.586 ' HD2' ' HB1' ' A' ' 946' ' ' ALA . 38.1 Cg_endo -67.99 170.0 15.24 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.099 1.866 . . . . 0.0 111.1 171.72 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.501 ' HA ' HG21 ' A' 1009 ' ' VAL . 4.3 Cg_exo -41.72 133.66 3.81 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.414 2.743 . . . . 0.0 112.957 -179.592 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.641 ' HB2' HG22 ' A' ' 943' ' ' ILE . 26.8 tt0 -59.64 -22.9 62.52 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.063 176.505 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.817 ' HB3' ' HG2' ' A' ' 953' ' ' PRO . 12.5 mm-40 55.22 66.64 1.17 Allowed 'General case' 0 N--CA 1.438 -1.033 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 -165.14 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.787 ' HB3' ' HB2' ' A' 1002 ' ' MET . 35.3 m-85 -53.58 -31.22 45.93 Favored 'General case' 0 C--O 1.21 -0.974 0 CA-C-N 113.545 -1.661 . . . . 0.0 111.912 179.25 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 0.657 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.1 OUTLIER -63.07 -52.88 59.55 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.859 174.097 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 0.817 ' HG2' ' HB3' ' A' ' 950' ' ' GLU . 0.5 OUTLIER -46.26 -43.68 20.93 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 121.936 1.757 . . . . 0.0 113.309 161.322 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.734 ' HB3' ' HA ' ' A' ' 951' ' ' TYR . 27.3 tpp -60.83 -33.49 73.12 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.794 0.33 . . . . 0.0 110.859 176.261 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.628 HG23 ' HA ' ' A' ' 952' ' ' VAL . 60.0 t -51.84 -40.1 26.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.249 -0.432 . . . . 0.0 109.946 172.6 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.599 ' HD3' ' HA ' ' A' ' 953' ' ' PRO . 3.2 mptp? -66.59 -36.73 83.33 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.735 0.302 . . . . 0.0 110.862 175.688 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -79.85 -45.45 18.66 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.186 -0.461 . . . . 0.0 112.125 -172.284 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.428 HG12 ' O ' ' A' ' 954' ' ' MET . 11.8 p -84.26 -26.34 7.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -65.02 -30.77 78.86 Favored Glycine 0 N--CA 1.442 -0.944 0 N-CA-C 110.03 -1.228 . . . . 0.0 110.03 169.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 960' ' ' LEU . . . . . 0.614 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 19.5 tp -71.08 -38.59 72.43 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.305 -0.448 . . . . 0.0 110.097 176.029 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.535 ' HB1' ' HB3' ' A' ' 932' ' ' LEU . . . -72.46 -39.7 67.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.905 0.383 . . . . 0.0 111.109 -174.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.454 HD22 HD22 ' A' ' 995' ' ' LEU . 0.0 OUTLIER -70.18 -40.53 74.61 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-O 119.095 -0.478 . . . . 0.0 110.873 173.346 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.614 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 4.6 ptp180 -67.03 -31.38 71.86 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 118.735 -1.186 . . . . 0.0 110.306 178.391 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 964' ' ' THR . . . . . 0.496 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 40.5 m -68.62 -40.96 80.13 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.127 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.624 HD22 HD11 ' A' ' 991' ' ' LEU . 0.1 OUTLIER -63.76 -39.58 94.63 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 114.062 -1.426 . . . . 0.0 110.92 175.535 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 0.618 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.2 tt -76.17 -35.08 59.32 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 -172.716 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 967' ' ' ALA . . . . . 0.413 ' O ' ' HB2' ' A' ' 971' ' ' GLU . . . -72.08 -31.07 65.74 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.393 178.557 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.704 HG21 ' HG3' ' A' ' 924' ' ' LYS . 13.6 p -70.6 -41.58 72.12 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 118.347 0.521 . . . . 0.0 110.301 174.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 1.026 HG12 HG23 ' A' ' 984' ' ' ILE . 61.2 t -68.52 -38.19 78.82 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.991 172.494 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.58 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 16.5 t70 -68.06 -39.54 82.97 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.965 0.888 . . . . 0.0 108.88 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.625 ' O ' HG23 ' A' ' 975' ' ' VAL . 37.5 tt0 -65.74 -32.92 74.73 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.272 -1.331 . . . . 0.0 109.672 177.685 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.444 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 71.9 m -66.97 -17.81 65.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.979 175.377 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.752 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 8.5 tt -68.57 -52.39 19.64 Favored Pre-proline 0 CA--C 1.534 0.33 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 -178.314 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.752 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 5.7 Cg_exo -81.89 0.62 9.74 Favored 'Trans proline' 0 C--N 1.354 0.857 0 C-N-CA 121.478 1.452 . . . . 0.0 112.908 173.033 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.625 HG23 ' O ' ' A' ' 971' ' ' GLU . 17.5 t -73.44 -52.09 22.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 170.85 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 976' ' ' LEU . . . . . . . . . . . . . 32.1 tp -134.12 95.37 16.9 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-O 120.993 0.425 . . . . 0.0 110.38 178.013 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_exo -72.98 -173.72 1.32 Allowed 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 123.329 2.686 . . . . 0.0 112.067 178.487 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . 70.28 103.99 0.06 Allowed 'General case' 0 N--CA 1.463 0.19 0 O-C-N 123.761 0.663 . . . . 0.0 111.035 -178.305 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.677 ' O ' ' HG2' ' A' ' 982' ' ' ARG . 44.4 m 69.17 -59.7 0.47 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.246 -0.888 . . . . 0.0 113.334 178.499 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.42 ' OG1' ' HG2' ' A' 1046 ' ' MET . 1.9 m -52.75 -29.25 26.06 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 -171.21 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.712 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 19.2 p80 -50.2 -32.04 15.38 Favored 'General case' 0 C--O 1.214 -0.782 0 C-N-CA 121.135 -0.226 . . . . 0.0 111.54 174.39 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 982' ' ' ARG . . . . . 0.677 ' HG2' ' O ' ' A' ' 979' ' ' SER . 9.4 ptm180 -82.81 -20.51 35.58 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 121.147 -0.221 . . . . 0.0 111.069 -173.683 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 983' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.01 -34.47 57.41 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 169.696 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 1.026 HG23 HG12 ' A' ' 969' ' ' VAL . 69.0 mt -70.05 -32.82 52.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 114.913 -1.039 . . . . 0.0 109.441 177.339 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 985' ' ' GLU . . . . . 0.712 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 42.0 mt-10 -66.01 -51.62 56.68 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.312 177.477 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 18.2 mmt -71.58 -41.73 68.64 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.909 -172.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.999 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -75.56 -51.54 12.67 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.357 -0.838 . . . . 0.0 113.25 -171.685 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.71 ' O ' ' HB2' ' A' ' 992' ' ' ASN . 18.2 pt20 -62.42 -28.35 69.73 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 119.649 -0.82 . . . . 0.0 109.703 179.046 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 989' ' ' LYS . . . . . 0.71 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 21.0 tttm -69.48 -40.82 76.84 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.323 -0.853 . . . . 0.0 112.204 170.639 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.451 ' HB3' ' O ' ' A' ' 987' ' ' ALA . 17.2 tp -50.5 -60.36 3.09 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.47 -0.786 . . . . 0.0 113.032 -176.438 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.734 HD22 HD13 ' A' 1035 ' ' LEU . 1.5 pt? -76.55 -20.42 56.88 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-O 121.508 0.671 . . . . 0.0 109.826 -178.305 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 992' ' ' ASN . . . . . 0.71 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 50.3 t-20 -50.9 -53.97 28.07 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 114.424 -1.262 . . . . 0.0 110.876 175.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 3.7 m -73.75 -34.75 64.86 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 120.792 -0.363 . . . . 0.0 111.741 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 994' ' ' ASP . . . . . 0.412 ' O ' ' HB2' ' A' ' 997' ' ' GLU . 0.3 OUTLIER -66.91 -32.93 74.51 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 119.829 -0.748 . . . . 0.0 111.904 178.272 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 0.622 ' N ' HD21 ' A' 1028 ' ' LEU . 3.3 tt -69.6 -20.89 63.62 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 122.222 0.209 . . . . 0.0 110.697 170.746 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -75.76 -26.33 57.31 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 119.671 -0.811 . . . . 0.0 109.665 170.349 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.606 ' O ' ' HG2' ' A' 1001 ' ' LYS . 56.0 mm-40 -71.33 -46.23 61.09 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 171.43 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.76 HD22 HD11 ' A' 1028 ' ' LEU . 0.0 OUTLIER -55.38 -45.76 76.57 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.713 -177.404 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.585 ' HA ' ' HG2' ' A' 1002 ' ' MET . 85.6 mt -65.08 -37.74 80.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.356 -175.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 26.6 m-80 -61.33 -40.32 93.8 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.176 0.512 . . . . 0.0 111.457 177.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.606 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 51.1 mmtt -76.38 -45.23 32.76 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.942 0.877 . . . . 0.0 108.998 -171.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.787 ' HB2' ' HB3' ' A' ' 951' ' ' TYR . 14.5 ptp -62.25 -30.5 71.16 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.88 -1.054 . . . . 0.0 109.026 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.564 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 6.0 tptm -64.55 -53.02 54.41 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.35 -167.376 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.724 ' HB3' HD13 ' A' 1013 ' ' LEU . 7.2 mp -75.34 -13.82 60.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.876 -178.625 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.654 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -67.95 -43.7 78.48 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.099 -178.761 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.938 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 5.4 pp0? -77.13 -23.82 51.71 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.349 -0.541 . . . . 0.0 111.485 174.373 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1007 ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -52.89 -47.72 67.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.361 0.601 . . . . 0.0 110.638 174.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.639 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 74.6 m-85 -121.5 38.72 4.02 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.988 174.519 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1009 ' ' VAL . . . . . 1.06 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 11.9 p -48.61 -23.07 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.665 173.384 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 1.4 mpt? -37.38 -49.92 1.02 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.108 0.88 . . . . 0.0 111.328 173.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 71.4 m -163.56 -77.95 0.04 OUTLIER 'General case' 0 C--O 1.243 0.744 0 CA-C-O 121.125 0.488 . . . . 0.0 111.92 175.336 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1012 ' ' SER . . . . . 0.474 ' O ' ' HG2' ' A' 1015 ' ' GLN . 6.3 m -50.55 -76.43 0.02 OUTLIER 'General case' 0 C--O 1.241 0.624 0 CA-C-N 115.278 -0.874 . . . . 0.0 113.297 -166.67 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.724 HD13 ' HB3' ' A' 1004 ' ' LEU . 2.8 mt -46.91 -42.57 17.84 Favored 'General case' 0 CA--C 1.501 -0.917 0 N-CA-C 113.569 0.951 . . . . 0.0 113.569 -178.553 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1014 ' ' GLN . . . . . 1.06 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.7 OUTLIER -55.68 -43.85 76.78 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.905 -166.907 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A 1015 ' ' GLN . . . . . 0.474 ' HG2' ' O ' ' A' 1012 ' ' SER . 24.3 pt20 -75.73 -40.79 54.99 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.814 -175.226 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -69.97 -53.63 16.93 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.487 0.66 . . . . 0.0 110.54 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.682 ' CE2' HD22 ' A' 1013 ' ' LEU . 7.8 m-85 -63.86 -35.77 81.73 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.865 -1.061 . . . . 0.0 113.263 -173.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.815 ' HG2' HD13 ' A' ' 943' ' ' ILE . 21.4 tptm -80.63 -28.0 37.08 Favored 'General case' 0 N--CA 1.458 -0.066 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.292 -177.424 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1019 ' ' LYS . . . . . 0.416 ' O ' HD23 ' A' 1022 ' ' LEU . 11.9 mptt -73.38 -51.55 16.95 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 175.585 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -50.79 -34.99 29.7 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.265 163.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.644 ' HE2' HD11 ' A' ' 998' ' ' LEU . 1.7 tmt? -65.34 -50.72 64.53 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 110.28 -0.266 . . . . 0.0 110.28 175.551 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1022 ' ' LEU . . . . . 0.739 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -77.5 -6.58 54.09 Favored 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 119.328 -0.949 . . . . 0.0 109.788 -175.712 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 86.5 m -80.05 -44.44 20.08 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 173.316 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.49 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.29 -20.76 50.9 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-O 121.309 0.576 . . . . 0.0 109.543 175.281 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.792 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -84.17 -25.19 29.76 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.17 170.454 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.58 ' O ' HG23 ' A' 1030 ' ' VAL . 16.1 t-80 -76.05 -26.47 56.6 Favored 'General case' 0 C--O 1.215 -0.737 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 165.621 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1027 ' ' ALA . . . . . 0.476 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -66.03 -43.34 87.84 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 122.962 0.505 . . . . 0.0 110.297 162.274 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.76 HD11 HD22 ' A' ' 998' ' ' LEU . 17.0 mt -59.37 -46.1 89.6 Favored 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 120.399 -0.52 . . . . 0.0 109.615 171.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1029 ' ' ALA . . . . . 0.627 ' O ' ' HB2' ' A' 1033 ' ' LYS . . . -57.45 -40.18 77.89 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.128 173.415 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.58 HG23 ' O ' ' A' 1026 ' ' HIS . 12.2 t -69.77 -51.45 40.71 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 CA-C-O 121.407 0.622 . . . . 0.0 110.644 -177.658 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.436 ' O ' ' HB3' ' A' 1035 ' ' LEU . 71.4 m-20 -75.11 -30.82 60.97 Favored 'General case' 0 C--O 1.221 -0.444 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.535 -173.297 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.818 ' HA ' HD22 ' A' 1035 ' ' LEU . . . -72.99 -35.46 66.87 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.841 0.353 . . . . 0.0 110.129 173.814 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.627 ' HB2' ' O ' ' A' 1029 ' ' ALA . 53.2 tttt -63.68 -46.24 86.44 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.944 0.878 . . . . 0.0 108.988 172.484 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.429 ' O ' HG23 ' A' 1038 ' ' VAL . 12.6 t30 -68.93 -51.84 35.58 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 113.996 -1.456 . . . . 0.0 112.485 -177.935 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.999 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 0.2 OUTLIER -59.24 -40.85 87.23 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 117.782 0.265 . . . . 0.0 111.139 -171.713 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.506 ' HG ' ' HB ' ' A' ' 925' ' ' VAL . 1.5 tm? -68.13 -47.56 67.79 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 118.574 -1.251 . . . . 0.0 109.289 -178.04 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 14.8 t70 -47.16 -45.92 23.1 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.363 171.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.47 ' HB ' ' O ' ' A' 1035 ' ' LEU . 22.4 t -56.18 -42.52 73.41 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.633 0 CA-C-N 113.912 -1.495 . . . . 0.0 112.818 177.575 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.587 HG12 HG12 ' A' ' 984' ' ' ILE . 1.6 mp -81.26 -31.77 11.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 119.304 0.956 . . . . 0.0 111.288 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.587 ' C ' ' HB ' ' A' ' 919' ' ' ILE . 3.0 m-20 -59.38 -41.25 88.92 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 167.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -71.94 -37.57 69.97 Favored 'General case' 0 C--O 1.215 -0.737 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.578 173.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.533 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -53.29 -55.56 23.63 Favored 'General case' 0 CA--C 1.499 -0.988 0 C-N-CA 123.468 0.707 . . . . 0.0 111.566 -179.241 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.468 ' O ' ' HG3' ' A' 1046 ' ' MET . 0.0 OUTLIER -63.45 -37.36 86.98 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.34 -175.56 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 2.8 tm? -66.83 -48.89 67.51 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.164 178.03 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1045 ' ' LYS . . . . . . . . . . . . . 45.8 mtpt -57.11 -44.51 83.3 Favored 'General case' 0 C--O 1.213 -0.836 0 C-N-CA 124.072 0.949 . . . . 0.0 112.838 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.468 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 1.5 ptm -64.39 -26.37 68.43 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 119.142 -1.023 . . . . 0.0 111.638 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 51.5 mm -84.93 -52.03 12.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.793 0.33 . . . . 0.0 110.898 174.368 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 23.2 t -63.87 -42.06 97.61 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.553 -177.368 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 11.8 mm-40 -97.48 160.86 14.07 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.966 -171.401 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -123.43 -12.42 7.76 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.71 175.393 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1051 ' ' ARG . . . . . 0.756 ' H ' ' HD2' ' A' 1052 ' ' PRO . 38.7 mtm180 -131.26 -54.7 0.03 OUTLIER Pre-proline 0 CA--C 1.536 0.42 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1052 ' ' PRO . . . . . 0.756 ' HD2' ' H ' ' A' 1051 ' ' ARG . 50.4 Cg_endo -69.71 45.99 0.47 Allowed 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 122.955 2.437 . . . . 0.0 114.614 -178.228 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.324 -0.538 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 170.163 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.792 0 N-CA-C 112.033 -0.427 . . . . 0.0 112.033 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 909' ' ' SER . . . . . 0.404 ' N ' ' HD2' ' A' ' 910' ' ' PRO . 30.4 t -66.96 -51.24 38.49 Favored Pre-proline 0 CA--C 1.536 0.41 0 CA-C-O 119.672 -0.204 . . . . 0.0 110.858 179.425 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 910' ' ' PRO . . . . . 0.404 ' HD2' ' N ' ' A' ' 909' ' ' SER . 37.4 Cg_endo -69.05 69.9 1.23 Allowed 'Trans proline' 0 C--N 1.359 1.098 0 C-N-CA 121.781 1.654 . . . . 0.0 111.066 171.603 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . 179.09 -20.14 0.04 OUTLIER Glycine 0 N--CA 1.447 -0.58 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -176.18 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 61.9 mt -101.47 102.68 13.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 172.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 11.3 m -112.3 130.79 55.83 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.086 -174.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . -100.79 65.19 0.54 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 121.069 -0.586 . . . . 0.0 111.897 177.397 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 75.5 -147.55 35.83 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.97 -0.633 . . . . 0.0 112.151 -178.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 916' ' ' GLY . . . . . 0.498 ' HA2' HD13 ' A' ' 919' ' ' ILE . . . -78.12 93.53 1.2 Allowed Glycine 0 N--CA 1.445 -0.722 0 C-N-CA 120.978 -0.63 . . . . 0.0 111.798 178.086 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . -63.78 -69.53 1.3 Allowed Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 121.051 -0.595 . . . . 0.0 112.833 -177.81 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -131.85 31.86 2.99 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.343 -0.932 . . . . 0.0 113.182 -177.133 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 919' ' ' ILE . . . . . 0.861 HG13 ' HA ' ' A' 1041 ' ' GLN . 2.4 mp -59.95 81.98 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 C-N-CA 123.042 0.537 . . . . 0.0 110.438 174.467 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.496 ' HB2' ' O ' ' A' ' 919' ' ' ILE . 15.0 tpp180 175.54 102.6 0.01 OUTLIER 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.455 170.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 49.4 m -137.97 116.46 12.04 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 168.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -58.1 161.67 3.96 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.825 0.822 . . . . 0.0 111.569 -167.242 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.677 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 10.9 t70 -174.48 136.01 0.44 Allowed 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 114.322 -1.308 . . . . 0.0 113.83 -165.386 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.586 ' HB2' HG21 ' A' ' 968' ' ' THR . 0.0 OUTLIER -49.83 -14.33 0.13 Allowed 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.127 -0.942 . . . . 0.0 113.398 177.076 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.777 ' HA ' HD21 ' A' ' 928' ' ' ASN . 4.2 p -59.84 -34.53 56.18 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 CA-C-N 119.708 1.14 . . . . 0.0 110.942 167.019 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.677 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 2.4 p90 -77.23 -28.13 53.6 Favored 'General case' 0 CA--C 1.506 -0.737 0 O-C-N 121.601 -0.687 . . . . 0.0 109.394 174.458 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.85 -24.88 48.45 Favored 'General case' 0 C--N 1.307 -1.282 0 C-N-CA 118.698 -1.201 . . . . 0.0 113.962 178.243 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.777 HD21 ' HA ' ' A' ' 925' ' ' VAL . 13.0 p30 -72.21 -27.66 62.69 Favored 'General case' 0 C--N 1.317 -0.807 0 C-N-CA 118.661 -1.216 . . . . 0.0 108.992 166.06 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.787 HG22 ' HB1' ' A' 1032 ' ' ALA . 71.6 t -76.61 -30.7 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.137 179.239 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 930' ' ' THR . . . . . . . . . . . . . 26.8 m -61.2 -42.9 99.4 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 172.123 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -67.12 -52.72 30.38 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-N 114.61 -1.177 . . . . 0.0 113.808 176.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.62 ' HB3' ' HB1' ' A' ' 961' ' ' ALA . 2.4 pp -64.67 -49.47 70.85 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -174.76 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.531 ' O ' ' HB ' ' A' ' 936' ' ' VAL . 54.3 t -64.2 -37.84 80.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-O 121.311 0.576 . . . . 0.0 110.663 -176.146 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.404 ' O ' ' HB3' ' A' ' 938' ' ' GLU . 19.2 ttpp -59.87 -51.42 69.8 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.08 178.064 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -51.81 -39.69 59.17 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 111.672 0.249 . . . . 0.0 111.672 178.047 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.909 HG22 ' HB1' ' A' 1025 ' ' ALA . 92.0 t -46.73 -76.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 O-C-N 123.747 0.654 . . . . 0.0 111.852 177.256 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.448 HG13 ' N ' ' A' ' 938' ' ' GLU . 26.9 pt -68.66 -40.7 82.05 Favored 'Isoleucine or valine' 0 C--O 1.244 0.788 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -176.775 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.642 ' O ' ' HD3' ' A' ' 942' ' ' LYS . 30.8 tt0 -61.47 -52.86 62.77 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.117 -171.561 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.552 ' HA ' HG12 ' A' ' 943' ' ' ILE . 85.7 mtp -76.23 -26.93 56.55 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 119.782 -0.767 . . . . 0.0 110.721 -178.226 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.634 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 28.5 t -52.95 -45.75 67.85 Favored 'General case' 0 CA--C 1.52 -0.21 0 O-C-N 123.925 0.766 . . . . 0.0 112.502 -170.71 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 8.3 t -121.37 -18.31 7.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.191 -0.913 . . . . 0.0 112.24 -170.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.642 ' HD3' ' O ' ' A' ' 938' ' ' GLU . 0.5 OUTLIER -84.05 -44.95 13.58 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 118.793 -1.163 . . . . 0.0 110.376 -179.904 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.552 HG12 ' HA ' ' A' ' 939' ' ' MET . 26.0 mm -74.26 -21.31 17.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.255 179.703 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.486 ' HB3' ' HD3' ' A' ' 945' ' ' PRO . 20.1 tt0 -60.9 -47.75 94.71 Favored Pre-proline 0 CA--C 1.544 0.743 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 -173.214 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.486 ' HD3' ' HB3' ' A' ' 944' ' ' GLN . 18.2 Cg_exo -69.63 57.23 1.4 Allowed 'Trans proline' 0 C--N 1.358 1.028 0 C-N-CA 122.65 2.233 . . . . 0.0 113.028 179.026 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.666 ' HB1' ' HD2' ' A' ' 947' ' ' PRO . . . -169.99 -176.4 0.4 Allowed Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 -178.498 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.666 ' HD2' ' HB1' ' A' ' 946' ' ' ALA . 87.3 Cg_exo -50.66 161.16 1.4 Allowed 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 121.817 1.678 . . . . 0.0 111.287 168.114 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.563 ' HA ' HG21 ' A' 1009 ' ' VAL . 4.3 Cg_exo -34.73 131.14 0.2 Allowed 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 124.11 3.206 . . . . 0.0 113.677 -174.16 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.731 ' H ' ' HE1' ' A' ' 951' ' ' TYR . 29.6 mt-10 -66.67 29.03 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 114.815 -1.084 . . . . 0.0 112.782 -176.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.652 ' HB2' ' HG2' ' A' ' 953' ' ' PRO . 9.3 pt-20 33.53 66.15 0.24 Allowed 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 122.108 0.956 . . . . 0.0 110.559 -169.609 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.868 ' CD1' ' HB3' ' A' 1006 ' ' GLN . 0.8 OUTLIER -63.94 -49.02 74.22 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.238 -1.346 . . . . 0.0 110.509 -169.411 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 0.797 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 26.6 t -59.5 -54.13 59.04 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.963 174.16 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 0.797 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 34.7 Cg_exo -49.01 -41.51 40.03 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 122.059 1.839 . . . . 0.0 112.628 171.535 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 954' ' ' MET . . . . . . . . . . . . . 27.0 ttt -64.36 -38.25 90.38 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.376 175.519 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.747 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 35.1 t -52.25 -47.44 45.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.378 169.397 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -64.21 -29.89 70.98 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.27 177.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -78.26 -46.07 21.23 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 121.151 0.5 . . . . 0.0 111.012 -174.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 958' ' ' VAL . . . . . . . . . . . . . 14.8 p -81.66 -26.48 9.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.482 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -67.05 -34.49 86.9 Favored Glycine 0 N--CA 1.447 -0.59 0 N-CA-C 110.493 -1.043 . . . . 0.0 110.493 171.112 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 960' ' ' LEU . . . . . 0.577 HD12 ' HD2' ' A' ' 963' ' ' ARG . 20.2 tp -63.88 -30.39 71.48 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.288 -0.456 . . . . 0.0 110.213 175.427 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.62 ' HB1' ' HB3' ' A' ' 932' ' ' LEU . . . -76.41 -56.86 4.25 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.105 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.624 HD22 HD12 ' A' ' 995' ' ' LEU . 0.2 OUTLIER -44.07 -47.35 8.85 Favored 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 169.22 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.577 ' HD2' HD12 ' A' ' 960' ' ' LEU . 9.5 ptp180 -69.79 -27.18 64.68 Favored 'General case' 0 C--N 1.32 -0.699 0 O-C-N 120.848 -1.158 . . . . 0.0 110.831 179.159 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 964' ' ' THR . . . . . 0.484 HG22 ' HB3' ' A' ' 928' ' ' ASN . 93.0 m -68.94 -32.78 72.63 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 171.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.743 HD22 HD23 ' A' ' 991' ' ' LEU . 0.2 OUTLIER -65.44 -41.87 92.99 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.073 172.721 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 5.1 tt -69.98 -42.91 72.48 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.415 -0.811 . . . . 0.0 108.95 -174.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -66.99 -44.07 81.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.258 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.586 HG21 ' HB2' ' A' ' 924' ' ' LYS . 19.4 p -62.38 -48.48 79.57 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.77 0.319 . . . . 0.0 111.224 179.455 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 1.073 HG12 HG23 ' A' ' 984' ' ' ILE . 45.7 t -72.68 -31.43 37.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.81 178.393 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.619 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 15.1 t70 -69.96 -40.87 75.16 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 178.527 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.581 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 31.2 tt0 -64.79 -34.23 77.87 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 114.013 -1.449 . . . . 0.0 109.258 178.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.515 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 61.6 m -71.36 -18.81 62.35 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.324 178.058 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.747 ' HB2' HG21 ' A' ' 984' ' ' ILE . 9.7 tt -65.27 -49.78 63.08 Favored Pre-proline 0 CA--C 1.532 0.254 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.482 -176.591 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.702 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 4.9 Cg_exo -81.84 -9.68 11.93 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 121.659 1.573 . . . . 0.0 113.058 171.16 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.569 HG23 ' O ' ' A' ' 971' ' ' GLU . 25.4 t -66.47 -51.03 62.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 171.593 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.553 ' O ' ' HB ' ' A' ' 980' ' ' THR . 20.3 tp -128.75 90.05 47.29 Favored Pre-proline 0 N--CA 1.45 -0.465 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 173.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -87.49 -154.96 0.05 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.995 2.464 . . . . 0.0 114.104 -169.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . 68.04 -93.68 0.03 OUTLIER 'General case' 0 C--O 1.231 0.124 0 CA-C-N 114.896 -1.047 . . . . 0.0 111.815 178.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.487 ' O ' ' HG2' ' A' ' 982' ' ' ARG . 19.7 m -99.45 -34.72 10.16 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.606 -173.799 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.553 ' HB ' ' O ' ' A' ' 976' ' ' LEU . 54.6 m -62.58 -18.92 63.12 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 121.936 0.874 . . . . 0.0 109.366 175.752 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.634 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 2.8 t60 -56.9 -35.09 68.58 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 114.187 -1.37 . . . . 0.0 111.427 178.486 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 982' ' ' ARG . . . . . 0.487 ' HG2' ' O ' ' A' ' 979' ' ' SER . 6.0 ptp180 -84.54 -19.46 33.15 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -174.058 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.633 ' HG3' HG13 ' A' 1038 ' ' VAL . 0.4 OUTLIER -75.55 -33.98 60.71 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 121.903 0.859 . . . . 0.0 108.785 171.542 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 1.073 HG23 HG12 ' A' ' 969' ' ' VAL . 62.1 mt -72.95 -29.24 28.57 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.893 0 CA-C-N 114.219 -1.355 . . . . 0.0 109.596 177.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 985' ' ' GLU . . . . . 0.634 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 57.6 mt-10 -63.27 -47.87 80.55 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.512 0.672 . . . . 0.0 109.844 172.519 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 986' ' ' MET . . . . . 0.511 ' HG2' HD13 ' A' ' 990' ' ' LEU . 54.0 ttm -71.64 -47.38 54.79 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.88 -172.39 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.861 ' HA ' ' HG ' ' A' 1035 ' ' LEU . . . -61.1 -50.61 72.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.785 -175.485 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.66 ' O ' ' HB2' ' A' ' 992' ' ' ASN . 47.6 mt-30 -56.99 -30.67 64.34 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.0 0.429 . . . . 0.0 110.696 177.056 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 989' ' ' LYS . . . . . 0.733 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 1.9 ttmt -79.09 -40.33 31.44 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 -178.896 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.511 HD13 ' HG2' ' A' ' 986' ' ' MET . 3.1 mp -60.33 -54.05 50.29 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 119.552 -0.859 . . . . 0.0 112.867 -178.119 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.743 HD23 HD22 ' A' ' 965' ' ' LEU . 11.7 tp -65.64 -26.44 67.81 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.061 -0.656 . . . . 0.0 109.401 177.225 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 992' ' ' ASN . . . . . 0.733 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 23.8 t-20 -52.97 -57.74 9.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.632 178.828 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 13.4 m -80.42 -36.3 33.91 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -175.678 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.43 -36.7 84.71 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 119.386 -0.926 . . . . 0.0 111.268 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 0.689 ' N ' HD21 ' A' 1028 ' ' LEU . 2.3 tm? -68.16 -24.79 65.02 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.308 171.444 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -71.61 -28.7 63.98 Favored 'General case' 0 C--N 1.316 -0.86 0 C-N-CA 119.283 -0.967 . . . . 0.0 109.978 170.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -76.26 -37.66 57.3 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 110.415 -0.217 . . . . 0.0 110.415 173.607 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.889 HD12 ' HB2' ' A' 1025 ' ' ALA . 1.1 tt -56.6 -46.77 80.68 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.293 0.568 . . . . 0.0 110.855 178.756 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.511 ' N ' HD23 ' A' ' 998' ' ' LEU . 84.7 mt -65.95 -46.76 87.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.722 -172.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -56.38 -40.28 74.32 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.333 0.587 . . . . 0.0 111.552 -177.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.688 ' HD3' ' HG2' ' A' 1020 ' ' GLN . 96.8 mttt -84.88 -33.92 22.7 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.79 -173.543 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.68 ' SD ' ' HE3' ' A' 1018 ' ' LYS . 5.3 ttp -62.4 -30.31 71.12 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 122.351 1.072 . . . . 0.0 108.574 173.267 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.504 ' O ' ' HG3' ' A' 1006 ' ' GLN . 3.8 tptm -67.38 -53.03 32.94 Favored 'General case' 0 N--CA 1.439 -0.975 0 CA-C-N 113.777 -1.556 . . . . 0.0 110.491 -171.001 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.69 ' HB3' HD23 ' A' 1013 ' ' LEU . 8.4 mp -69.95 -16.65 63.24 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.815 -179.356 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.719 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -70.98 -39.45 72.47 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 119.344 -0.942 . . . . 0.0 110.219 -178.377 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.887 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.4 pp0? -74.75 -32.95 62.23 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 120.384 -0.526 . . . . 0.0 111.328 167.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.627 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 75.4 mt-30 -50.92 -44.51 60.13 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.258 0.551 . . . . 0.0 110.379 176.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.739 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 49.7 m-85 -122.2 41.1 3.49 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.561 172.239 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1009 ' ' VAL . . . . . 1.052 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 14.9 p -50.52 -21.18 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.646 171.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1010 ' ' MET . . . . . 0.501 ' O ' HG23 ' A' 1011 ' ' THR . 97.0 mmm -38.7 -50.32 1.63 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.33 -1.304 . . . . 0.0 111.381 172.937 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1011 ' ' THR . . . . . 0.501 HG23 ' O ' ' A' 1010 ' ' MET . 0.7 OUTLIER -163.68 -86.15 0.02 OUTLIER 'General case' 0 C--O 1.246 0.897 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 179.369 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 42.5 t -54.02 -67.46 0.26 Allowed 'General case' 0 C--O 1.238 0.474 0 CA-C-N 114.786 -1.097 . . . . 0.0 112.605 -166.231 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.739 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 6.8 mp -50.09 -42.39 50.13 Favored 'General case' 0 CA--C 1.5 -0.967 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 -179.189 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1014 ' ' GLN . . . . . 1.052 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.8 OUTLIER -53.47 -48.53 68.79 Favored 'General case' 0 N--CA 1.442 -0.827 0 O-C-N 123.65 0.594 . . . . 0.0 111.222 -166.866 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 27.0 pt20 -74.45 -45.56 45.49 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.262 -176.17 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -66.53 -53.14 38.16 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.495 0.664 . . . . 0.0 110.751 -178.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.719 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 15.9 m-85 -62.93 -37.63 87.8 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 114.628 -1.169 . . . . 0.0 113.37 -174.555 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.68 ' HE3' ' SD ' ' A' 1002 ' ' MET . 17.3 tptm -81.54 -29.1 33.62 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.988 -177.73 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1019 ' ' LYS . . . . . 0.433 ' O ' HD23 ' A' 1022 ' ' LEU . 4.5 mptp? -74.27 -51.74 14.41 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 174.814 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1020 ' ' GLN . . . . . 0.688 ' HG2' ' HD3' ' A' 1001 ' ' LYS . 10.5 tt0 -51.02 -34.47 29.62 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.07 163.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.635 ' HE2' ' HE2' ' A' 1018 ' ' LYS . 9.9 tmm? -62.87 -50.55 70.47 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 174.81 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1022 ' ' LEU . . . . . 0.89 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -80.11 -2.83 46.21 Favored 'General case' 0 C--O 1.221 -0.445 0 C-N-CA 119.276 -0.97 . . . . 0.0 109.858 -176.811 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 88.5 m -84.57 -39.56 18.59 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 171.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.514 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.21 -21.16 50.44 Favored 'General case' 0 C--O 1.22 -0.486 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 172.139 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.909 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -85.03 -25.11 27.86 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.137 170.536 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.582 ' O ' HG23 ' A' 1030 ' ' VAL . 61.0 t60 -75.78 -23.91 55.95 Favored 'General case' 0 C--O 1.217 -0.61 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 164.365 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1027 ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -71.01 -39.98 72.09 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 123.057 0.543 . . . . 0.0 109.8 164.118 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.697 HD12 HD13 ' A' ' 998' ' ' LEU . 15.0 mt -62.47 -44.7 95.77 Favored 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.104 170.507 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -60.01 -36.43 77.19 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 111.286 0.106 . . . . 0.0 111.286 173.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.582 HG23 ' O ' ' A' 1026 ' ' HIS . 8.8 t -70.35 -50.81 43.4 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 CA-C-O 121.506 0.67 . . . . 0.0 109.795 -179.756 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1031 ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -71.16 -42.35 69.23 Favored 'General case' 0 C--O 1.208 -1.101 0 CA-C-N 114.784 -1.098 . . . . 0.0 111.483 -175.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.787 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -66.8 -32.64 74.06 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.668 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 65.4 tttp -64.37 -49.82 70.12 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.747 0.784 . . . . 0.0 110.116 170.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.471 ' O ' HG23 ' A' 1038 ' ' VAL . 59.9 t30 -72.28 -38.74 68.72 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 114.826 -1.079 . . . . 0.0 112.018 -173.829 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.861 ' HG ' ' HA ' ' A' ' 987' ' ' ALA . 0.0 OUTLIER -64.83 -40.5 95.29 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 119.215 -0.421 . . . . 0.0 110.817 -177.498 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.551 ' HB3' HG22 ' A' ' 925' ' ' VAL . 4.2 pp -67.8 -39.57 84.0 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 117.232 -1.787 . . . . 0.0 110.177 174.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.08 -39.26 59.47 Favored 'General case' 0 C--N 1.344 0.328 0 CA-C-O 121.725 0.774 . . . . 0.0 110.207 172.375 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.633 HG13 ' HG3' ' A' ' 983' ' ' GLU . 12.3 t -57.91 -46.35 87.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 114.321 -1.309 . . . . 0.0 111.841 176.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.602 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 2.4 mp -73.91 -27.62 22.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 118.329 0.513 . . . . 0.0 111.484 174.834 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.526 ' HB3' HG23 ' A' ' 919' ' ' ILE . 4.3 m-20 -64.45 -46.96 80.87 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.332 170.662 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.861 ' HA ' HG13 ' A' ' 919' ' ' ILE . 45.7 mt-30 -60.47 -46.09 91.34 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 172.253 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.602 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -55.49 -51.4 67.09 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.58 -175.884 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.519 ' HG2' ' O ' ' A' 1039 ' ' ILE . 4.8 ptp85 -62.07 -34.73 76.82 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.034 -173.687 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 12.9 mt -83.47 -42.21 17.16 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 119.201 -1.0 . . . . 0.0 111.635 174.731 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.43 ' O ' ' HB2' ' A' 1049 ' ' GLN . 24.9 ttpp -55.13 -34.62 63.89 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.218 0.532 . . . . 0.0 111.294 -177.522 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.636 ' O ' ' HB3' ' A' 1050 ' ' SER . 18.2 mmt -86.57 -39.11 16.49 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 177.199 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.735 HG22 ' HA ' ' A' 1053 ' ' HIS . 3.7 mm -96.0 -46.8 13.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 O-C-N 121.77 -0.581 . . . . 0.0 111.603 -174.213 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 56.4 m -63.36 -6.71 5.07 Favored 'General case' 0 C--N 1.316 -0.851 0 O-C-N 121.202 -0.936 . . . . 0.0 111.626 177.269 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1049 ' ' GLN . . . . . 0.43 ' HB2' ' O ' ' A' 1045 ' ' LYS . 13.6 mm-40 -128.54 -70.39 0.68 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.256 -0.429 . . . . 0.0 112.056 -169.296 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1050 ' ' SER . . . . . 0.636 ' HB3' ' O ' ' A' 1046 ' ' MET . 36.0 t -58.55 -61.86 2.28 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.871 0.367 . . . . 0.0 111.024 -179.691 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1051 ' ' ARG . . . . . 0.423 ' HA ' ' HD2' ' A' 1052 ' ' PRO . 78.5 mtp180 -132.83 104.83 12.81 Favored Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 178.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1052 ' ' PRO . . . . . 0.423 ' HD2' ' HA ' ' A' 1051 ' ' ARG . 26.7 Cg_exo -21.3 130.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.855 1 C-N-CA 126.439 4.76 . . . . 0.0 116.818 -172.374 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A 1053 ' ' HIS . . . . . 0.735 ' HA ' HG22 ' A' 1047 ' ' ILE . 54.0 t-80 . . . . . 0 C--N 1.337 0.047 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.441 -179.704 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.767 0 N-CA-C 112.303 -0.319 . . . . 0.0 112.303 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 15.9 t -87.09 139.53 32.47 Favored Pre-proline 0 C--N 1.323 -0.566 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 178.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.44 163.28 39.38 Favored 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 122.429 2.086 . . . . 0.0 112.063 178.516 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -90.46 95.36 2.08 Favored Glycine 0 N--CA 1.444 -0.774 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 177.489 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 912' ' ' ILE . . . . . 0.679 HG13 ' H ' ' A' ' 913' ' ' SER . 13.6 pt 41.46 -99.46 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 124.046 0.938 . . . . 0.0 112.726 -175.728 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 913' ' ' SER . . . . . 0.679 ' H ' HG13 ' A' ' 912' ' ' ILE . 14.6 t -123.51 141.35 52.09 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 -178.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 101.29 4.2 53.47 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.267 -178.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 79.46 -72.43 2.53 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 121.136 -0.554 . . . . 0.0 112.5 178.726 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . -161.84 87.74 0.11 Allowed Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 121.198 -0.525 . . . . 0.0 111.838 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . -89.61 71.02 2.3 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.223 -179.119 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 918' ' ' GLY . . . . . 0.706 ' HA3' ' HB2' ' A' 1044 ' ' LEU . . . -61.92 -52.19 51.98 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.811 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 919' ' ' ILE . . . . . 0.462 ' HB ' ' HB3' ' A' 1040 ' ' ASP . 0.0 OUTLIER -65.85 130.1 30.8 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.706 0 CA-C-O 121.269 0.556 . . . . 0.0 110.195 176.629 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 920' ' ' ARG . . . . . . . . . . . . . 36.6 mmm-85 -115.04 -36.26 4.47 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.729 -169.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 50.3 m 60.69 30.94 20.05 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.637 -174.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -126.12 96.25 4.67 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.518 -1.219 . . . . 0.0 108.377 178.127 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.576 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 2.6 p30 -166.63 150.02 7.0 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 123.195 1.474 . . . . 0.0 114.344 -168.746 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.821 ' HB3' HG21 ' A' ' 968' ' ' THR . 14.0 tppt? -58.22 -26.98 63.51 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 113.312 -1.767 . . . . 0.0 112.651 170.113 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.624 HG12 HD12 ' A' ' 965' ' ' LEU . 3.6 t -64.29 -43.36 97.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-N 118.79 0.723 . . . . 0.0 111.274 -172.726 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.576 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.2 OUTLIER -78.69 -19.06 53.36 Favored 'General case' 0 CA--C 1.502 -0.89 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.845 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.66 -23.32 53.25 Favored 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 119.64 -0.824 . . . . 0.0 111.147 168.711 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.451 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 8.2 m120 -74.74 -27.53 60.4 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 168.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.668 HG22 ' HB1' ' A' 1032 ' ' ALA . 60.0 t -77.51 -30.95 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.258 176.224 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 930' ' ' THR . . . . . . . . . . . . . 27.9 m -60.32 -41.36 93.35 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 171.081 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -68.72 -54.05 17.0 Favored Glycine 0 CA--C 1.526 0.761 0 CA-C-N 114.996 -1.002 . . . . 0.0 113.621 176.641 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.553 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.2 pp -63.44 -49.33 74.12 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -175.556 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 63.5 t -65.62 -36.84 78.56 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-O 121.112 0.482 . . . . 0.0 110.883 -175.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.651 ' O ' ' HB2' ' A' ' 938' ' ' GLU . 4.3 ttpm? -58.92 -46.58 87.58 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.178 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -55.3 -41.63 72.61 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 111.545 0.202 . . . . 0.0 111.545 176.268 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.771 HG22 ' HB1' ' A' 1025 ' ' ALA . 61.9 t -49.21 -75.49 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 123.206 0.603 . . . . 0.0 112.448 -177.757 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.425 HG13 ' N ' ' A' ' 938' ' ' GLU . 35.4 pt -74.3 -42.03 50.6 Favored 'Isoleucine or valine' 0 C--O 1.245 0.836 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -175.123 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.651 ' HB2' ' O ' ' A' ' 934' ' ' LYS . 25.4 mm-40 -60.86 -51.29 69.94 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.907 0.384 . . . . 0.0 110.529 -174.306 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.651 ' HB3' ' OE1' ' A' ' 950' ' ' GLU . 65.4 mtt -74.16 -26.52 60.35 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.861 -178.464 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.629 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 53.3 p -52.05 -48.15 64.75 Favored 'General case' 0 CA--C 1.52 -0.202 0 O-C-N 123.705 0.628 . . . . 0.0 111.672 -170.142 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 23.3 t -116.27 -23.07 8.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.606 -173.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.599 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 0.4 OUTLIER -83.63 -46.42 12.37 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 119.787 -0.765 . . . . 0.0 111.304 -173.245 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.638 HG12 ' HA ' ' A' ' 939' ' ' MET . 44.8 mm -70.89 -23.49 23.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 944' ' ' GLN . . . . . . . . . . . . . 2.8 mm100 -61.73 -35.78 25.17 Favored Pre-proline 0 CA--C 1.544 0.75 0 N-CA-C 115.236 1.569 . . . . 0.0 115.236 -172.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.599 ' HD2' ' O ' ' A' ' 942' ' ' LYS . 76.5 Cg_exo -55.12 -23.18 34.85 Favored 'Trans proline' 0 C--N 1.353 0.784 0 C-N-CA 121.771 1.647 . . . . 0.0 112.905 170.557 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.785 ' HB1' ' HD2' ' A' ' 947' ' ' PRO . . . -92.79 -178.98 0.95 Allowed Pre-proline 0 C--N 1.326 -0.446 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 178.336 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.785 ' HD2' ' HB1' ' A' ' 946' ' ' ALA . 64.8 Cg_exo -40.85 113.6 0.24 Allowed 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 122.696 2.264 . . . . 0.0 112.549 173.378 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.649 ' HB2' HG21 ' A' 1009 ' ' VAL . 81.8 Cg_endo -83.13 -156.63 0.07 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.646 0 C-N-CA 123.183 2.589 . . . . 0.0 113.922 -170.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.864 ' HB3' ' HB2' ' A' 1006 ' ' GLN . 2.3 mt-10 61.47 10.63 3.3 Favored 'General case' 0 CA--C 1.494 -1.191 0 CA-C-N 114.403 -1.271 . . . . 0.0 109.714 -169.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.714 ' O ' ' HB3' ' A' ' 954' ' ' MET . 0.6 OUTLIER -61.41 0.27 0.31 Allowed 'General case' 0 C--O 1.209 -1.06 0 O-C-N 123.815 0.697 . . . . 0.0 111.972 -170.337 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.659 ' CD1' ' HD3' ' A' 1018 ' ' LYS . 0.1 OUTLIER -68.62 -34.91 76.58 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 123.56 0.744 . . . . 0.0 110.031 177.021 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 0.998 HG23 ' HD3' ' A' ' 953' ' ' PRO . 0.9 OUTLIER -82.62 -39.22 0.83 Allowed Pre-proline 0 N--CA 1.453 -0.281 0 CA-C-O 119.219 -0.42 . . . . 0.0 111.415 176.175 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 0.998 ' HD3' HG23 ' A' ' 952' ' ' VAL . 35.8 Cg_exo -49.84 -42.15 45.05 Favored 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 121.417 1.412 . . . . 0.0 110.729 161.684 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.714 ' HB3' ' O ' ' A' ' 950' ' ' GLU . 2.5 ttm -70.4 -28.96 65.49 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 113.831 -1.531 . . . . 0.0 111.846 177.571 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.88 HG23 ' HA ' ' A' ' 952' ' ' VAL . 76.0 t -53.39 -40.34 39.91 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 173.037 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.404 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 8.9 tmtt? -68.45 -33.17 73.72 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 114.973 -1.012 . . . . 0.0 111.723 173.601 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 957' ' ' GLU . . . . . 0.419 ' HB2' ' HA ' ' A' ' 954' ' ' MET . 6.9 mm-40 -78.35 -47.63 17.3 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -176.556 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.607 HG23 ' HG3' ' A' ' 954' ' ' MET . 2.7 t -84.54 -34.92 9.9 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.011 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 -178.143 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -59.8 -39.53 95.49 Favored Glycine 0 N--CA 1.434 -1.453 0 N-CA-C 110.636 -0.986 . . . . 0.0 110.636 178.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 960' ' ' LEU . . . . . 0.547 ' O ' ' HG2' ' A' ' 963' ' ' ARG . 9.1 tt -68.13 -36.17 79.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.348 -0.426 . . . . 0.0 110.626 175.276 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -76.25 -60.23 2.42 Favored 'General case' 0 C--N 1.321 -0.65 0 O-C-N 122.093 -0.379 . . . . 0.0 110.952 -174.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 1.108 HD13 HD22 ' A' ' 995' ' ' LEU . 3.4 pp -53.54 -34.13 57.11 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 112.435 0.531 . . . . 0.0 112.435 173.153 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.547 ' HG2' ' O ' ' A' ' 960' ' ' LEU . 3.7 ptm180 -71.83 -39.98 69.39 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 119.949 1.25 . . . . 0.0 111.166 174.803 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 38.3 m -61.24 -38.82 88.05 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 174.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.667 HD11 HD21 ' A' 1035 ' ' LEU . 0.3 OUTLIER -55.97 -54.72 41.42 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.66 174.738 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 5.2 tt -69.52 -34.68 74.62 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.164 -172.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 967' ' ' ALA . . . . . 0.418 ' O ' ' HB2' ' A' ' 971' ' ' GLU . . . -71.8 -29.16 64.15 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.807 178.108 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.821 HG21 ' HB3' ' A' ' 924' ' ' LYS . 23.7 m -71.99 -32.9 67.68 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 118.824 0.738 . . . . 0.0 109.79 172.354 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 1.003 HG12 HG23 ' A' ' 984' ' ' ILE . 24.3 t -70.24 -40.8 78.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.424 171.404 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.584 ' HB2' ' OE1' ' A' ' 988' ' ' GLN . 16.4 t70 -65.58 -42.1 92.13 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 122.301 1.048 . . . . 0.0 108.864 179.583 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.525 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 37.6 tt0 -62.16 -37.6 85.85 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 113.54 -1.664 . . . . 0.0 109.867 177.516 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 63.7 m -67.1 -18.76 65.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.085 176.813 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.63 ' HG ' ' HB2' ' A' ' 981' ' ' HIS . 9.4 tt -68.69 -51.74 20.56 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.648 -172.601 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.549 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 95.7 Cg_endo -84.37 -7.35 9.91 Favored 'Trans proline' 0 C--N 1.354 0.821 0 CA-C-N 119.883 0.994 . . . . 0.0 112.878 174.858 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 971' ' ' GLU . 75.3 t -74.96 -42.95 46.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 C-N-CA 120.226 -0.59 . . . . 0.0 109.419 170.235 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.452 HD22 HG21 ' A' ' 980' ' ' THR . 4.7 mp -115.63 83.93 11.85 Favored Pre-proline 0 C--O 1.233 0.197 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 174.012 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_exo -72.28 -7.08 20.31 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.166 2.578 . . . . 0.0 113.307 -172.444 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 978' ' ' ALA . . . . . 0.551 ' HB3' ' SD ' ' A' 1046 ' ' MET . . . -83.94 -159.11 0.36 Allowed 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 110.089 -0.338 . . . . 0.0 110.089 178.622 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.567 ' O ' ' HG2' ' A' ' 982' ' ' ARG . 18.4 m -37.67 -36.35 0.17 Allowed 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 114.163 1.172 . . . . 0.0 114.163 -177.811 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.867 ' HA ' ' HB1' ' A' 1042 ' ' ALA . 89.4 m -53.89 -36.36 62.6 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 117.879 0.308 . . . . 0.0 111.703 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.63 ' HB2' ' HG ' ' A' ' 973' ' ' LEU . 4.4 p-80 -62.66 -33.81 75.8 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.961 -175.729 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 982' ' ' ARG . . . . . 0.567 ' HG2' ' O ' ' A' ' 979' ' ' SER . 9.3 ptm180 -85.4 -19.82 30.77 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 121.046 -0.261 . . . . 0.0 111.046 -178.387 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 983' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.67 -34.48 69.75 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 166.256 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 1.003 HG23 HG12 ' A' ' 969' ' ' VAL . 44.9 mt -69.9 -33.01 53.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.637 176.872 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 985' ' ' GLU . . . . . 0.53 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 50.5 mt-10 -57.96 -49.81 75.53 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.559 175.245 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 50.9 ttp -72.83 -42.49 63.74 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 114.9 -1.046 . . . . 0.0 110.755 -175.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.809 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -68.21 -50.27 55.25 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 114.898 -1.046 . . . . 0.0 112.279 -172.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.595 ' O ' ' HB2' ' A' ' 992' ' ' ASN . 44.8 mt-30 -54.39 -43.73 71.67 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 176.2 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 989' ' ' LYS . . . . . 0.708 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 0.0 OUTLIER -63.52 -42.15 98.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.046 177.88 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 26.3 tp -51.86 -59.32 4.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.324 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.452 ' HA ' HD22 ' A' ' 991' ' ' LEU . 0.7 OUTLIER -63.43 -35.5 80.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.709 0.766 . . . . 0.0 108.936 178.143 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 992' ' ' ASN . . . . . 0.708 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 25.5 t-20 -50.37 -55.39 15.86 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 113.82 -1.536 . . . . 0.0 112.749 -176.661 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 5.5 m -77.86 -30.03 50.69 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.31 -0.556 . . . . 0.0 111.99 -178.151 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 994' ' ' ASP . . . . . 0.436 ' O ' ' HB3' ' A' ' 997' ' ' GLU . 0.1 OUTLIER -73.75 -33.79 64.46 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 118.877 -1.129 . . . . 0.0 111.667 179.826 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 1.108 HD22 HD13 ' A' ' 962' ' ' LEU . 1.9 pp -68.02 -19.12 64.88 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 169.645 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -78.21 -23.93 47.31 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 119.414 -0.914 . . . . 0.0 110.133 169.363 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.436 ' HB3' ' O ' ' A' ' 994' ' ' ASP . 6.9 tp10 -74.23 -43.96 55.04 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.976 -0.749 . . . . 0.0 108.976 171.566 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.715 HD13 ' HB2' ' A' 1025 ' ' ALA . 7.5 tp -56.91 -48.06 79.09 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.266 -179.371 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.874 ' HA ' ' SD ' ' A' 1002 ' ' MET . 67.5 mt -68.76 -38.08 78.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.828 -171.278 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 25.8 m-80 -62.76 -35.41 79.72 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.63 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.486 ' HA ' ' HD1' ' A' 1017 ' ' TYR . 0.7 OUTLIER -85.4 -39.84 17.13 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.293 0.568 . . . . 0.0 110.816 -175.469 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.874 ' SD ' ' HA ' ' A' ' 999' ' ' ILE . 8.2 ptm -62.29 -27.08 68.77 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 122.255 1.026 . . . . 0.0 108.653 177.499 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.671 ' O ' ' HG3' ' A' 1006 ' ' GLN . 19.9 tptt -73.92 -54.04 8.81 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 114.158 -1.383 . . . . 0.0 110.575 -171.056 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.549 ' HA ' ' HB2' ' A' 1007 ' ' GLN . 6.4 mt -69.54 -12.52 61.72 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.004 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.749 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -75.73 -38.7 58.27 Favored 'General case' 0 C--O 1.213 -0.838 0 C-N-CA 119.296 -0.962 . . . . 0.0 108.594 -178.85 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.967 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 1.3 pp0? -74.33 -36.7 63.66 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.764 -0.375 . . . . 0.0 111.126 170.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.549 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 33.9 mt-30 -49.26 -43.32 42.86 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.034 0.445 . . . . 0.0 111.289 178.599 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.658 ' HB2' ' HG ' ' A' 1013 ' ' LEU . 49.4 m-85 -126.04 44.74 2.78 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.313 0.578 . . . . 0.0 110.839 169.17 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1009 ' ' VAL . . . . . 1.013 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 7.9 p -53.17 -20.21 2.57 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.409 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.63 171.899 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1010 ' ' MET . . . . . 0.462 ' O ' HG23 ' A' 1011 ' ' THR . 60.2 mtm -48.42 -40.59 26.51 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.162 -1.381 . . . . 0.0 111.915 174.419 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1011 ' ' THR . . . . . 0.462 HG23 ' O ' ' A' 1010 ' ' MET . 1.0 OUTLIER -160.66 -94.18 0.02 OUTLIER 'General case' 0 C--O 1.248 0.998 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 -179.344 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 4.6 m -59.12 -62.65 1.72 Allowed 'General case' 0 C--O 1.24 0.555 0 CA-C-N 114.517 -1.22 . . . . 0.0 113.121 -162.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.701 HD22 ' HE2' ' A' 1017 ' ' TYR . 14.6 mt -53.57 -37.38 62.86 Favored 'General case' 0 CA--C 1.498 -1.044 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.735 -178.653 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1014 ' ' GLN . . . . . 1.013 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -53.78 -54.56 36.46 Favored 'General case' 0 N--CA 1.441 -0.919 0 O-C-N 123.867 0.729 . . . . 0.0 110.817 -166.693 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -70.57 -42.45 71.07 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.82 -175.61 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -67.0 -53.76 28.26 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.555 0.693 . . . . 0.0 111.149 -179.193 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.749 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 12.0 m-85 -62.56 -34.34 76.77 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 113.823 1.045 . . . . 0.0 113.823 -176.775 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.659 ' HD3' ' CD1' ' A' ' 951' ' ' TYR . 54.1 tptt -79.05 -31.38 44.51 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 114.92 -1.036 . . . . 0.0 110.247 -176.122 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -71.81 -42.51 66.96 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 175.084 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -56.16 -36.25 68.1 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.539 163.335 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.597 ' HB3' ' HA ' ' A' 1018 ' ' LYS . 0.0 OUTLIER -66.82 -51.74 52.0 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.377 0.132 . . . . 0.0 110.834 -177.032 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A 1022 ' ' LEU . . . . . 0.417 ' O ' ' HG ' ' A' 1022 ' ' LEU . 0.0 OUTLIER -78.09 -13.48 59.85 Favored 'General case' 0 C--O 1.218 -0.558 0 C-N-CA 119.595 -0.842 . . . . 0.0 109.955 -176.036 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A 1023 ' ' THR . . . . . 0.499 ' HA ' ' HB3' ' A' 1026 ' ' HIS . 87.5 m -88.44 -32.75 18.14 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.671 177.093 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.499 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.28 -23.36 47.24 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 171.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.771 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -86.21 -21.67 27.34 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.255 169.307 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.636 ' O ' HG23 ' A' 1030 ' ' VAL . 84.9 t60 -76.38 -27.07 56.22 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 165.662 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1027 ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -68.98 -41.51 77.78 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 123.806 0.842 . . . . 0.0 109.957 163.19 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.623 HD21 ' N ' ' A' ' 995' ' ' LEU . 12.3 mt -61.23 -39.95 92.18 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 119.989 -0.684 . . . . 0.0 109.666 170.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -60.96 -37.34 82.05 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.484 0.183 . . . . 0.0 110.973 171.29 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.636 HG23 ' O ' ' A' 1026 ' ' HIS . 18.1 t -69.28 -50.45 52.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 121.746 0.784 . . . . 0.0 110.109 -178.684 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1031 ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -74.18 -32.83 63.25 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-N 114.445 -1.252 . . . . 0.0 111.024 -174.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.874 ' HA ' HD22 ' A' 1035 ' ' LEU . . . -71.39 -32.36 68.35 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 173.824 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -63.73 -43.89 95.17 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.661 0.743 . . . . 0.0 109.363 171.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.439 ' O ' ' HB3' ' A' 1037 ' ' ASP . 48.3 t30 -79.22 -49.25 12.81 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 114.865 -1.061 . . . . 0.0 112.364 -173.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.874 HD22 ' HA ' ' A' 1032 ' ' ALA . 0.2 OUTLIER -60.33 -39.7 88.01 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 118.012 0.369 . . . . 0.0 110.662 -174.422 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.511 ' H ' HD23 ' A' 1035 ' ' LEU . 2.5 tm? -68.83 -43.19 76.02 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 117.998 -1.481 . . . . 0.0 108.87 178.669 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.439 ' HB3' ' O ' ' A' 1034 ' ' ASN . 27.8 t70 -52.6 -41.76 63.95 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.457 174.49 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.474 ' HB ' ' O ' ' A' 1035 ' ' LEU . 24.6 t -56.41 -41.38 71.71 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.694 0 CA-C-N 114.182 -1.372 . . . . 0.0 111.706 174.871 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.657 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 1.6 mp -81.16 -28.63 10.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 118.215 0.461 . . . . 0.0 111.282 177.721 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.462 ' HB3' ' HB ' ' A' ' 919' ' ' ILE . 0.1 OUTLIER -59.23 -48.6 81.01 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 168.889 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -70.76 -33.43 70.78 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.53 175.225 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.867 ' HB1' ' HA ' ' A' ' 980' ' ' THR . . . -55.37 -50.22 70.27 Favored 'General case' 0 CA--C 1.512 -0.511 0 C-N-CA 123.384 0.673 . . . . 0.0 112.422 178.739 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.591 ' HG2' ' O ' ' A' 1039 ' ' ILE . 4.0 ptp85 -64.58 -34.87 79.28 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.911 -0.404 . . . . 0.0 109.911 -177.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.706 ' HB2' ' HA3' ' A' ' 918' ' ' GLY . 51.7 tp -72.31 -30.91 65.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.102 0.477 . . . . 0.0 110.61 173.16 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1045 ' ' LYS . . . . . . . . . . . . . 4.5 tmtm? -71.76 -37.92 70.43 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.055 -174.176 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.551 ' SD ' ' HB3' ' A' ' 978' ' ' ALA . 1.2 ptm -73.09 -30.52 63.73 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.834 172.297 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.465 HG12 ' O ' ' A' 1043 ' ' ARG . 34.5 mm -73.65 -42.2 55.13 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 118.608 0.64 . . . . 0.0 110.381 179.359 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 68.9 p -72.38 -5.42 36.27 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.362 178.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1049 ' ' GLN . . . . . 0.458 ' HB3' ' O ' ' A' 1046 ' ' MET . 41.9 tp60 -86.23 -77.37 0.31 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.221 -0.9 . . . . 0.0 111.543 -177.368 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1050 ' ' SER . . . . . 0.406 ' OG ' ' HG3' ' A' 1049 ' ' GLN . 36.9 p 176.5 -46.62 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.853 -172.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1051 ' ' ARG . . . . . 0.451 ' HA ' ' HD3' ' A' 1052 ' ' PRO . 54.6 ttt180 -85.82 103.09 3.21 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.295 178.36 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1052 ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' 1051 ' ' ARG . 4.1 Cg_exo -79.27 -171.74 1.33 Allowed 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 122.801 2.334 . . . . 0.0 113.486 -169.569 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 51.6 t-80 . . . . . 0 C--N 1.326 -0.424 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.172 -177.662 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.701 0 N-CA-C 111.842 -0.503 . . . . 0.0 111.842 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 909' ' ' SER . . . . . 0.477 ' HA ' ' HD3' ' A' ' 910' ' ' PRO . 34.8 t -95.68 138.64 21.76 Favored Pre-proline 0 C--N 1.321 -0.643 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 179.56 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 910' ' ' PRO . . . . . 0.477 ' HD3' ' HA ' ' A' ' 909' ' ' SER . 17.2 Cg_exo -67.8 81.03 0.47 Allowed 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.915 2.41 . . . . 0.0 112.284 178.37 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -147.44 26.04 1.53 Allowed Glycine 0 N--CA 1.447 -0.585 0 N-CA-C 111.228 -0.749 . . . . 0.0 111.228 177.188 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 60.0 mt -92.98 92.1 3.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.208 0.528 . . . . 0.0 110.015 -177.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 6.0 p -91.25 -25.56 19.43 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.031 -179.259 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 98.58 -0.3 58.1 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.904 -0.665 . . . . 0.0 111.909 -177.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 915' ' ' GLY . . . . . 0.463 ' HA3' ' NH2' ' A' ' 920' ' ' ARG . . . 83.32 -82.91 1.64 Allowed Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 121.098 -0.572 . . . . 0.0 112.152 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . 171.42 -61.0 0.17 Allowed Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 121.1 -0.571 . . . . 0.0 111.866 179.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . -154.37 -155.38 7.22 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.074 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 918' ' ' GLY . . . . . 0.6 ' CA ' ' HB2' ' A' 1044 ' ' LEU . . . 76.52 136.23 0.68 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 121.276 -0.488 . . . . 0.0 112.868 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 919' ' ' ILE . . . . . 0.444 ' HB ' ' HB3' ' A' 1040 ' ' ASP . 0.1 OUTLIER -79.21 117.05 24.18 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.39 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 171.565 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.463 ' NH2' ' HA3' ' A' ' 915' ' ' GLY . 81.5 mtt180 -97.24 -11.02 24.67 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.758 -172.35 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 921' ' ' SER . . . . . 0.451 ' O ' ' HB2' ' A' ' 922' ' ' ASN . 32.3 t 69.24 114.67 0.04 OUTLIER 'General case' 0 CA--C 1.513 -0.445 0 O-C-N 124.034 0.834 . . . . 0.0 109.777 -177.774 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 0.658 ' O ' ' HB2' ' A' ' 923' ' ' ASP . 86.2 m-20 73.61 -167.55 0.11 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.662 -1.154 . . . . 0.0 109.733 -174.083 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.784 ' HB3' HG22 ' A' ' 925' ' ' VAL . 3.5 t70 145.82 -177.83 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 -167.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.462 ' HA ' ' HD2' ' A' ' 924' ' ' LYS . 0.3 OUTLIER -57.95 -29.47 65.21 Favored 'General case' 0 C--N 1.317 -0.808 0 O-C-N 121.685 -0.634 . . . . 0.0 110.138 174.328 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.784 HG22 ' HB3' ' A' ' 923' ' ' ASP . 20.0 m -60.42 -29.22 43.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.318 0.58 . . . . 0.0 110.744 175.221 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.712 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -73.79 -35.16 64.9 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.004 -0.544 . . . . 0.0 112.205 179.381 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 927' ' ' GLU . . . . . 0.843 ' HA ' ' HB ' ' A' ' 930' ' ' THR . 12.1 pt-20 -76.26 -22.71 54.79 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 119.566 1.075 . . . . 0.0 110.736 179.388 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.416 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 1.4 m120 -71.81 -30.3 65.35 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 174.306 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.661 HG22 ' HB1' ' A' 1032 ' ' ALA . 75.6 t -80.53 -32.5 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.297 0 CA-C-N 114.593 -1.185 . . . . 0.0 109.556 172.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.843 ' HB ' ' HA ' ' A' ' 927' ' ' GLU . 1.2 m -54.4 -44.72 72.59 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 167.137 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -68.35 -53.2 22.59 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-N 115.006 -0.997 . . . . 0.0 114.008 175.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.574 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.0 pp -64.68 -48.32 75.18 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 117.518 0.659 . . . . 0.0 112.772 -175.323 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 49.7 t -66.64 -36.69 77.88 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.394 0 CA-C-O 121.04 0.448 . . . . 0.0 110.925 -174.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.41 ' HE2' ' HB3' ' A' ' 934' ' ' LYS . 22.0 ttpt -60.09 -41.98 93.65 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.303 179.046 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -62.46 -32.1 72.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.554 0.216 . . . . 0.0 111.543 176.131 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.814 HG22 ' HB1' ' A' 1025 ' ' ALA . 98.6 t -58.6 -75.83 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -177.912 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 27.4 pt -73.35 -39.45 55.38 Favored 'Isoleucine or valine' 0 C--O 1.239 0.516 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -173.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -63.09 -51.9 64.79 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.686 0.755 . . . . 0.0 109.809 -174.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.817 ' HA ' ' HG3' ' A' ' 942' ' ' LYS . 21.6 mmt -73.32 -26.59 61.11 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.877 -177.383 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.662 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 25.7 p -52.74 -41.38 63.94 Favored 'General case' 0 CA--C 1.519 -0.247 0 O-C-N 123.746 0.654 . . . . 0.0 111.458 -173.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 45.0 m -99.43 -20.52 16.42 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.95 -175.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.817 ' HG3' ' HA ' ' A' ' 939' ' ' MET . 0.0 OUTLIER -82.4 -8.22 59.63 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 119.133 -1.027 . . . . 0.0 109.958 -178.996 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.932 HG22 ' HB2' ' A' ' 949' ' ' GLU . 41.0 pt -45.05 -53.15 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 O-C-N 123.515 0.509 . . . . 0.0 111.492 170.013 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.659 ' N ' HG13 ' A' ' 943' ' ' ILE . 27.7 mm-40 67.34 147.66 0.11 Allowed Pre-proline 0 CA--C 1.534 0.363 0 O-C-N 123.727 0.642 . . . . 0.0 111.256 -174.341 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 944' ' ' GLN . 8.1 Cg_exo -73.7 60.59 4.38 Favored 'Trans proline' 0 CA--C 1.531 0.371 0 C-N-CA 122.873 2.382 . . . . 0.0 113.076 -177.152 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.883 ' HB3' ' HD3' ' A' ' 947' ' ' PRO . . . -167.98 -58.17 0.01 OUTLIER Pre-proline 0 CA--C 1.537 0.469 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.523 176.044 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.883 ' HD3' ' HB3' ' A' ' 946' ' ' ALA . 3.5 Cg_exo -79.11 129.74 8.97 Favored 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 122.451 2.101 . . . . 0.0 111.612 174.191 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.429 ' HB3' HG21 ' A' 1009 ' ' VAL . 95.8 Cg_endo -80.69 26.51 0.59 Allowed 'Trans proline' 0 CA--C 1.515 -0.441 0 C-N-CA 122.794 2.329 . . . . 0.0 113.697 -176.71 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.932 ' HB2' HG22 ' A' ' 943' ' ' ILE . 43.3 tt0 60.71 -13.26 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.438 0 O-C-N 123.775 0.672 . . . . 0.0 112.686 -178.772 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.749 ' HB3' ' HG2' ' A' ' 953' ' ' PRO . 1.8 mp0 52.15 64.2 1.94 Allowed 'General case' 0 N--CA 1.44 -0.944 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 -154.761 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.833 ' CE1' ' HD3' ' A' 1018 ' ' LYS . 23.6 m-85 -47.79 -59.41 3.33 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.23 -0.895 . . . . 0.0 111.834 -175.485 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 0.881 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -54.69 -51.78 75.83 Favored Pre-proline 0 CA--C 1.542 0.643 0 CA-C-O 119.077 -0.487 . . . . 0.0 111.877 178.76 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 0.881 ' HD3' HG13 ' A' ' 952' ' ' VAL . 5.7 Cg_exo -46.4 -49.18 12.15 Favored 'Trans proline' 0 C--N 1.354 0.827 0 C-N-CA 122.522 2.148 . . . . 0.0 113.73 169.492 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.706 ' SD ' ' HG3' ' A' ' 939' ' ' MET . 2.3 tpt -58.47 -49.03 78.8 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.546 0.688 . . . . 0.0 110.233 176.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.884 HG21 ' HG2' ' A' 1002 ' ' MET . 56.8 t -53.37 -33.57 21.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 114.56 -1.2 . . . . 0.0 112.414 171.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 5.7 mptp? -63.36 -31.68 72.9 Favored 'General case' 0 C--N 1.315 -0.901 0 C-N-CA 119.737 -0.785 . . . . 0.0 111.149 173.047 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 957' ' ' GLU . . . . . 0.432 ' O ' ' HB3' ' A' ' 960' ' ' LEU . 45.0 mm-40 -79.76 -42.76 23.85 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.545 0.212 . . . . 0.0 111.506 176.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' ' 954' ' ' MET . 2.0 t -69.42 -33.46 57.55 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 177.639 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -66.1 -37.4 93.03 Favored Glycine 0 N--CA 1.435 -1.401 0 N-CA-C 110.352 -1.099 . . . . 0.0 110.352 173.502 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 960' ' ' LEU . . . . . 0.565 HD12 ' HD3' ' A' ' 963' ' ' ARG . 16.3 tp -62.81 -31.98 73.08 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 115.034 -0.583 . . . . 0.0 110.045 172.538 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.51 ' HB1' ' HB3' ' A' ' 932' ' ' LEU . . . -73.76 -58.54 3.23 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.763 -0.198 . . . . 0.0 110.588 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.535 ' HG ' ' N ' ' A' ' 963' ' ' ARG . 0.1 OUTLIER -39.22 -53.65 1.88 Allowed 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 166.682 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.565 ' HD3' HD12 ' A' ' 960' ' ' LEU . 6.5 ptm180 -67.7 -31.96 72.27 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 119.318 0.963 . . . . 0.0 111.516 -178.111 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 83.5 m -65.96 -35.6 81.04 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 175.401 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.941 HD21 HD11 ' A' 1035 ' ' LEU . 52.9 tp -70.88 -37.76 73.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.52 -1.218 . . . . 0.0 109.63 176.569 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 9.7 tt -68.21 -40.37 82.12 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 114.628 -1.169 . . . . 0.0 108.36 -175.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -70.63 -37.18 73.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.531 -0.759 . . . . 0.0 112.262 178.351 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 7.6 p -66.07 -41.42 90.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 118.802 0.728 . . . . 0.0 110.169 176.628 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.973 HG12 HG23 ' A' ' 984' ' ' ILE . 77.0 t -71.1 -38.58 71.87 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.324 174.619 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.648 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 7.1 t70 -68.01 -41.49 82.16 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.647 0.736 . . . . 0.0 109.045 -178.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.469 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 45.5 tt0 -62.93 -33.37 75.19 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.519 176.8 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.42 ' HB2' ' O ' ' A' ' 969' ' ' VAL . 62.2 m -67.06 -20.03 65.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.184 176.396 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.713 ' HB2' HG21 ' A' ' 984' ' ' ILE . 9.1 tt -68.64 -53.18 16.88 Favored Pre-proline 0 CA--C 1.534 0.352 0 CA-C-O 119.513 -0.28 . . . . 0.0 110.907 -174.192 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.693 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 4.1 Cg_endo -89.29 -2.69 6.06 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 121.766 1.644 . . . . 0.0 113.143 176.647 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 975' ' ' VAL . . . . . . . . . . . . . 20.9 t -86.5 -40.44 14.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.616 175.137 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.413 HD13 ' HB3' ' A' 1043 ' ' ARG . 91.1 mt -73.55 125.21 90.76 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.089 0.471 . . . . 0.0 110.544 177.512 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -81.8 24.11 0.73 Allowed 'Trans proline' 0 C--O 1.233 0.258 0 C-N-CA 123.395 2.73 . . . . 0.0 113.526 -173.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 978' ' ' ALA . . . . . 0.558 ' HB1' ' HB3' ' A' 1046 ' ' MET . . . -125.19 -176.06 3.47 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.568 -177.401 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.575 ' HB2' ' SD ' ' A' 1046 ' ' MET . 18.1 m -80.61 24.49 0.47 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.118 0.485 . . . . 0.0 111.008 -179.621 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.891 HG23 ' HB1' ' A' 1042 ' ' ALA . 23.7 m -63.61 -9.84 15.61 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.625 -178.025 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.455 ' HA ' ' HG ' ' A' ' 973' ' ' LEU . 7.9 p80 -52.98 -32.62 47.29 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -179.525 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 982' ' ' ARG . . . . . 0.546 ' HA ' ' HG2' ' A' ' 985' ' ' GLU . 4.4 ptm180 -83.46 -21.57 32.84 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 120.268 -0.573 . . . . 0.0 111.714 -174.683 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.436 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 0.4 OUTLIER -79.33 -39.88 31.67 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 121.882 0.849 . . . . 0.0 109.232 171.63 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.973 HG23 HG12 ' A' ' 969' ' ' VAL . 75.0 mt -69.02 -33.22 57.75 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 CA-C-N 114.254 -1.339 . . . . 0.0 110.0 -178.334 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 985' ' ' GLU . . . . . 0.546 ' HG2' ' HA ' ' A' ' 982' ' ' ARG . 12.8 pt-20 -71.2 -43.54 67.17 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 119.553 -0.859 . . . . 0.0 109.525 -179.499 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 54.3 tpp -71.3 -43.52 66.94 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 114.583 -1.189 . . . . 0.0 111.344 -172.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.987 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -74.83 -50.09 18.33 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.879 -1.055 . . . . 0.0 112.687 -170.327 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.565 ' O ' ' HB2' ' A' ' 992' ' ' ASN . 23.8 pt20 -60.02 -29.1 68.27 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.972 176.472 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 989' ' ' LYS . . . . . 0.722 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 20.8 tttm -70.03 -39.64 75.66 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.19 172.479 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.463 ' HB3' ' O ' ' A' ' 987' ' ' ALA . 16.7 tp -50.37 -60.54 2.89 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.412 -0.813 . . . . 0.0 112.651 -179.353 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.718 HD22 ' HG ' ' A' 1035 ' ' LEU . 1.6 pt? -73.46 -22.25 60.23 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.584 0.707 . . . . 0.0 110.036 -177.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 992' ' ' ASN . . . . . 0.722 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 48.8 t-20 -51.94 -55.43 20.37 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 114.317 -1.311 . . . . 0.0 110.965 175.363 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 14.6 m -73.16 -31.87 64.51 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.854 -179.234 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.5 -31.73 68.94 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 119.58 -0.848 . . . . 0.0 112.059 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 0.592 ' N ' HD21 ' A' 1028 ' ' LEU . 8.3 tt -71.05 -16.65 62.61 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 122.168 -0.333 . . . . 0.0 110.227 171.187 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -76.81 -24.41 52.79 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 119.854 -0.738 . . . . 0.0 109.901 168.417 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -74.1 -42.93 59.34 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 109.144 -0.688 . . . . 0.0 109.144 171.568 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.645 HD22 HD11 ' A' 1028 ' ' LEU . 0.4 OUTLIER -55.69 -43.48 76.47 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.34 -0.846 . . . . 0.0 111.024 -179.597 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.795 HG12 HG11 ' A' ' 955' ' ' VAL . 75.5 mt -64.45 -43.94 96.98 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.957 -177.016 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 29.1 m-80 -63.8 -33.75 76.38 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.321 0.582 . . . . 0.0 111.856 -178.702 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.977 ' HD3' ' HG2' ' A' 1020 ' ' GLN . 89.7 mttt -82.55 -42.48 18.29 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.539 -174.055 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.884 ' HG2' HG21 ' A' ' 955' ' ' VAL . 0.0 OUTLIER -62.88 -25.48 68.32 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.919 0.866 . . . . 0.0 108.893 176.341 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.615 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 10.4 tptp -71.04 -54.97 9.3 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.432 -168.796 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.773 ' HB3' HD23 ' A' 1013 ' ' LEU . 80.3 mt -70.69 -14.11 62.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.343 179.242 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.76 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -70.5 -50.95 32.46 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 119.704 -0.798 . . . . 0.0 110.002 178.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.68 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.2 pp0? -74.11 -30.4 62.31 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.319 -0.553 . . . . 0.0 112.049 173.576 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.618 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 49.4 mt-30 -50.78 -45.42 59.11 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.524 0.678 . . . . 0.0 110.175 173.165 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.637 ' CD1' HD22 ' A' 1013 ' ' LEU . 73.3 m-85 -121.93 43.58 2.82 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.267 175.675 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1009 ' ' VAL . . . . . 1.087 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 7.7 p -51.92 -29.44 11.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-O 121.79 0.805 . . . . 0.0 110.65 173.256 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1010 ' ' MET . . . . . 0.429 ' HG3' ' OG1' ' A' 1011 ' ' THR . 24.1 ptp -69.04 -5.69 23.46 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.003 -0.999 . . . . 0.0 111.897 176.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1011 ' ' THR . . . . . 0.911 HG22 ' H ' ' A' 1012 ' ' SER . 1.2 m -141.55 -168.45 2.66 Favored 'General case' 0 C--O 1.258 1.544 0 CA-C-O 122.952 1.358 . . . . 0.0 113.98 -172.823 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1012 ' ' SER . . . . . 0.911 ' H ' HG22 ' A' 1011 ' ' THR . 15.5 m -57.72 -32.57 67.53 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 114.2 -1.364 . . . . 0.0 111.899 -175.615 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.773 HD23 ' HB3' ' A' 1004 ' ' LEU . 7.5 mp -49.72 -43.32 47.63 Favored 'General case' 0 CA--C 1.499 -1.006 0 C-N-CA 120.425 -0.51 . . . . 0.0 112.206 172.388 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1014 ' ' GLN . . . . . 1.087 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -56.63 -50.16 72.85 Favored 'General case' 0 N--CA 1.439 -1.016 0 C-N-CA 119.871 -0.731 . . . . 0.0 109.437 -173.533 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 1015 ' ' GLN . . . . . 0.481 ' N ' HE21 ' A' 1014 ' ' GLN . 13.9 pt20 -71.31 -42.15 69.0 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 114.869 -1.059 . . . . 0.0 111.965 -175.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -67.12 -56.31 10.53 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.352 0.596 . . . . 0.0 111.623 179.029 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.76 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 13.8 m-85 -63.93 -33.1 74.95 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 -173.298 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.833 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 42.2 tptt -79.68 -30.8 41.24 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.453 -178.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1019 ' ' LYS . . . . . 0.511 ' O ' HD23 ' A' 1022 ' ' LEU . 1.1 mptm? -70.68 -51.21 29.19 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 173.152 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1020 ' ' GLN . . . . . 0.977 ' HG2' ' HD3' ' A' 1001 ' ' LYS . 8.0 tt0 -50.69 -33.56 23.24 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.761 -1.109 . . . . 0.0 111.206 165.692 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.655 ' HG3' ' HB3' ' A' 1002 ' ' MET . 1.9 tmt? -68.32 -46.82 69.21 Favored 'General case' 0 CA--C 1.512 -0.508 0 O-C-N 122.168 -0.333 . . . . 0.0 110.355 176.557 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1022 ' ' LEU . . . . . 0.682 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -80.47 -7.29 59.11 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 118.857 -1.137 . . . . 0.0 109.595 -179.28 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 84.8 m -83.93 -40.4 18.58 Favored 'General case' 0 C--N 1.333 -0.133 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 174.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.555 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -77.27 -21.13 54.13 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 172.233 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.814 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -85.09 -23.01 28.69 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.401 169.437 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.564 ' O ' HG23 ' A' 1030 ' ' VAL . 16.3 t60 -76.96 -24.84 52.3 Favored 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 166.26 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -73.74 -39.01 64.58 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 123.489 0.716 . . . . 0.0 109.67 165.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.645 HD11 HD22 ' A' ' 998' ' ' LEU . 22.7 mt -60.63 -44.34 96.48 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 168.646 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -59.99 -38.45 82.62 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 111.445 0.165 . . . . 0.0 111.445 173.154 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' 1026 ' ' HIS . 7.8 t -69.93 -50.31 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.166 0 CA-C-O 121.488 0.661 . . . . 0.0 110.071 -178.441 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.469 ' O ' HD12 ' A' 1035 ' ' LEU . 23.8 m-20 -66.63 -38.05 86.11 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 114.687 -1.142 . . . . 0.0 110.496 -178.808 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.661 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -59.76 -42.57 93.57 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.349 173.237 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 50.9 mttp -64.03 -53.14 54.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.665 0.745 . . . . 0.0 110.054 173.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.433 ' O ' HG23 ' A' 1038 ' ' VAL . 9.0 t30 -63.18 -52.18 63.4 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.175 -1.375 . . . . 0.0 111.813 -171.207 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.987 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 0.0 OUTLIER -65.31 -38.0 88.85 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 119.307 -0.378 . . . . 0.0 110.825 -173.204 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.721 ' N ' HD13 ' A' 1035 ' ' LEU . 4.0 pp -72.98 -35.1 66.83 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 116.951 -1.899 . . . . 0.0 109.718 -179.326 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.424 ' N ' HD12 ' A' 1036 ' ' LEU . 38.3 t70 -59.12 -42.86 91.56 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 114.988 -1.006 . . . . 0.0 109.823 174.494 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' 1034 ' ' ASN . 19.6 t -53.9 -42.3 52.77 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.706 0 CA-C-N 113.847 -1.524 . . . . 0.0 111.522 173.903 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.647 ' O ' ' HG2' ' A' 1043 ' ' ARG . 1.7 mp -79.11 -31.11 14.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 118.35 0.523 . . . . 0.0 111.387 177.466 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.444 ' HB3' ' HB ' ' A' ' 919' ' ' ILE . 0.4 OUTLIER -56.83 -50.39 72.53 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.655 0.74 . . . . 0.0 109.511 169.907 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -65.61 -42.93 91.04 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.222 174.475 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.891 ' HB1' HG23 ' A' ' 980' ' ' THR . . . -52.33 -48.46 65.44 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 122.973 0.509 . . . . 0.0 112.37 -175.844 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.682 ' O ' HG12 ' A' 1047 ' ' ILE . 13.4 ptt180 -64.27 -47.76 78.31 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.905 -178.662 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.6 ' HB2' ' CA ' ' A' ' 918' ' ' GLY . 47.5 tp -67.37 -36.57 81.63 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 120.461 -0.496 . . . . 0.0 111.221 178.766 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.661 ' O ' ' HB2' ' A' 1049 ' ' GLN . 1.3 tmtp? -64.84 -48.43 74.35 Favored 'General case' 0 C--O 1.211 -0.969 0 CA-C-O 121.577 0.703 . . . . 0.0 109.878 -179.493 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.575 ' SD ' ' HB2' ' A' ' 979' ' ' SER . 18.8 mmt -68.2 -34.7 76.75 Favored 'General case' 0 C--N 1.297 -1.698 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.74 -177.697 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.682 HG12 ' O ' ' A' 1043 ' ' ARG . 38.2 mm -60.47 -63.33 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.514 171.414 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1048 ' ' SER . . . . . 0.678 ' O ' ' HD2' ' A' 1052 ' ' PRO . 67.2 m -136.63 52.89 1.93 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -172.623 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1049 ' ' GLN . . . . . 0.661 ' HB2' ' O ' ' A' 1045 ' ' LYS . 22.0 tm0? -54.42 -22.38 12.35 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 179.041 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 12.5 t -66.93 -6.33 16.18 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 111.613 0.227 . . . . 0.0 111.613 -177.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1051 ' ' ARG . . . . . 0.875 ' HB2' ' HD3' ' A' 1052 ' ' PRO . 19.5 mmm180 -118.5 -74.32 0.01 OUTLIER Pre-proline 0 CA--C 1.542 0.641 0 CA-C-O 119.076 -0.488 . . . . 0.0 111.452 172.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1052 ' ' PRO . . . . . 0.875 ' HD3' ' HB2' ' A' 1051 ' ' ARG . 93.7 Cg_endo -95.78 170.9 1.23 Allowed 'Trans proline' 0 C--N 1.357 1.018 0 C-N-CA 121.926 1.751 . . . . 0.0 113.338 179.513 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 4.2 m-70 . . . . . 0 N--CA 1.465 0.28 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.845 175.138 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.702 0 N-CA-C 112.023 -0.431 . . . . 0.0 112.023 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 37.3 t -96.93 123.04 54.93 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-O 120.818 0.342 . . . . 0.0 110.487 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -84.72 0.14 9.1 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 122.851 2.367 . . . . 0.0 111.659 175.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -114.72 71.35 0.24 Allowed Glycine 0 N--CA 1.445 -0.736 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.048 -179.467 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 68.7 mt -83.45 106.36 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 178.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 13.1 t -91.27 110.85 22.15 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.462 -176.526 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 88.26 -80.27 1.64 Allowed Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.256 179.291 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 83.93 -32.64 3.19 Favored Glycine 0 CA--C 1.518 0.275 0 C-N-CA 121.155 -0.545 . . . . 0.0 112.541 178.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . 91.9 58.82 1.37 Allowed Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.068 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . -58.79 131.57 52.11 Favored Glycine 0 C--N 1.333 0.415 0 N-CA-C 111.735 -0.546 . . . . 0.0 111.735 177.53 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 918' ' ' GLY . . . . . 0.699 ' HA2' ' HD2' ' A' 1043 ' ' ARG . . . 162.61 169.23 25.7 Favored Glycine 0 C--O 1.225 -0.452 0 C-N-CA 120.162 -1.018 . . . . 0.0 112.791 -171.215 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 919' ' ' ILE . . . . . 0.923 ' HA ' ' CB ' ' A' 1040 ' ' ASP . 40.1 pt -57.99 44.77 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 N-CA-C 115.993 1.849 . . . . 0.0 115.993 -176.57 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 920' ' ' ARG . . . . . . . . . . . . . 39.7 ptt180 -140.11 11.73 2.4 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 121.553 -0.717 . . . . 0.0 111.109 179.179 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 921' ' ' SER . . . . . 0.457 ' H ' ' CG ' ' A' 1040 ' ' ASP . 21.8 m 60.31 25.6 15.07 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 123.013 0.525 . . . . 0.0 111.325 177.174 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 21.6 m-20 39.94 -147.14 0.02 OUTLIER 'General case' 0 C--O 1.233 0.22 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.809 178.117 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.753 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 5.9 p-10 -112.26 -60.2 1.9 Allowed 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.807 ' HB3' HG21 ' A' ' 968' ' ' THR . 11.2 tptm -72.34 -29.88 64.22 Favored 'General case' 0 C--N 1.31 -1.133 0 O-C-N 120.462 -1.399 . . . . 0.0 112.532 -164.131 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.577 HG12 ' HB ' ' A' ' 968' ' ' THR . 14.0 m -65.86 -31.74 55.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 CA-C-O 121.045 0.45 . . . . 0.0 110.421 177.173 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.753 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -77.14 -23.52 51.7 Favored 'General case' 0 CA--C 1.504 -0.797 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 174.525 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.78 -25.27 48.91 Favored 'General case' 0 C--N 1.301 -1.529 0 C-N-CA 120.067 -0.653 . . . . 0.0 111.542 173.354 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.586 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 3.2 m120 -77.16 -30.34 54.96 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 174.226 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.603 HG22 HD21 ' A' ' 932' ' ' LEU . 62.6 t -79.74 -29.52 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.766 175.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.488 ' O ' ' HB3' ' A' ' 934' ' ' LYS . 84.8 m -57.8 -39.97 78.81 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 119.127 0.876 . . . . 0.0 108.642 169.043 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -72.7 -52.52 9.63 Favored Glycine 0 CA--C 1.527 0.812 0 CA-C-N 114.978 -1.01 . . . . 0.0 113.775 177.349 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.603 HD21 HG22 ' A' ' 929' ' ' VAL . 2.1 pp -63.2 -45.43 91.76 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 117.745 0.772 . . . . 0.0 112.706 -176.062 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 61.5 t -65.56 -39.44 85.06 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 CA-C-O 121.253 0.549 . . . . 0.0 110.366 -178.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.488 ' HB3' ' O ' ' A' ' 930' ' ' THR . 1.4 tmtt? -61.08 -35.94 78.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.942 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 0.457 ' HB1' ' SD ' ' A' ' 954' ' ' MET . . . -64.61 -41.98 95.83 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 118.129 0.422 . . . . 0.0 110.801 177.423 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.86 HG22 ' HB1' ' A' 1025 ' ' ALA . 58.0 t -47.63 -73.84 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.974 -179.485 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.416 HG13 ' N ' ' A' ' 938' ' ' GLU . 25.6 pt -65.64 -41.38 90.46 Favored 'Isoleucine or valine' 0 C--O 1.244 0.813 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -177.015 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.538 ' HG2' ' HD2' ' A' ' 942' ' ' LYS . 36.2 tt0 -69.6 -51.89 31.01 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.588 -170.315 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 23.8 mmt -73.71 -27.18 61.08 Favored 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 119.757 -0.777 . . . . 0.0 109.371 -174.145 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.577 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 59.9 p -54.74 -40.64 69.51 Favored 'General case' 0 C--N 1.343 0.288 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.429 -174.611 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 35.8 t -95.27 -15.54 23.1 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.046 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.538 ' HD2' ' HG2' ' A' ' 938' ' ' GLU . 51.2 mttm -83.03 -10.57 58.68 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 119.95 -0.7 . . . . 0.0 110.55 -178.242 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.496 HG13 ' N ' ' A' ' 944' ' ' GLN . 41.7 pt -41.88 -43.45 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 O-C-N 123.547 0.529 . . . . 0.0 112.104 167.597 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.496 ' N ' HG13 ' A' ' 943' ' ' ILE . 58.8 tp60 65.49 114.52 0.03 OUTLIER Pre-proline 0 N--CA 1.465 0.291 0 C-N-CA 123.458 0.703 . . . . 0.0 110.795 -176.039 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.406 ' HB3' HE22 ' A' 1014 ' ' GLN . 58.2 Cg_endo -72.72 69.84 3.55 Favored 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 122.665 2.244 . . . . 0.0 113.458 -176.708 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.87 ' HB3' ' HD3' ' A' ' 947' ' ' PRO . . . -170.47 -59.54 0.0 OUTLIER Pre-proline 0 CA--C 1.534 0.347 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.783 172.826 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.87 ' HD3' ' HB3' ' A' ' 946' ' ' ALA . 86.9 Cg_endo -93.13 141.48 1.9 Allowed 'Trans proline' 0 N--CA 1.451 -1.022 0 C-N-CA 122.397 2.064 . . . . 0.0 111.032 171.243 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.609 ' HA ' HG21 ' A' 1009 ' ' VAL . 11.7 Cg_exo -68.88 132.69 25.33 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 121.714 1.61 . . . . 0.0 112.589 -179.337 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.711 ' HB3' ' CD1' ' A' ' 951' ' ' TYR . 19.8 tt0 -61.22 -15.46 34.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.26 -0.882 . . . . 0.0 108.939 168.316 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.673 ' HB2' ' HG2' ' A' ' 953' ' ' PRO . 7.4 mm-40 74.84 -22.71 0.25 Allowed 'General case' 0 C--N 1.344 0.359 0 CA-C-N 114.756 -1.111 . . . . 0.0 109.647 -169.411 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.8 ' HB3' ' HG3' ' A' 1002 ' ' MET . 1.0 OUTLIER 62.5 -46.65 0.18 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.533 1.133 . . . . 0.0 112.936 174.441 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 0.615 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 23.8 t -53.41 -45.4 98.51 Favored Pre-proline 0 C--N 1.323 -0.563 0 C-N-CA 123.151 0.58 . . . . 0.0 111.608 171.047 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 0.673 ' HG2' ' HB2' ' A' ' 950' ' ' GLU . 38.4 Cg_exo -51.58 -39.42 65.52 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.186 1.924 . . . . 0.0 112.53 174.029 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.457 ' SD ' ' HB1' ' A' ' 935' ' ' ALA . 5.3 tpt -73.96 -36.41 64.59 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.762 175.073 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.605 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 71.2 t -52.67 -40.74 35.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.794 168.166 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.4 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 3.1 tmtm? -66.59 -33.02 74.73 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.597 175.627 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 957' ' ' GLU . . . . . 0.434 ' HB3' ' HA ' ' A' ' 954' ' ' MET . 7.0 tp10 -77.55 -45.81 24.24 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 121.002 0.429 . . . . 0.0 111.01 -174.278 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.498 HG11 HD21 ' A' ' 998' ' ' LEU . 14.6 p -87.05 -27.53 5.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.618 -178.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -63.82 -38.91 96.84 Favored Glycine 0 N--CA 1.447 -0.567 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 173.554 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 960' ' ' LEU . . . . . 0.467 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 17.0 tp -63.11 -38.26 90.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.279 -0.46 . . . . 0.0 109.893 174.264 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.463 ' HB1' ' HB3' ' A' ' 932' ' ' LEU . . . -70.3 -40.76 74.06 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.706 -176.154 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.596 HD13 HD12 ' A' ' 991' ' ' LEU . 0.2 OUTLIER -67.74 -44.16 78.23 Favored 'General case' 0 C--O 1.217 -0.644 0 CA-C-O 118.782 -0.627 . . . . 0.0 111.437 173.423 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.467 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 6.1 ptp180 -64.85 -31.68 73.03 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 120.187 1.358 . . . . 0.0 110.457 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 964' ' ' THR . . . . . 0.483 HG22 ' ND2' ' A' ' 928' ' ' ASN . 30.4 m -69.33 -39.11 78.39 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 176.602 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 1.0 HD11 HD21 ' A' 1036 ' ' LEU . 37.5 tp -62.79 -44.11 97.04 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.559 -1.2 . . . . 0.0 109.949 175.179 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 0.745 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.5 tt -68.2 -35.22 77.66 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.318 -0.856 . . . . 0.0 109.119 -172.861 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -69.81 -43.48 71.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.815 178.322 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.807 HG21 ' HB3' ' A' ' 924' ' ' LYS . 4.6 m -64.41 -41.11 96.8 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 119.843 -0.743 . . . . 0.0 110.134 178.321 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.736 HG12 HG23 ' A' ' 984' ' ' ILE . 43.6 t -67.65 -38.09 79.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.178 173.473 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 970' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -66.73 -38.61 87.01 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 122.21 1.005 . . . . 0.0 108.696 -178.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.448 ' C ' ' HD2' ' A' ' 974' ' ' PRO . 28.1 tt0 -76.01 -21.94 56.34 Favored 'General case' 0 N--CA 1.437 -1.106 0 CA-C-N 113.964 -1.471 . . . . 0.0 110.128 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.588 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 52.7 m -72.08 -17.67 61.98 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.708 171.651 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.828 ' HA ' HD13 ' A' ' 984' ' ' ILE . 9.4 tt -66.04 -51.0 48.95 Favored Pre-proline 0 CA--C 1.53 0.176 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 179.736 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.536 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 95.0 Cg_endo -81.97 -2.44 11.3 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 120.964 1.109 . . . . 0.0 113.546 171.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.727 HG12 HD13 ' A' ' 976' ' ' LEU . 0.3 OUTLIER -73.06 -32.16 38.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.691 178.351 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.727 HD13 HG12 ' A' ' 975' ' ' VAL . 0.0 OUTLIER -108.91 158.26 34.67 Favored Pre-proline 0 CA--C 1.53 0.194 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 169.27 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -80.46 99.21 1.13 Allowed 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 122.866 2.377 . . . . 0.0 113.625 -176.179 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . 68.94 -77.58 0.05 Allowed 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 167.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.407 ' HB3' ' HB3' ' A' 1046 ' ' MET . 4.7 m -38.34 -55.31 1.36 Allowed 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 114.776 1.399 . . . . 0.0 114.776 -165.251 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.526 ' HB ' ' CD2' ' A' ' 976' ' ' LEU . 15.8 m -70.42 -8.53 51.61 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -172.369 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.656 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 2.0 p-80 -51.82 -34.85 42.12 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -175.542 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -82.22 -21.03 36.56 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.116 0.871 . . . . 0.0 111.94 -171.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.586 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 0.4 OUTLIER -77.77 -33.81 52.55 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.386 0.612 . . . . 0.0 109.723 169.615 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.838 HG12 HG12 ' A' 1039 ' ' ILE . 69.3 mt -70.8 -30.28 41.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 CA-C-N 114.889 -1.05 . . . . 0.0 108.469 179.319 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 985' ' ' GLU . . . . . 0.656 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 45.9 mt-10 -63.97 -54.47 34.01 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.302 174.729 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 986' ' ' MET . . . . . 0.577 ' HA ' ' HD2' ' A' ' 989' ' ' LYS . 75.2 mtp -70.61 -41.52 72.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.789 -170.736 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.953 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -65.24 -50.81 64.38 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.19 -0.914 . . . . 0.0 112.167 -173.713 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.745 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 24.5 pt20 -61.83 -28.2 69.31 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 120.452 -0.499 . . . . 0.0 111.074 178.528 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 989' ' ' LYS . . . . . 0.662 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 55.9 mttm -70.0 -43.42 71.45 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.449 0.643 . . . . 0.0 111.182 173.418 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.708 HD23 ' HB3' ' A' 1035 ' ' LEU . 7.7 tp -50.52 -60.08 3.38 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 114.694 -1.139 . . . . 0.0 112.539 -176.647 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.625 ' HB2' ' CD2' ' A' 1035 ' ' LEU . 0.4 OUTLIER -63.9 -33.49 75.83 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 121.398 0.618 . . . . 0.0 109.401 179.643 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 992' ' ' ASN . . . . . 0.662 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 44.7 t-20 -52.44 -51.89 56.88 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.584 -1.189 . . . . 0.0 110.546 177.814 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 993' ' ' SER . . . . . 0.489 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 32.7 t -75.01 -42.44 57.4 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.464 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.54 -36.31 80.23 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.971 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 0.639 ' HG ' HD23 ' A' ' 998' ' ' LEU . 8.1 tt -73.18 -19.75 61.04 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 122.198 -0.314 . . . . 0.0 110.617 172.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -75.0 -25.55 58.9 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 119.841 -0.744 . . . . 0.0 109.788 168.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.56 ' O ' ' HG2' ' A' 1001 ' ' LYS . 4.6 mm-40 -75.43 -40.16 57.98 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 172.15 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.826 HD13 ' HB2' ' A' 1025 ' ' ALA . 0.2 OUTLIER -56.18 -47.01 79.13 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.325 177.917 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.525 HG13 ' O ' ' A' ' 995' ' ' LEU . 95.8 mt -64.73 -42.12 94.1 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.575 -174.545 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 14.5 m-80 -59.49 -39.41 83.69 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.345 0.593 . . . . 0.0 111.856 -178.677 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.56 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 69.5 mmtt -77.96 -37.61 47.12 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 122.097 0.951 . . . . 0.0 108.739 -177.028 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.878 ' HB2' ' HG3' ' A' 1021 ' ' MET . 1.7 ttp -61.64 -28.71 69.57 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 114.061 -1.427 . . . . 0.0 109.179 175.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.47 ' O ' ' HG3' ' A' 1006 ' ' GLN . 2.9 tptm -73.76 -47.03 42.03 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.948 -167.661 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.872 HD13 ' HG3' ' A' 1007 ' ' GLN . 3.8 mm? -77.5 -13.56 59.89 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.102 179.609 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.834 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -75.38 -32.21 60.72 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 119.443 -0.903 . . . . 0.0 110.61 -177.853 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.719 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 5.2 pp0? -75.13 -33.27 61.54 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 118.867 -0.587 . . . . 0.0 110.961 165.406 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.872 ' HG3' HD13 ' A' 1004 ' ' LEU . 13.7 mm100 -48.33 -44.12 33.88 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.126 0.488 . . . . 0.0 110.497 176.245 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.884 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 28.6 m-85 -130.01 47.4 2.51 Favored 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 120.014 -0.674 . . . . 0.0 111.074 170.027 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1009 ' ' VAL . . . . . 1.029 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 7.2 p -50.95 -24.47 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 CA-C-O 121.945 0.878 . . . . 0.0 109.599 167.293 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 16.4 mmt -48.68 -44.6 38.05 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 113.838 -1.528 . . . . 0.0 110.922 175.575 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 2.6 p -154.98 -101.9 0.04 OUTLIER 'General case' 0 C--O 1.251 1.182 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 -177.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 16.4 p -57.67 -64.02 1.04 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-N 114.552 -1.204 . . . . 0.0 112.881 -164.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.884 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 4.6 mp -45.99 -42.94 13.75 Favored 'General case' 0 CA--C 1.5 -0.98 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1014 ' ' GLN . . . . . 1.029 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 1.0 OUTLIER -55.03 -47.77 74.29 Favored 'General case' 0 N--CA 1.438 -1.042 0 O-C-N 123.866 0.729 . . . . 0.0 110.345 -168.499 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A 1015 ' ' GLN . . . . . 0.614 ' O ' ' HD3' ' A' 1019 ' ' LYS . 97.8 mt-30 -69.37 -51.57 35.42 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.08 -177.458 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -64.35 -48.0 77.19 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.36 0.6 . . . . 0.0 111.188 -176.559 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.834 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 7.2 m-85 -68.24 -37.52 80.87 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.258 -0.883 . . . . 0.0 113.139 -173.393 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.6 ' HD3' ' CE2' ' A' ' 951' ' ' TYR . 47.1 tptt -80.96 -28.42 35.68 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.3 -176.727 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1019 ' ' LYS . . . . . 0.614 ' HD3' ' O ' ' A' 1015 ' ' GLN . 5.6 mptp? -73.32 -53.27 11.21 Favored 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 174.091 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1020 ' ' GLN . . . . . 0.478 ' HG2' ' HG3' ' A' 1001 ' ' LYS . 55.6 tt0 -50.56 -32.01 17.35 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.809 164.467 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.878 ' HG3' ' HB2' ' A' 1002 ' ' MET . 2.4 ttp -68.69 -50.66 49.18 Favored 'General case' 0 CA--C 1.514 -0.417 0 O-C-N 122.333 -0.23 . . . . 0.0 110.621 176.892 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1022 ' ' LEU . . . . . 0.762 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -84.9 -9.41 58.13 Favored 'General case' 0 C--O 1.219 -0.553 0 C-N-CA 119.629 -0.829 . . . . 0.0 110.317 -174.035 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 52.4 m -83.34 -34.8 25.57 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 171.409 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.53 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -78.28 -21.85 49.14 Favored 'General case' 0 C--O 1.223 -0.319 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 171.018 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.86 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -85.64 -23.38 27.52 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.176 170.187 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.582 ' O ' HG23 ' A' 1030 ' ' VAL . 46.9 t-80 -75.77 -24.58 56.03 Favored 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 165.345 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1027 ' ' ALA . . . . . 0.53 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -70.68 -38.88 73.78 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 123.53 0.732 . . . . 0.0 109.654 164.236 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.635 HD11 HD22 ' A' ' 998' ' ' LEU . 21.6 mt -60.95 -47.21 87.49 Favored 'General case' 0 C--N 1.314 -0.939 0 C-N-CA 120.191 -0.604 . . . . 0.0 109.495 169.681 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -57.74 -40.92 80.79 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 111.366 0.135 . . . . 0.0 111.366 173.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.582 HG23 ' O ' ' A' 1026 ' ' HIS . 16.1 t -70.18 -52.17 32.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-O 121.232 0.539 . . . . 0.0 110.711 -177.093 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.74 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 5.7 m-20 -77.27 -29.14 53.75 Favored 'General case' 0 C--O 1.214 -0.783 0 CA-C-N 115.441 -0.8 . . . . 0.0 112.746 -174.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.594 ' O ' ' HG ' ' A' 1036 ' ' LEU . . . -66.51 -32.68 74.18 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 170.105 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.503 ' HB3' ' O ' ' A' 1030 ' ' VAL . 22.9 tttm -64.96 -51.24 62.88 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 122.078 0.942 . . . . 0.0 109.098 168.102 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.74 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 32.4 t30 -61.58 -52.11 65.75 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 113.396 -1.729 . . . . 0.0 112.572 -173.399 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.953 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 1.5 pp -62.45 -37.95 87.89 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 118.941 -0.552 . . . . 0.0 110.23 -176.187 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1036 ' ' LEU . . . . . 1.0 HD21 HD11 ' A' ' 965' ' ' LEU . 19.9 mt -66.95 -45.86 76.48 Favored 'General case' 0 C--O 1.224 -0.279 0 C-N-CA 116.809 -1.956 . . . . 0.0 108.785 176.795 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.484 ' HB3' ' O ' ' A' 1034 ' ' ASN . 28.3 t70 -50.19 -40.79 48.07 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 114.46 -1.245 . . . . 0.0 111.038 175.273 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.522 ' HB ' ' O ' ' A' 1035 ' ' LEU . 24.2 t -53.33 -51.09 43.84 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.692 0 CA-C-N 114.267 -1.333 . . . . 0.0 111.66 173.015 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.838 HG12 HG12 ' A' ' 984' ' ' ILE . 3.0 mp -72.4 -33.08 44.58 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.428 0 CA-C-N 118.917 0.78 . . . . 0.0 110.738 176.792 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.923 ' CB ' ' HA ' ' A' ' 919' ' ' ILE . 90.1 m-20 -52.88 -52.59 56.92 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 122.317 1.056 . . . . 0.0 109.343 173.533 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -75.61 -35.72 60.45 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.524 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.654 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -53.96 -50.05 67.37 Favored 'General case' 0 CA--C 1.499 -0.994 0 C-N-CA 123.465 0.706 . . . . 0.0 111.998 -178.79 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.703 ' HD3' ' N ' ' A' 1044 ' ' LEU . 0.1 OUTLIER -62.2 -41.09 98.04 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -177.394 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.703 ' N ' ' HD3' ' A' 1043 ' ' ARG . 50.7 tp -74.51 -39.17 62.58 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 121.52 0.676 . . . . 0.0 110.319 -177.559 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.446 ' N ' ' HD2' ' A' 1053 ' ' HIS . 28.7 tttt -64.56 -44.78 89.68 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 114.877 -1.056 . . . . 0.0 110.793 179.221 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.407 ' HB3' ' HB3' ' A' ' 979' ' ' SER . 14.2 mmt -66.87 -35.56 80.31 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.748 179.077 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.687 HG12 ' O ' ' A' 1043 ' ' ARG . 20.6 mm -51.38 -48.49 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.368 172.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 66.3 m -144.87 65.42 1.27 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 111.592 0.219 . . . . 0.0 111.592 -177.183 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -68.63 -21.44 64.48 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.651 178.086 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 5.2 m -77.23 4.04 11.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.289 0.566 . . . . 0.0 110.518 177.751 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1051 ' ' ARG . . . . . 0.466 ' HG3' ' HD2' ' A' 1052 ' ' PRO . 16.9 tpt180 -135.1 146.37 58.13 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 175.163 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1052 ' ' PRO . . . . . 0.466 ' HD2' ' HG3' ' A' 1051 ' ' ARG . 74.1 Cg_exo -49.69 115.88 2.05 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 121.963 1.775 . . . . 0.0 112.113 177.208 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1053 ' ' HIS . . . . . 0.446 ' HD2' ' N ' ' A' 1045 ' ' LYS . 8.0 t-80 . . . . . 0 C--N 1.333 -0.111 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.754 -178.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.699 0 N-CA-C 111.453 -0.659 . . . . 0.0 111.453 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 38.0 m 69.56 127.43 0.03 OUTLIER Pre-proline 0 CA--C 1.53 0.211 0 CA-C-O 121.26 0.552 . . . . 0.0 111.484 178.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.98 47.15 2.13 Favored 'Trans proline' 0 CA--C 1.53 0.315 0 C-N-CA 122.931 2.421 . . . . 0.0 112.128 178.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . 118.05 -116.5 3.46 Favored Glycine 0 N--CA 1.444 -0.817 0 N-CA-C 111.099 -0.8 . . . . 0.0 111.099 -176.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 44.5 mm 65.79 102.23 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.324 0 C-N-CA 122.89 0.476 . . . . 0.0 111.117 178.412 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 39.7 p 48.58 38.84 12.02 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.648 -178.223 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . -83.7 -0.61 89.92 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 121.111 -0.566 . . . . 0.0 112.536 -179.36 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . -109.42 143.89 16.54 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.071 178.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . 81.66 23.57 57.81 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 121.034 -0.603 . . . . 0.0 112.608 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . -124.44 117.64 3.14 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.283 -179.474 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 918' ' ' GLY . . . . . 0.62 ' CA ' ' HG ' ' A' 1044 ' ' LEU . . . 84.5 170.37 46.83 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.871 -0.68 . . . . 0.0 113.247 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 919' ' ' ILE . . . . . 0.626 HG23 ' HB3' ' A' 1040 ' ' ASP . 3.2 mp -61.19 118.01 3.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 C-N-CA 123.254 0.622 . . . . 0.0 109.968 175.265 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 920' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -171.29 46.2 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.702 -169.199 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 7.7 t -114.59 145.68 41.68 Favored 'General case' 0 C--N 1.321 -0.64 0 O-C-N 121.602 -0.687 . . . . 0.0 110.993 178.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -148.74 85.08 1.48 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.27 -0.877 . . . . 0.0 108.942 175.017 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.658 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 5.0 p-10 -125.31 -157.44 0.78 Allowed 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.336 -171.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.571 ' HB2' HG21 ' A' ' 968' ' ' THR . 68.2 mmtt -54.28 -31.72 54.48 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -174.693 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.61 ' O ' HG23 ' A' ' 929' ' ' VAL . 34.0 m -57.51 -32.52 41.99 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.36 0 CA-C-O 121.164 0.507 . . . . 0.0 110.494 175.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.658 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.1 OUTLIER -74.56 -41.72 60.04 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.337 -179.738 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 927' ' ' GLU . . . . . 0.475 ' HG2' ' HA ' ' A' ' 924' ' ' LYS . 10.8 pt-20 -76.59 -25.6 54.12 Favored 'General case' 0 C--N 1.317 -0.807 0 C-N-CA 119.175 -1.01 . . . . 0.0 111.342 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -66.17 -28.59 68.89 Favored 'General case' 0 C--N 1.319 -0.754 0 O-C-N 121.651 -0.655 . . . . 0.0 110.346 167.528 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.616 HG22 ' HB1' ' A' 1032 ' ' ALA . 69.2 t -79.23 -34.9 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.312 172.535 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.466 HG22 ' O ' ' A' ' 927' ' ' GLU . 1.3 t -67.99 -30.43 69.69 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 120.369 1.44 . . . . 0.0 108.275 173.151 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -73.17 -53.11 8.02 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-N 115.398 -0.819 . . . . 0.0 113.084 174.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.456 ' CD2' ' HA ' ' A' ' 929' ' ' VAL . 0.9 OUTLIER -65.79 -49.69 67.4 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -178.414 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.421 ' O ' ' HB ' ' A' ' 936' ' ' VAL . 72.6 t -68.59 -32.39 54.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 CA-C-O 121.185 0.517 . . . . 0.0 110.733 -174.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 934' ' ' LYS . . . . . . . . . . . . . 24.7 ttpt -61.99 -45.96 91.33 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.084 176.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 0.462 ' O ' ' HB2' ' A' ' 939' ' ' MET . . . -56.38 -35.33 67.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.464 0.173 . . . . 0.0 111.366 176.557 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.856 HG22 ' HB1' ' A' 1025 ' ' ALA . 57.8 t -52.79 -74.95 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.696 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 23.5 pt -74.74 -42.64 47.55 Favored 'Isoleucine or valine' 0 C--O 1.245 0.851 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -175.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.434 ' HG2' ' HD3' ' A' ' 942' ' ' LYS . 31.5 tt0 -64.9 -51.41 62.06 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.383 0.611 . . . . 0.0 109.99 -171.409 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.598 ' HA ' ' HG2' ' A' ' 942' ' ' LYS . 65.4 mtt -73.55 -25.49 60.41 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.254 -178.211 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.748 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 32.6 p -52.75 -38.73 61.37 Favored 'General case' 0 C--N 1.347 0.468 0 O-C-N 123.797 0.686 . . . . 0.0 111.346 -173.64 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 10.9 p -106.93 -24.98 11.84 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -176.3 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.598 ' HG2' ' HA ' ' A' ' 939' ' ' MET . 60.5 pttt -83.26 -45.38 13.89 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 119.012 -1.075 . . . . 0.0 112.625 -165.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 1.052 ' HB ' ' HG3' ' A' ' 949' ' ' GLU . 5.1 mt -78.52 -1.11 3.9 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 N-CA-C 112.713 0.634 . . . . 0.0 112.713 -175.505 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.439 ' HB3' ' HD3' ' A' ' 945' ' ' PRO . 34.7 tt0 -62.56 -43.68 84.82 Favored Pre-proline 0 CA--C 1.541 0.616 0 N-CA-C 113.496 0.924 . . . . 0.0 113.496 -175.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.561 ' HD2' ' O ' ' A' ' 942' ' ' LYS . 42.6 Cg_exo -58.63 -20.73 51.84 Favored 'Trans proline' 0 C--N 1.356 0.973 0 C-N-CA 121.994 1.796 . . . . 0.0 112.562 174.43 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.685 ' HB1' ' HD2' ' A' ' 947' ' ' PRO . . . -91.06 179.18 1.51 Allowed Pre-proline 0 C--N 1.322 -0.606 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 176.619 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.685 ' HD2' ' HB1' ' A' ' 946' ' ' ALA . 87.7 Cg_exo -43.96 131.73 8.28 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 121.975 1.783 . . . . 0.0 111.544 170.525 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 1.011 ' HG3' HG11 ' A' 1009 ' ' VAL . 32.5 Cg_exo -19.66 65.73 0.0 OUTLIER 'Trans proline' 0 C--N 1.357 1.019 1 C-N-CA 127.644 5.562 . . . . 0.0 116.561 -167.758 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 1.052 ' HG3' ' HB ' ' A' ' 943' ' ' ILE . 0.4 OUTLIER 47.57 -0.09 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -168.314 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.78 ' HB3' ' HG2' ' A' ' 953' ' ' PRO . 42.7 mt-10 45.51 63.25 1.85 Allowed 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 -158.782 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.959 ' HB3' ' HG3' ' A' 1002 ' ' MET . 20.2 m-85 -51.31 -50.8 58.67 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.509 -176.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 0.802 ' O ' ' HB ' ' A' ' 955' ' ' VAL . 25.3 t -63.49 -48.4 81.51 Favored Pre-proline 0 C--N 1.324 -0.511 0 O-C-N 122.49 -0.131 . . . . 0.0 110.863 178.604 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 0.78 ' HG2' ' HB3' ' A' ' 950' ' ' GLU . 25.7 Cg_exo -50.6 -40.0 55.47 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 121.928 1.752 . . . . 0.0 112.806 166.808 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.559 ' HE1' ' HG2' ' A' ' 949' ' ' GLU . 36.9 ttm -67.33 -31.92 72.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.034 0.445 . . . . 0.0 110.235 175.752 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.802 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 49.7 t -52.59 -39.12 28.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.087 168.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.632 ' HD3' ' HA ' ' A' ' 953' ' ' PRO . 12.8 mptt -64.82 -36.4 84.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.592 0.234 . . . . 0.0 111.293 172.799 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -78.87 -46.93 17.53 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.768 0.318 . . . . 0.0 111.773 -172.404 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.6 HG22 HD23 ' A' ' 962' ' ' LEU . 14.5 p -80.75 -32.01 12.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 179.214 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -59.72 -42.84 98.13 Favored Glycine 0 N--CA 1.446 -0.674 0 N-CA-C 110.719 -0.953 . . . . 0.0 110.719 174.134 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 960' ' ' LEU . . . . . 0.569 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 7.7 tt -67.39 -41.35 85.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.822 0.344 . . . . 0.0 110.305 177.519 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -66.97 -43.45 83.05 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.063 0.459 . . . . 0.0 111.689 -174.647 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.774 HD13 HD22 ' A' ' 995' ' ' LEU . 4.0 pp -84.94 -26.47 27.18 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.01 -178.674 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.613 ' HG3' ' N ' ' A' ' 964' ' ' THR . 8.6 ptt180 -66.82 -39.08 87.56 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 118.656 -1.218 . . . . 0.0 109.606 171.149 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 964' ' ' THR . . . . . 0.613 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 12.5 m -64.67 -31.51 72.76 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.742 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.724 HD23 HD22 ' A' ' 991' ' ' LEU . 54.2 tp -63.44 -51.43 65.75 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 121.561 0.695 . . . . 0.0 109.541 173.436 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 0.758 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.3 tt -63.36 -37.81 88.73 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 114.52 -1.218 . . . . 0.0 109.081 -175.114 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 967' ' ' ALA . . . . . 0.493 ' HA ' ' HB3' ' A' ' 970' ' ' ASP . . . -74.37 -28.66 61.22 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.667 179.545 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.571 HG21 ' HB2' ' A' ' 924' ' ' LYS . 31.4 m -72.0 -32.53 67.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 119.19 0.905 . . . . 0.0 109.214 171.759 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.667 HG12 HG23 ' A' ' 984' ' ' ILE . 71.3 t -71.35 -40.1 72.79 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.166 171.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.493 ' HB3' ' HA ' ' A' ' 967' ' ' ALA . 24.8 t70 -69.23 -38.65 78.63 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 122.033 0.921 . . . . 0.0 108.572 -179.587 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.645 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 6.8 tp10 -63.78 -35.34 80.26 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.583 174.398 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.443 ' HB2' ' O ' ' A' ' 969' ' ' VAL . 64.8 m -64.9 -17.93 64.75 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.12 174.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.76 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 2.4 tm? -66.18 -53.07 34.78 Favored Pre-proline 0 CA--C 1.537 0.456 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -176.51 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.76 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 94.0 Cg_endo -91.31 -19.31 0.88 Allowed 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 121.236 1.291 . . . . 0.0 114.23 174.275 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 975' ' ' VAL . . . . . . . . . . . . . 3.4 t -60.26 -44.27 95.23 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 CA-C-N 118.019 0.372 . . . . 0.0 110.666 177.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.414 HD12 ' HD2' ' A' ' 977' ' ' PRO . 33.8 tp -97.47 106.76 34.85 Favored Pre-proline 0 N--CA 1.447 -0.579 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 173.495 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 0.414 ' HD2' HD12 ' A' ' 976' ' ' LEU . 72.6 Cg_endo -75.75 31.22 0.38 Allowed 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 123.214 2.609 . . . . 0.0 112.765 -176.341 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -109.13 174.66 5.77 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.951 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.665 ' HB2' ' SD ' ' A' 1046 ' ' MET . 7.2 m -76.53 15.82 0.57 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.227 0.537 . . . . 0.0 111.32 -178.208 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.84 HG23 ' HB1' ' A' 1042 ' ' ALA . 55.1 m -60.35 -18.77 52.32 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 121.366 0.603 . . . . 0.0 110.1 173.209 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.499 ' HA ' HD12 ' A' ' 984' ' ' ILE . 1.7 p-80 -52.56 -25.7 11.23 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 114.816 -1.083 . . . . 0.0 113.825 -176.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 982' ' ' ARG . . . . . 0.669 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 0.0 OUTLIER -84.37 -20.16 32.42 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.396 -0.815 . . . . 0.0 111.6 -177.409 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.558 ' CB ' ' HB2' ' A' 1042 ' ' ALA . 0.3 OUTLIER -78.5 -34.96 47.04 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.808 0.813 . . . . 0.0 109.157 168.912 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.667 HG23 HG12 ' A' ' 969' ' ' VAL . 70.4 mt -69.58 -30.13 44.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 114.459 -1.246 . . . . 0.0 109.31 179.459 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 985' ' ' GLU . . . . . 0.669 ' HG3' ' O ' ' A' ' 982' ' ' ARG . 2.4 pp20? -70.37 -44.01 68.95 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 121.494 0.664 . . . . 0.0 109.923 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 24.9 ttt -72.09 -42.78 65.76 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.474 -173.196 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.95 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -74.44 -51.77 13.94 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.984 -1.007 . . . . 0.0 112.488 -170.31 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.758 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 28.9 pt20 -61.87 -23.15 66.11 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.277 177.187 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 989' ' ' LYS . . . . . 0.8 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 15.1 tttt -73.07 -37.24 66.87 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.887 171.654 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.632 HD23 ' OD1' ' A' 1031 ' ' ASP . 15.7 tp -60.37 -57.73 11.5 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 119.616 -0.833 . . . . 0.0 111.89 179.128 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.724 HD22 HD23 ' A' ' 965' ' ' LEU . 11.6 tp -53.42 -33.95 55.93 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.475 0.655 . . . . 0.0 110.162 175.808 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 992' ' ' ASN . . . . . 0.8 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 24.6 t-20 -50.04 -53.84 24.22 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.065 -1.425 . . . . 0.0 111.426 -179.417 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 20.0 m -79.57 -26.79 41.27 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 179.493 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.64 -44.03 75.02 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.569 -0.852 . . . . 0.0 111.011 178.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 0.774 HD22 HD13 ' A' ' 962' ' ' LEU . 0.8 OUTLIER -66.02 -21.93 66.42 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 123.179 0.591 . . . . 0.0 110.478 172.405 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -75.91 -26.16 56.7 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 119.171 -1.012 . . . . 0.0 110.009 171.689 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -75.38 -43.38 50.59 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 171.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.887 HD22 HD11 ' A' 1028 ' ' LEU . 0.1 OUTLIER -56.37 -48.1 77.54 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.316 -0.857 . . . . 0.0 111.742 -177.683 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.74 HD12 HG13 ' A' ' 955' ' ' VAL . 47.5 mm -69.65 -37.76 74.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.455 -175.018 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 11.7 m-80 -63.66 -36.1 82.73 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 121.126 0.489 . . . . 0.0 111.83 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.586 ' HD3' ' HB3' ' A' 1020 ' ' GLN . 35.2 mttp -82.47 -35.34 27.56 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.477 0.656 . . . . 0.0 110.453 -176.499 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.959 ' HG3' ' HB3' ' A' ' 951' ' ' TYR . 15.2 tpp -60.42 -29.45 69.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 122.423 1.106 . . . . 0.0 108.514 173.406 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1003 ' ' LYS . . . . . . . . . . . . . 2.7 tptm -73.69 -52.66 12.54 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 113.865 -1.516 . . . . 0.0 111.04 -167.02 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.733 ' HA ' ' HB2' ' A' 1007 ' ' GLN . 7.8 mp -76.8 -13.43 60.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.731 -178.393 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.737 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -69.12 -44.58 72.08 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 119.317 -0.953 . . . . 0.0 109.434 179.348 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.78 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 2.9 pp0? -71.86 -34.03 68.89 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 120.127 -0.629 . . . . 0.0 111.435 170.134 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.733 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 51.8 mt-30 -47.14 -48.95 23.19 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.993 0.425 . . . . 0.0 110.901 176.838 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.832 ' HB2' HD13 ' A' 1013 ' ' LEU . 89.0 m-85 -125.15 47.75 2.12 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.191 -0.603 . . . . 0.0 110.529 171.465 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1009 ' ' VAL . . . . . 1.038 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 12.5 p -51.76 -22.04 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 115.087 -0.961 . . . . 0.0 110.434 171.366 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1010 ' ' MET . . . . . 0.469 ' O ' HG23 ' A' 1011 ' ' THR . 22.7 mmt -41.67 -36.61 1.0 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.402 -1.272 . . . . 0.0 111.961 176.117 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1011 ' ' THR . . . . . 0.469 HG23 ' O ' ' A' 1010 ' ' MET . 0.2 OUTLIER -167.7 -92.42 0.01 OUTLIER 'General case' 0 C--O 1.246 0.911 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 176.522 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 12.2 m -53.1 -64.62 0.76 Allowed 'General case' 0 C--O 1.237 0.408 0 CA-C-N 114.571 -1.195 . . . . 0.0 113.311 -164.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.832 HD13 ' HB2' ' A' 1008 ' ' TYR . 4.1 mp -52.7 -40.28 62.81 Favored 'General case' 0 CA--C 1.496 -1.099 0 O-C-N 123.25 0.343 . . . . 0.0 111.365 -177.714 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1014 ' ' GLN . . . . . 1.038 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 1.3 tt0 -54.09 -48.33 70.8 Favored 'General case' 0 N--CA 1.44 -0.93 0 O-C-N 123.639 0.587 . . . . 0.0 110.506 -168.206 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1015 ' ' GLN . . . . . 0.539 ' O ' ' HD3' ' A' 1019 ' ' LYS . 92.7 mt-30 -71.39 -47.92 53.18 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 120.343 -0.543 . . . . 0.0 111.605 -179.076 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -67.5 -56.33 9.98 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.148 0.499 . . . . 0.0 111.25 -176.495 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.737 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 10.3 m-85 -56.46 -38.6 71.89 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.283 -177.148 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.915 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 22.9 tptm -80.01 -30.89 39.68 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 114.865 -1.061 . . . . 0.0 110.808 -177.194 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1019 ' ' LYS . . . . . 0.539 ' HD3' ' O ' ' A' 1015 ' ' GLN . 1.6 mptm? -70.87 -52.88 17.52 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 174.302 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1020 ' ' GLN . . . . . 0.586 ' HB3' ' HD3' ' A' 1001 ' ' LYS . 98.2 mt-30 -50.79 -32.86 21.21 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.107 164.792 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.49 ' SD ' HD12 ' A' ' 998' ' ' LEU . 10.7 tmm? -65.73 -50.73 63.74 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 177.398 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1022 ' ' LEU . . . . . 0.77 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -81.08 -5.01 57.14 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 119.301 -0.96 . . . . 0.0 109.707 -177.023 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 87.4 m -88.21 -35.9 17.08 Favored 'General case' 0 C--O 1.223 -0.306 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 173.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.555 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -77.76 -21.73 51.31 Favored 'General case' 0 C--O 1.22 -0.478 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 170.705 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.856 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -85.34 -24.09 27.77 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.368 169.139 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.614 ' O ' HG23 ' A' 1030 ' ' VAL . 28.4 t60 -76.97 -24.14 52.3 Favored 'General case' 0 C--O 1.215 -0.743 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 166.095 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1027 ' ' ALA . . . . . 0.459 ' HA ' ' HB ' ' A' 1030 ' ' VAL . . . -73.23 -39.81 65.18 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 123.88 0.872 . . . . 0.0 109.875 165.068 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.887 HD11 HD22 ' A' ' 998' ' ' LEU . 39.7 mt -59.68 -45.11 93.07 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 168.237 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -61.45 -34.88 76.17 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.592 0.234 . . . . 0.0 111.41 173.492 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.614 HG23 ' O ' ' A' 1026 ' ' HIS . 4.3 t -66.85 -50.33 66.16 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -179.49 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.773 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 34.2 t70 -74.55 -28.4 60.94 Favored 'General case' 0 C--O 1.206 -1.212 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.424 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.616 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -55.16 -45.59 75.71 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 171.629 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.426 ' O ' ' HB2' ' A' 1037 ' ' ASP . 78.0 tttt -67.82 -40.7 83.76 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.421 174.003 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.773 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 7.0 t30 -77.96 -56.1 4.76 Favored 'General case' 0 C--O 1.221 -0.444 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.176 -170.353 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.95 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 0.2 OUTLIER -61.37 -39.99 92.69 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 118.978 -0.534 . . . . 0.0 110.654 -175.025 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.653 HD13 ' N ' ' A' 1037 ' ' ASP . 0.0 OUTLIER -72.94 -29.57 63.2 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 116.029 -2.268 . . . . 0.0 109.644 -179.372 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.653 ' N ' HD13 ' A' 1036 ' ' LEU . 15.2 t70 -63.03 -41.92 99.65 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-O 122.116 0.96 . . . . 0.0 109.314 174.349 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' 1034 ' ' ASN . 36.3 t -59.95 -45.48 95.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 113.764 -1.562 . . . . 0.0 111.591 177.585 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.658 HD11 ' HA ' ' A' ' 984' ' ' ILE . 2.0 mp -72.79 -31.63 37.28 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 C-N-CA 119.972 -0.691 . . . . 0.0 110.917 174.064 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.626 ' HB3' HG23 ' A' ' 919' ' ' ILE . 1.7 t0 -58.54 -46.34 87.03 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.317 0.579 . . . . 0.0 109.746 170.89 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.486 ' HG3' ' O ' ' A' 1037 ' ' ASP . 78.2 mt-30 -60.36 -49.43 77.61 Favored 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 173.671 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.84 ' HB1' HG23 ' A' ' 980' ' ' THR . . . -54.2 -52.27 61.77 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 114.279 -1.328 . . . . 0.0 113.353 -173.146 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.703 ' O ' HG12 ' A' 1047 ' ' ILE . 0.0 OUTLIER -64.07 -41.24 97.4 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 -176.2 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.62 ' HG ' ' CA ' ' A' ' 918' ' ' GLY . 3.0 tm? -72.4 -43.35 64.04 Favored 'General case' 0 N--CA 1.44 -0.94 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 -177.275 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.635 ' HB3' ' HB2' ' A' 1053 ' ' HIS . 22.8 mttp -50.65 -41.39 55.25 Favored 'General case' 0 C--O 1.213 -0.853 0 CA-C-N 114.689 -1.141 . . . . 0.0 109.659 172.568 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.665 ' SD ' ' HB2' ' A' ' 979' ' ' SER . 10.3 mmt -84.17 -23.42 30.6 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -179.261 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.703 HG12 ' O ' ' A' 1043 ' ' ARG . 23.5 mm -59.69 -42.62 89.16 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.396 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 174.335 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 48.9 m -141.96 72.54 1.38 Allowed 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.994 176.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.13 157.45 22.79 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.865 179.202 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 5.0 t -164.83 -38.01 0.03 OUTLIER 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 -177.144 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1051 ' ' ARG . . . . . 0.451 ' HB2' ' HD3' ' A' 1052 ' ' PRO . 52.2 mtp180 -143.42 -58.31 0.02 OUTLIER Pre-proline 0 CA--C 1.537 0.467 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.711 175.295 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1052 ' ' PRO . . . . . 0.451 ' HD3' ' HB2' ' A' 1051 ' ' ARG . 13.1 Cg_endo -89.81 103.32 0.34 Allowed 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 122.251 1.967 . . . . 0.0 114.556 -168.02 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1053 ' ' HIS . . . . . 0.635 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 11.0 t60 . . . . . 0 N--CA 1.467 0.407 0 CA-C-N 115.417 -0.81 . . . . 0.0 108.932 169.784 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.749 0 N-CA-C 111.991 -0.444 . . . . 0.0 111.991 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 909' ' ' SER . . . . . 0.584 ' N ' ' HD2' ' A' ' 910' ' ' PRO . 14.1 m -52.66 -49.38 86.54 Favored Pre-proline 0 CA--C 1.538 0.494 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -177.151 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 910' ' ' PRO . . . . . 0.584 ' HD2' ' N ' ' A' ' 909' ' ' SER . 6.3 Cg_exo -39.7 -43.73 3.22 Favored 'Trans proline' 0 C--N 1.366 1.461 0 C-N-CA 123.616 2.877 . . . . 0.0 113.776 179.068 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . 151.36 72.22 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.013 -1.089 . . . . 0.0 113.614 176.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 30.1 pt -80.29 -13.67 13.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.323 0.582 . . . . 0.0 109.946 173.216 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 19.1 p -145.78 103.98 3.82 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.957 178.272 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . -152.67 -82.36 0.04 OUTLIER Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.83 -0.7 . . . . 0.0 111.91 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . -73.79 -59.79 3.91 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.691 -0.766 . . . . 0.0 111.623 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . 134.07 -81.8 0.3 Allowed Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.212 178.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . -176.93 -137.98 2.82 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 121.09 -0.576 . . . . 0.0 112.041 -179.313 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 918' ' ' GLY . . . . . 0.605 ' HA2' HD13 ' A' 1044 ' ' LEU . . . 82.05 144.86 4.93 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 121.017 -0.611 . . . . 0.0 111.639 -177.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 919' ' ' ILE . . . . . 0.506 ' HA ' ' HB3' ' A' 1040 ' ' ASP . 0.2 OUTLIER -73.54 99.68 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.409 -2.488 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 178.695 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.445 ' H ' ' CG ' ' A' 1040 ' ' ASP . 47.2 ttt180 -177.26 -35.67 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.341 -166.732 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 20.4 m -69.01 106.82 2.9 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.002 -172.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 0.452 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 7.0 t30 -63.58 -45.76 88.93 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.306 -177.096 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.713 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 8.5 m-20 48.2 176.74 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 175.384 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.488 ' HB2' HG21 ' A' ' 968' ' ' THR . 27.8 mmtp -56.04 -21.19 20.27 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.105 -1.407 . . . . 0.0 112.605 178.142 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.885 ' HA ' HD21 ' A' ' 928' ' ' ASN . 16.3 m -65.87 -28.76 44.86 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.394 0 CA-C-O 120.96 0.41 . . . . 0.0 110.575 178.237 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.713 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.1 OUTLIER -78.71 -31.76 46.64 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.814 172.326 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -77.08 -24.14 51.89 Favored 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 118.837 -1.145 . . . . 0.0 113.528 -177.475 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.885 HD21 ' HA ' ' A' ' 925' ' ' VAL . 8.8 p30 -70.75 -45.8 64.14 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 118.388 -1.325 . . . . 0.0 109.106 166.861 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.626 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 98.3 t -53.04 -33.84 20.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 N-CA-C 113.809 1.041 . . . . 0.0 113.809 171.031 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 930' ' ' THR . . . . . . . . . . . . . 33.1 m -62.05 -43.42 98.88 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 119.884 1.22 . . . . 0.0 108.836 174.438 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -67.8 -51.73 33.49 Favored Glycine 0 CA--C 1.53 1.025 0 CA-C-N 114.65 -1.159 . . . . 0.0 113.574 175.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.626 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.8 pp -65.66 -49.13 69.76 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -174.253 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.455 HG23 HG13 ' A' ' 929' ' ' VAL . 53.3 t -65.89 -37.97 81.07 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.417 0 CA-C-O 121.101 0.477 . . . . 0.0 110.466 -176.007 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.55 ' HD2' ' C ' ' A' ' 934' ' ' LYS . 4.1 tmmm? -58.51 -41.01 84.44 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.99 178.162 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -67.45 -31.69 72.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.804 0.335 . . . . 0.0 111.498 -179.135 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.762 HG22 ' HB1' ' A' 1025 ' ' ALA . 80.2 t -54.45 -65.92 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.052 178.502 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 25.6 pt -70.24 -39.33 76.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.414 -178.392 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.458 ' HG2' ' HD3' ' A' ' 942' ' ' LYS . 40.1 tt0 -65.51 -52.21 54.34 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 120.194 -0.602 . . . . 0.0 110.451 -173.577 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.501 ' HB3' ' OE2' ' A' ' 949' ' ' GLU . 1.4 mpt? -70.52 -24.97 62.92 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.462 -176.286 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.548 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 28.7 p -58.63 -39.0 79.26 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.737 -171.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 941' ' ' SER . . . . . 0.57 ' HA ' ' HG3' ' A' ' 944' ' ' GLN . 17.1 p -98.11 -8.78 26.98 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.561 -178.753 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.458 ' HD3' ' HG2' ' A' ' 938' ' ' GLU . 22.0 mtpp -81.78 -9.86 59.51 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 175.437 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.928 HG12 ' HG2' ' A' 1018 ' ' LYS . 2.5 pp -87.9 -9.73 10.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 C-N-CA 120.477 -0.489 . . . . 0.0 111.719 169.353 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.57 ' HG3' ' HA ' ' A' ' 941' ' ' SER . 40.2 mt-30 -63.56 -48.58 80.63 Favored Pre-proline 0 CA--C 1.531 0.235 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.087 178.868 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 945' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -65.22 118.36 5.37 Favored 'Trans proline' 0 C--N 1.351 0.705 0 N-CA-C 107.216 -1.879 . . . . 0.0 107.216 156.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 946' ' ' ALA . . . . . . . . . . . . . . . -107.95 65.3 0.25 Allowed Pre-proline 0 CA--C 1.535 0.383 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 -160.093 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 947' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -87.71 128.62 2.47 Favored 'Trans proline' 0 N--CA 1.449 -1.132 0 C-N-CA 121.774 1.649 . . . . 0.0 108.005 149.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.706 ' HB3' HG11 ' A' 1009 ' ' VAL . 38.8 Cg_exo -49.95 117.93 3.46 Favored 'Trans proline' 0 CA--C 1.513 -0.527 0 C-N-CA 121.98 1.787 . . . . 0.0 112.801 -172.155 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.554 ' C ' ' H ' ' A' ' 951' ' ' TYR . 30.3 tt0 -59.68 -22.27 61.72 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 172.798 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.64 ' HB2' ' HG2' ' A' ' 953' ' ' PRO . 35.0 mt-10 71.88 -14.77 0.49 Allowed 'General case' 0 C--N 1.344 0.357 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.799 -173.493 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.827 ' HE1' HG21 ' A' ' 943' ' ' ILE . 30.9 m-85 55.13 -42.94 0.02 OUTLIER 'General case' 0 C--O 1.217 -0.617 0 C-N-CA 125.309 1.444 . . . . 0.0 114.544 175.857 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 0.601 ' HA ' ' CG2' ' A' ' 955' ' ' VAL . 46.9 t -53.15 -45.38 98.3 Favored Pre-proline 0 C--N 1.319 -0.737 0 C-N-CA 122.944 0.497 . . . . 0.0 111.256 170.723 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 0.64 ' HG2' ' HB2' ' A' ' 950' ' ' GLU . 48.8 Cg_exo -51.53 -38.31 64.32 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 122.071 1.847 . . . . 0.0 112.078 172.557 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.436 ' O ' HG12 ' A' ' 958' ' ' VAL . 7.0 tpt -77.45 -32.48 54.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.076 -0.966 . . . . 0.0 110.644 175.624 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.65 HG22 ' SD ' ' A' 1002 ' ' MET . 88.9 t -52.92 -38.71 29.42 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 167.843 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.546 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 12.4 tmtt? -66.87 -35.48 80.11 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.451 175.346 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -78.66 -46.79 18.36 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -177.014 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.527 ' O ' ' HG ' ' A' ' 962' ' ' LEU . 11.2 p -83.58 -30.36 7.92 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.365 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.299 -178.311 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -61.09 -38.89 96.31 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 110.617 -0.993 . . . . 0.0 110.617 174.321 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 960' ' ' LEU . . . . . 0.581 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 9.4 tt -70.15 -36.41 74.72 Favored 'General case' 0 C--O 1.223 -0.296 0 CA-C-O 120.935 0.397 . . . . 0.0 110.146 177.297 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.577 ' O ' ' HB2' ' A' ' 928' ' ' ASN . . . -72.68 -42.56 64.12 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.152 0.501 . . . . 0.0 111.523 -176.504 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 1.05 HD13 HD22 ' A' ' 995' ' ' LEU . 4.1 pp -81.5 -24.63 36.57 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.466 -179.167 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.581 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 4.9 ptp180 -73.73 -31.04 63.18 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 119.159 -1.017 . . . . 0.0 109.934 168.853 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 964' ' ' THR . . . . . 0.402 HG22 ' HB3' ' A' ' 928' ' ' ASN . 93.1 m -62.86 -32.52 73.77 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 174.025 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.996 HD23 HD22 ' A' ' 991' ' ' LEU . 63.5 tp -65.46 -55.66 16.7 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.235 174.055 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 0.534 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 9.5 tt -55.54 -41.18 72.86 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 114.199 -1.364 . . . . 0.0 109.901 -175.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -72.43 -36.74 68.65 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.289 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.488 HG21 ' HB2' ' A' ' 924' ' ' LYS . 22.2 m -66.29 -42.04 88.95 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.446 176.203 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.733 HG12 HG23 ' A' ' 984' ' ' ILE . 18.0 t -73.22 -33.55 41.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.929 178.412 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.651 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 7.6 t70 -68.16 -42.46 80.02 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 122.087 0.946 . . . . 0.0 108.815 178.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.658 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 31.9 tt0 -69.82 -29.86 67.23 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-N 114.082 -1.417 . . . . 0.0 109.874 178.114 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 73.2 m -67.21 -17.66 64.91 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.664 174.453 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.701 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 10.2 tt -68.64 -51.69 21.14 Favored Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 121.064 -0.254 . . . . 0.0 110.39 -178.787 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.701 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 2.6 Cg_endo -84.95 -27.62 1.16 Allowed 'Trans proline' 0 C--N 1.359 1.08 0 C-N-CA 121.771 1.647 . . . . 0.0 114.206 174.697 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 975' ' ' VAL . . . . . . . . . . . . . 52.3 t -73.33 -40.69 57.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 O-C-N 122.155 -0.341 . . . . 0.0 111.376 -177.041 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.793 ' HB3' ' HD2' ' A' ' 977' ' ' PRO . 90.5 mt -82.2 178.92 2.15 Favored Pre-proline 0 C--N 1.325 -0.473 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 176.359 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 0.793 ' HD2' ' HB3' ' A' ' 976' ' ' LEU . 4.6 Cg_exo -41.34 127.38 3.06 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 122.692 2.261 . . . . 0.0 111.775 173.388 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -56.04 -36.51 68.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.632 -0.713 . . . . 0.0 112.29 -169.549 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.616 ' HB2' ' SD ' ' A' 1046 ' ' MET . 10.7 m -87.07 3.18 47.16 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 -175.349 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.7 HG23 ' HB1' ' A' 1042 ' ' ALA . 74.7 m -74.4 -10.33 59.47 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.595 0.712 . . . . 0.0 109.184 170.533 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.574 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 9.2 p-80 -48.88 -35.28 14.4 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 114.214 -1.357 . . . . 0.0 114.563 -174.367 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 982' ' ' ARG . . . . . 0.402 ' HA ' ' OE2' ' A' ' 985' ' ' GLU . 3.8 ptp180 -78.96 -19.33 51.96 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 118.867 0.758 . . . . 0.0 111.062 -169.268 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.57 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 0.0 OUTLIER -76.52 -37.94 55.93 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 120.401 -0.52 . . . . 0.0 109.865 171.928 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.803 HG13 HG12 ' A' 1039 ' ' ILE . 3.6 mp -66.51 -35.75 75.63 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.486 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 175.854 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 985' ' ' GLU . . . . . 0.574 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 40.5 mt-10 -56.99 -52.88 63.51 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.598 178.428 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 89.9 mtp -70.57 -39.88 73.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.478 -174.018 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.997 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -76.9 -52.41 9.5 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.868 -1.06 . . . . 0.0 112.792 -169.695 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.534 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 27.0 pt20 -64.32 -24.88 67.8 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 121.6 0.714 . . . . 0.0 109.498 179.32 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 989' ' ' LYS . . . . . 0.798 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 31.7 tttm -73.39 -38.87 65.49 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.748 -1.115 . . . . 0.0 111.742 172.558 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.5 ' HG ' ' OD2' ' A' 1031 ' ' ASP . 17.1 tp -57.39 -58.27 9.02 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.423 -0.511 . . . . 0.0 112.275 178.277 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.996 HD22 HD23 ' A' ' 965' ' ' LEU . 13.6 tp -55.03 -34.45 63.52 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-O 121.365 0.602 . . . . 0.0 110.085 175.784 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 992' ' ' ASN . . . . . 0.798 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 24.7 t-20 -48.47 -53.21 18.8 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.197 -1.365 . . . . 0.0 111.606 -178.163 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 6.5 p -77.6 -29.95 52.2 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 120.591 -0.443 . . . . 0.0 112.131 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 994' ' ' ASP . . . . . 0.438 ' O ' ' HB2' ' A' ' 997' ' ' GLU . 0.9 OUTLIER -69.76 -39.04 76.95 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 119.646 -0.822 . . . . 0.0 110.741 -179.866 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 1.05 HD22 HD13 ' A' ' 962' ' ' LEU . 2.2 pp -68.41 -17.44 64.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.7 171.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -78.43 -24.38 46.18 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 119.523 -0.871 . . . . 0.0 110.259 168.374 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.654 ' O ' ' HG2' ' A' 1001 ' ' LYS . 71.6 mm-40 -72.08 -45.99 58.55 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 172.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.726 HD22 HD11 ' A' 1028 ' ' LEU . 0.2 OUTLIER -56.03 -46.76 78.74 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.752 -178.147 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.761 ' HA ' ' SD ' ' A' 1002 ' ' MET . 84.1 mt -66.99 -36.8 78.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.428 -173.392 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 19.9 m-80 -64.05 -35.36 80.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.124 0.488 . . . . 0.0 111.5 177.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.654 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 44.7 mmtm -77.4 -45.28 26.38 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.78 0.8 . . . . 0.0 109.792 -174.258 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1002 ' ' MET . . . . . 1.01 ' HB3' ' HG3' ' A' 1021 ' ' MET . 7.1 ptm -63.76 -25.92 68.41 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 122.165 0.983 . . . . 0.0 108.973 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.619 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 9.4 tptm -69.55 -52.66 24.26 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.439 -167.446 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.804 HD13 ' HG3' ' A' 1007 ' ' GLN . 4.0 mm? -75.33 -12.59 60.3 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.483 -0.781 . . . . 0.0 111.592 179.557 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.754 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -71.96 -37.78 69.87 Favored 'General case' 0 C--O 1.213 -0.828 0 C-N-CA 119.389 -0.924 . . . . 0.0 110.52 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.695 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.4 pp0? -76.3 -30.69 57.85 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 119.105 -0.474 . . . . 0.0 110.984 173.132 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.804 ' HG3' HD13 ' A' 1004 ' ' LEU . 17.2 mm-40 -48.3 -49.28 34.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.393 0.616 . . . . 0.0 109.989 175.253 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.504 ' HB2' HD12 ' A' 1013 ' ' LEU . 68.7 m-85 -129.09 55.04 1.76 Allowed 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 121.483 0.659 . . . . 0.0 110.419 170.362 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.995 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 4.7 p -56.51 -25.54 21.15 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.527 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.786 168.155 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 59.8 mtt -74.01 1.32 11.21 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 114.818 -1.083 . . . . 0.0 111.081 176.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1011 ' ' THR . . . . . 0.593 HG22 ' H ' ' A' 1012 ' ' SER . 0.2 OUTLIER -151.63 -154.77 0.56 Allowed 'General case' 0 C--O 1.26 1.606 0 CA-C-O 122.9 1.333 . . . . 0.0 114.043 -176.357 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A 1012 ' ' SER . . . . . 0.593 ' H ' HG22 ' A' 1011 ' ' THR . 15.1 m -59.06 -43.84 91.77 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 113.902 -1.499 . . . . 0.0 112.376 -170.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.669 ' O ' ' HB2' ' A' 1017 ' ' TYR . 13.2 mt -48.6 -43.23 35.94 Favored 'General case' 0 CA--C 1.494 -1.183 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.888 178.678 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1014 ' ' GLN . . . . . 0.995 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 3.4 tt0 -54.72 -54.08 46.56 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-O 121.521 0.677 . . . . 0.0 109.798 -171.374 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -67.01 -44.94 79.02 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 114.283 -1.326 . . . . 0.0 110.825 -174.64 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -65.67 -56.21 13.37 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.296 0.569 . . . . 0.0 111.799 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.754 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 6.7 m-85 -62.02 -34.52 76.37 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.988 -1.005 . . . . 0.0 113.149 -172.697 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.928 ' HG2' HG12 ' A' ' 943' ' ' ILE . 55.6 tptt -80.61 -30.72 36.77 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.74 -176.683 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -73.0 -49.79 26.88 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 174.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -54.65 -30.54 55.5 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 114.999 -1.001 . . . . 0.0 110.782 165.064 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1021 ' ' MET . . . . . 1.01 ' HG3' ' HB3' ' A' 1002 ' ' MET . 2.5 ttp -68.95 -48.16 63.89 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 175.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1022 ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' 1022 ' ' LEU . 0.0 OUTLIER -79.13 -12.28 59.99 Favored 'General case' 0 C--O 1.216 -0.702 0 C-N-CA 119.835 -0.746 . . . . 0.0 109.977 -177.016 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 97.8 m -84.45 -36.07 22.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.111 175.166 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.52 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.73 -22.08 47.09 Favored 'General case' 0 C--O 1.222 -0.369 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 171.816 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.762 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -84.92 -21.98 29.45 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.877 -0.602 . . . . 0.0 109.887 169.069 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.509 ' O ' HG23 ' A' 1030 ' ' VAL . 8.5 t60 -76.0 -27.18 57.32 Favored 'General case' 0 C--O 1.217 -0.624 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 165.584 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1027 ' ' ALA . . . . . 0.448 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -69.27 -39.94 78.09 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 123.355 0.662 . . . . 0.0 110.09 164.045 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.726 HD11 HD22 ' A' ' 998' ' ' LEU . 26.0 mt -61.3 -44.61 96.92 Favored 'General case' 0 C--N 1.315 -0.921 0 C-N-CA 120.353 -0.539 . . . . 0.0 109.615 170.427 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -59.09 -40.28 84.81 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.529 0.204 . . . . 0.0 111.476 173.233 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.509 HG23 ' O ' ' A' 1026 ' ' HIS . 9.5 t -69.11 -46.31 78.41 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 CA-C-O 121.7 0.762 . . . . 0.0 110.179 -178.799 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.5 ' OD2' ' HG ' ' A' ' 990' ' ' LEU . 5.5 t70 -71.84 -42.54 66.81 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 114.339 -1.301 . . . . 0.0 110.187 -174.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.601 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -59.98 -36.27 76.8 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 174.309 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 36.4 tttm -66.14 -55.01 18.52 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.631 0.729 . . . . 0.0 110.001 173.001 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.47 ' O ' ' HB3' ' A' 1037 ' ' ASP . 9.6 t30 -64.91 -48.66 73.38 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 114.587 -1.188 . . . . 0.0 112.552 -172.711 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.997 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 2.0 pp -63.99 -40.67 96.89 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 119.401 -0.333 . . . . 0.0 110.108 -176.382 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.638 HD22 HG23 ' A' ' 925' ' ' VAL . 4.0 pp -70.59 -33.68 71.33 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 117.232 -1.787 . . . . 0.0 109.618 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.47 ' HB3' ' O ' ' A' 1034 ' ' ASN . 18.3 t70 -58.25 -44.36 88.27 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.654 173.777 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.46 ' HB ' ' O ' ' A' 1035 ' ' LEU . 24.8 t -55.09 -39.38 50.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 113.708 -1.587 . . . . 0.0 111.269 174.284 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.803 HG12 HG13 ' A' ' 984' ' ' ILE . 1.7 mp -80.45 -33.13 13.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.374 176.857 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.506 ' HB3' ' HA ' ' A' ' 919' ' ' ILE . 0.4 OUTLIER -55.61 -44.26 76.85 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 121.536 0.684 . . . . 0.0 109.482 170.874 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 92.1 mt-30 -70.06 -39.22 75.81 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.058 174.205 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.7 ' HB1' HG23 ' A' ' 980' ' ' THR . . . -55.62 -52.51 63.55 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -177.414 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.648 ' HG2' ' O ' ' A' 1039 ' ' ILE . 5.7 ptm180 -66.1 -41.14 91.02 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 -176.379 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.605 HD13 ' HA2' ' A' ' 918' ' ' GLY . 44.5 tp -61.71 -43.73 98.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.987 -0.552 . . . . 0.0 109.895 174.225 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.7 ' O ' ' HB2' ' A' 1049 ' ' GLN . 50.4 mtpt -67.15 -22.37 65.78 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.13 -177.529 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.64 ' HA ' ' CE ' ' A' 1046 ' ' MET . 2.6 mmt -93.52 -24.29 18.04 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 172.019 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.577 HD11 ' HG3' ' A' ' 977' ' ' PRO . 44.6 mm -91.97 -64.58 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.895 0.379 . . . . 0.0 110.659 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1048 ' ' SER . . . . . 0.447 ' HB2' HD12 ' A' 1044 ' ' LEU . 9.8 t -59.94 -34.37 73.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.654 0.74 . . . . 0.0 110.611 -179.611 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1049 ' ' GLN . . . . . 0.7 ' HB2' ' O ' ' A' 1045 ' ' LYS . 11.8 mp0 -96.12 155.4 16.77 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.543 -174.401 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 16.1 m -118.61 11.54 12.86 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.507 177.118 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1051 ' ' ARG . . . . . 0.743 ' HB3' ' HD3' ' A' 1052 ' ' PRO . 12.3 ttm180 -165.04 -54.35 0.01 OUTLIER Pre-proline 0 CA--C 1.538 0.496 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -178.068 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1052 ' ' PRO . . . . . 0.743 ' HD3' ' HB3' ' A' 1051 ' ' ARG . 31.6 Cg_exo -61.33 87.34 0.09 OUTLIER 'Trans proline' 0 C--N 1.359 1.108 0 C-N-CA 122.751 2.301 . . . . 0.0 113.822 -179.572 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1053 ' ' HIS . . . . . 0.689 ' HA ' ' HE2' ' A' 1045 ' ' LYS . 35.5 t-80 . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.359 172.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.82 0 N-CA-C 111.813 -0.515 . . . . 0.0 111.813 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 4.9 p -158.49 107.9 1.66 Allowed Pre-proline 0 C--N 1.324 -0.519 0 CA-C-O 120.643 0.258 . . . . 0.0 110.747 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -65.64 -19.44 59.98 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 123.469 2.78 . . . . 0.0 113.132 -176.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -69.66 -21.99 76.56 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.976 -0.63 . . . . 0.0 112.587 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 47.0 mm -72.96 129.9 35.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 120.596 0.236 . . . . 0.0 110.452 -179.285 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 44.1 m -56.76 113.11 1.51 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.348 0.594 . . . . 0.0 111.225 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 119.74 -25.07 7.74 Favored Glycine 0 N--CA 1.444 -0.773 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.712 -178.368 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 98.3 -29.32 11.59 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.484 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . 134.88 -148.33 19.5 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 121.067 -0.587 . . . . 0.0 111.806 179.475 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . 99.74 -172.06 24.47 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.206 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . 101.2 -130.57 10.27 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.296 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 919' ' ' ILE . . . . . 0.619 ' HA ' ' HB3' ' A' 1040 ' ' ASP . 0.1 OUTLIER -75.77 127.01 37.12 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.835 0 C-N-CA 123.217 0.607 . . . . 0.0 110.0 -177.009 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 920' ' ' ARG . 14.7 ptt180 -163.69 -15.69 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 -178.465 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 25.7 p -153.37 101.16 2.5 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 119.548 -0.861 . . . . 0.0 112.561 -172.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 0.597 ' CG ' HD11 ' A' 1036 ' ' LEU . 1.4 p-10 -138.88 133.7 32.3 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.222 177.329 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.418 ' O ' ' CD1' ' A' ' 926' ' ' TYR . 7.3 m-20 -103.12 -75.64 0.6 Allowed 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -177.053 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.717 ' HB2' HG21 ' A' ' 968' ' ' THR . 0.0 OUTLIER -70.52 -53.52 15.85 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 114.444 1.276 . . . . 0.0 114.444 -170.5 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.683 ' H ' ' HD2' ' A' ' 924' ' ' LYS . 4.1 t -53.62 -40.57 42.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 CA-C-N 119.148 0.886 . . . . 0.0 111.895 -169.653 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.418 ' CD1' ' O ' ' A' ' 923' ' ' ASP . 0.7 OUTLIER -80.03 -20.94 44.17 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.084 -179.777 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 927' ' ' GLU . . . . . 0.587 ' HG2' ' O ' ' A' ' 924' ' ' LYS . 9.3 pt-20 -76.71 -24.17 53.11 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 120.173 1.351 . . . . 0.0 109.542 169.286 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.55 ' OD1' ' HA ' ' A' ' 925' ' ' VAL . 1.1 m120 -68.57 -29.7 68.31 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 170.601 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.578 ' HA ' ' CD2' ' A' ' 932' ' ' LEU . 44.3 t -80.5 -30.24 12.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 114.726 -1.125 . . . . 0.0 109.841 175.258 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.457 ' OG1' ' HA ' ' A' ' 927' ' ' GLU . 31.1 m -57.36 -43.4 83.47 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 168.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -66.55 -52.35 35.43 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-N 114.518 -1.219 . . . . 0.0 114.106 176.091 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.578 ' CD2' ' HA ' ' A' ' 929' ' ' VAL . 2.2 pp -65.29 -49.32 69.96 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -175.269 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.456 HG22 ' CB ' ' A' 1029 ' ' ALA . 76.7 t -62.1 -42.17 94.0 Favored 'Isoleucine or valine' 0 C--O 1.242 0.68 0 CA-C-O 121.399 0.619 . . . . 0.0 110.312 -176.637 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.472 ' O ' ' HB2' ' A' ' 938' ' ' GLU . 4.7 tmmm? -58.52 -39.04 79.02 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.612 -1.176 . . . . 0.0 109.906 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 0.56 ' HA ' ' SD ' ' A' ' 939' ' ' MET . . . -66.75 -35.41 80.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.569 0.223 . . . . 0.0 111.169 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.673 HG22 ' HB1' ' A' 1025 ' ' ALA . 59.8 t -53.24 -77.12 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.687 -179.513 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.511 ' O ' ' HB2' ' A' ' 940' ' ' SER . 27.1 pt -67.43 -42.57 87.4 Favored 'Isoleucine or valine' 0 C--O 1.249 1.062 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -174.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.472 ' HB2' ' O ' ' A' ' 934' ' ' LYS . 7.5 mm-40 -66.49 -46.5 76.1 Favored 'General case' 0 C--N 1.315 -0.929 0 C-N-CA 120.932 -0.307 . . . . 0.0 110.928 -170.149 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.56 ' SD ' ' HA ' ' A' ' 935' ' ' ALA . 1.0 OUTLIER -69.84 -28.33 65.6 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.174 178.032 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.751 ' HA ' ' NZ ' ' A' 1018 ' ' LYS . 4.6 m -51.79 -45.02 63.66 Favored 'General case' 0 CA--C 1.514 -0.434 0 O-C-N 123.542 0.526 . . . . 0.0 112.355 -171.788 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 18.1 m -106.63 -22.5 12.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.109 -177.098 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.437 ' C ' ' HD3' ' A' ' 942' ' ' LYS . 7.6 tmtm? -84.01 -58.72 2.66 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 119.445 -0.902 . . . . 0.0 110.87 -169.287 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.864 HG23 ' HG2' ' A' ' 949' ' ' GLU . 10.5 tp -77.81 0.92 2.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 121.163 0.506 . . . . 0.0 110.62 -178.771 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.544 ' HB2' ' OE2' ' A' ' 949' ' ' GLU . 33.5 tt0 -106.41 77.56 0.47 Allowed Pre-proline 0 CA--C 1.541 0.608 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.469 176.473 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.681 ' HD3' ' O ' ' A' ' 943' ' ' ILE . 11.3 Cg_endo -93.84 -69.26 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 123.157 2.571 . . . . 0.0 111.845 177.392 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.842 ' H ' ' HD2' ' A' ' 947' ' ' PRO . . . -135.92 -48.31 0.02 OUTLIER Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.031 176.853 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.842 ' HD2' ' H ' ' A' ' 946' ' ' ALA . 60.6 Cg_endo -73.35 162.36 40.51 Favored 'Trans proline' 0 C--N 1.356 0.941 0 C-N-CA 121.852 1.701 . . . . 0.0 111.114 169.821 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.561 ' HA ' HG21 ' A' 1009 ' ' VAL . 29.9 Cg_endo -64.04 155.79 62.55 Favored 'Trans proline' 0 N--CA 1.464 -0.244 0 C-N-CA 122.183 1.922 . . . . 0.0 112.597 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.864 ' HG2' HG23 ' A' ' 943' ' ' ILE . 51.1 mt-10 -74.99 7.11 3.45 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.331 178.43 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.601 ' HB3' ' HG2' ' A' ' 953' ' ' PRO . 1.0 OUTLIER 50.09 64.37 1.81 Allowed 'General case' 0 N--CA 1.44 -0.964 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -163.899 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 1.029 ' HB3' ' HG3' ' A' 1002 ' ' MET . 16.5 m-85 -52.62 -51.75 58.61 Favored 'General case' 0 C--O 1.214 -0.79 0 CA-C-N 114.557 -1.201 . . . . 0.0 113.175 -174.398 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 0.784 ' O ' HG12 ' A' ' 955' ' ' VAL . 66.6 t -53.82 -54.06 50.81 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 117.949 0.34 . . . . 0.0 111.142 174.079 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 0.721 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 12.8 Cg_exo -48.3 -43.82 30.88 Favored 'Trans proline' 0 CA--C 1.545 1.071 0 C-N-CA 121.703 1.602 . . . . 0.0 113.413 170.588 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.417 ' HE1' ' HB1' ' A' ' 935' ' ' ALA . 5.2 tpt -71.12 -48.21 53.56 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.547 0.739 . . . . 0.0 112.023 -179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.784 HG12 ' O ' ' A' ' 952' ' ' VAL . 0.3 OUTLIER -54.27 -29.65 19.8 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.772 169.059 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.531 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 9.5 tmtt? -68.64 -31.61 70.87 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.585 0.231 . . . . 0.0 111.296 169.842 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 957' ' ' GLU . . . . . 0.673 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 18.6 mm-40 -77.76 -44.69 26.84 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.395 0.617 . . . . 0.0 110.247 -176.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.458 HG12 ' HA ' ' A' ' 955' ' ' VAL . 7.3 p -77.01 -27.38 16.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.283 178.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 959' ' ' GLY . . . . . 0.508 ' HA2' HD11 ' A' ' 995' ' ' LEU . . . -65.44 -34.96 90.69 Favored Glycine 0 N--CA 1.448 -0.529 0 N-CA-C 110.293 -1.123 . . . . 0.0 110.293 170.658 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 960' ' ' LEU . . . . . 0.593 HD12 ' HD3' ' A' ' 963' ' ' ARG . 25.8 tp -63.67 -32.66 74.21 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.022 -0.589 . . . . 0.0 110.526 174.405 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.472 ' HB1' ' HB3' ' A' ' 932' ' ' LEU . . . -75.58 -58.19 3.43 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 121.137 -0.225 . . . . 0.0 110.612 -178.324 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.608 HD13 HD12 ' A' ' 991' ' ' LEU . 0.4 OUTLIER -42.82 -50.7 5.64 Favored 'General case' 0 C--O 1.212 -0.918 0 N-CA-C 112.748 0.648 . . . . 0.0 112.748 168.827 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.593 ' HD3' HD12 ' A' ' 960' ' ' LEU . 3.5 ptm180 -65.82 -28.51 69.04 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 119.654 1.116 . . . . 0.0 110.745 -177.626 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 38.8 m -68.78 -39.26 80.28 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 173.278 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.521 HD21 HD21 ' A' 1035 ' ' LEU . 0.1 OUTLIER -66.36 -38.96 88.79 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.389 -1.278 . . . . 0.0 110.66 177.287 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 0.837 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 9.9 tt -76.48 -38.79 54.76 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 115.415 -0.811 . . . . 0.0 108.92 -172.723 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -71.13 -31.66 68.0 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.304 177.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.717 HG21 ' HB2' ' A' ' 924' ' ' LYS . 11.8 p -68.77 -39.98 79.94 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 118.654 0.661 . . . . 0.0 110.29 175.289 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.893 HG12 HG23 ' A' ' 984' ' ' ILE . 97.7 t -71.14 -40.73 75.38 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.045 173.894 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.488 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 19.4 t70 -64.79 -42.98 94.62 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 122.003 0.906 . . . . 0.0 108.691 -179.103 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.687 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 11.2 tp10 -61.48 -38.13 86.16 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 114.032 -1.44 . . . . 0.0 109.415 177.123 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.716 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 58.8 m -64.42 -18.94 65.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.772 179.053 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.841 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 8.8 tt -66.89 -53.24 27.77 Favored Pre-proline 0 CA--C 1.536 0.434 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 -179.618 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.841 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 4.8 Cg_exo -80.83 -17.61 9.54 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 121.71 1.606 . . . . 0.0 113.78 172.063 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.716 ' HB ' ' HA ' ' A' ' 972' ' ' SER . 3.5 t -57.99 -67.67 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -178.14 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.679 ' HB2' ' HD3' ' A' ' 977' ' ' PRO . 64.7 mt -145.79 -59.27 0.02 OUTLIER Pre-proline 0 N--CA 1.468 0.436 0 C-N-CA 119.067 -1.053 . . . . 0.0 113.238 -172.541 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 0.679 ' HD3' ' HB2' ' A' ' 976' ' ' LEU . 51.5 Cg_exo -54.61 99.37 0.06 OUTLIER 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.399 2.066 . . . . 0.0 113.446 -171.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 978' ' ' ALA . . . . . 0.467 ' C ' ' H ' ' A' ' 980' ' ' THR . . . -75.34 128.11 34.65 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.796 -178.434 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.516 ' HB2' ' SD ' ' A' 1046 ' ' MET . 20.1 m 62.45 -0.22 0.55 Allowed 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.973 -177.238 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.759 HG23 ' HB1' ' A' 1042 ' ' ALA . 67.4 m -73.12 -14.67 61.43 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 165.515 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.557 ' HA ' HD12 ' A' ' 984' ' ' ILE . 2.5 p80 -52.04 -23.33 5.07 Favored 'General case' 0 C--O 1.216 -0.669 0 CA-C-N 113.971 -1.468 . . . . 0.0 113.403 179.03 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -82.56 -21.42 35.3 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 119.081 0.855 . . . . 0.0 110.755 178.567 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.73 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 0.2 OUTLIER -78.63 -33.98 46.87 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 168.454 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.893 HG23 HG12 ' A' ' 969' ' ' VAL . 53.5 mt -70.15 -30.65 44.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 114.766 -1.106 . . . . 0.0 108.055 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 985' ' ' GLU . . . . . 0.518 ' O ' ' HG3' ' A' ' 989' ' ' LYS . 9.6 mm-40 -64.1 -55.35 22.67 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.783 174.417 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 65.3 mtt -71.11 -44.78 64.95 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.131 -0.94 . . . . 0.0 111.619 -168.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 1.021 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -66.6 -49.38 66.49 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.069 -0.968 . . . . 0.0 112.288 -173.352 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.837 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 25.9 pt20 -61.76 -29.92 70.45 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 119.817 -0.753 . . . . 0.0 111.26 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 989' ' ' LYS . . . . . 0.743 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 50.9 mttm -70.5 -39.16 74.31 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.616 0.722 . . . . 0.0 111.396 174.21 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.622 HD23 ' HB3' ' A' 1035 ' ' LEU . 15.8 tp -49.94 -60.49 2.87 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.447 -178.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.724 HD21 ' HA ' ' A' 1028 ' ' LEU . 0.3 OUTLIER -67.99 -28.55 67.53 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.522 0.677 . . . . 0.0 109.788 -179.885 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 992' ' ' ASN . . . . . 0.743 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 22.7 t-20 -52.27 -55.44 21.31 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.346 -1.297 . . . . 0.0 111.023 178.278 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 30.8 t -76.41 -34.75 58.82 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.383 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 994' ' ' ASP . . . . . 0.464 ' O ' ' HB3' ' A' ' 997' ' ' GLU . 0.7 OUTLIER -65.27 -37.04 85.97 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.6 -0.44 . . . . 0.0 112.162 179.306 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 1.035 ' HG ' HD23 ' A' ' 998' ' ' LEU . 6.8 tt -72.0 -17.49 62.04 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 122.32 -0.238 . . . . 0.0 110.546 172.703 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -72.8 -25.73 61.25 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 119.446 -0.901 . . . . 0.0 110.032 166.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.464 ' HB3' ' O ' ' A' ' 994' ' ' ASP . 12.1 tp10 -74.97 -38.4 61.68 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 173.371 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 1.035 HD23 ' HG ' ' A' ' 995' ' ' LEU . 0.1 OUTLIER -56.38 -46.39 80.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.039 178.629 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.589 ' O ' ' HB2' ' A' 1003 ' ' LYS . 76.2 mt -60.7 -46.11 96.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.679 -175.429 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -58.04 -39.87 79.49 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -175.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.554 ' O ' ' HB3' ' A' 1017 ' ' TYR . 32.7 mmtp -84.15 -37.05 22.42 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.721 0.772 . . . . 0.0 110.119 -175.551 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1002 ' ' MET . . . . . 1.029 ' HG3' ' HB3' ' A' ' 951' ' ' TYR . 34.3 tpp -57.97 -32.54 67.96 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.731 -1.122 . . . . 0.0 108.821 172.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.589 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 13.4 tptp -70.39 -53.7 15.46 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 113.808 -1.542 . . . . 0.0 111.369 -167.426 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.65 HD13 ' HG3' ' A' 1007 ' ' GLN . 4.1 mm? -76.9 -13.16 60.02 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.681 -177.383 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.629 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -68.45 -47.98 65.73 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 119.664 -0.814 . . . . 0.0 109.762 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.906 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 8.4 pt20 -70.87 -36.16 72.69 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 119.941 -0.704 . . . . 0.0 111.898 171.486 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.65 ' HG3' HD13 ' A' 1004 ' ' LEU . 12.4 mm100 -43.13 -51.55 5.86 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.108 0.48 . . . . 0.0 110.734 177.086 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.688 ' HB2' ' HG ' ' A' 1013 ' ' LEU . 66.4 m-85 -123.71 52.3 1.45 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.52 0.676 . . . . 0.0 110.088 169.372 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.983 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 13.0 p -53.73 -18.05 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.423 0 CA-C-N 114.576 -1.193 . . . . 0.0 110.288 169.555 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1010 ' ' MET . . . . . 0.418 ' C ' ' HG1' ' A' 1011 ' ' THR . 16.4 ptp -62.31 81.17 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.078 166.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1011 ' ' THR . . . . . 0.418 ' HG1' ' C ' ' A' 1010 ' ' MET . 45.8 p 68.0 -89.08 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 126.231 1.812 . . . . 0.0 114.589 175.479 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 37.6 m -45.98 -79.38 0.01 OUTLIER 'General case' 0 C--O 1.241 0.638 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 -165.264 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.688 ' HG ' ' HB2' ' A' 1008 ' ' TYR . 13.3 mt -54.57 -35.17 63.02 Favored 'General case' 0 CA--C 1.501 -0.92 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 -174.784 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1014 ' ' GLN . . . . . 0.983 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.8 OUTLIER -54.39 -48.61 71.36 Favored 'General case' 0 N--CA 1.445 -0.718 0 O-C-N 123.646 0.591 . . . . 0.0 110.912 -167.78 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A 1015 ' ' GLN . . . . . 0.403 ' O ' ' HD3' ' A' 1019 ' ' LYS . 22.3 pt20 -75.17 -41.06 58.88 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.565 -176.397 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -72.64 -46.74 52.5 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.203 0.525 . . . . 0.0 111.042 -176.431 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.629 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 6.9 m-85 -67.87 -36.5 80.39 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.48 -176.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.789 ' HE2' ' CE ' ' A' 1021 ' ' MET . 9.5 tptm -79.86 -26.61 40.3 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.587 -175.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1019 ' ' LYS . . . . . 0.403 ' HD3' ' O ' ' A' 1015 ' ' GLN . 1.1 mptm? -74.18 -42.16 60.3 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 174.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -57.34 -35.04 69.41 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.191 163.229 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.789 ' CE ' ' HE2' ' A' 1018 ' ' LYS . 6.6 tmm? -66.41 -53.6 33.94 Favored 'General case' 0 C--O 1.219 -0.505 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 -179.039 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1022 ' ' LEU . . . . . 0.522 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -78.98 -8.53 58.99 Favored 'General case' 0 C--O 1.22 -0.46 0 C-N-CA 119.367 -0.933 . . . . 0.0 109.852 -171.472 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 82.6 m -88.15 -35.27 17.51 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.944 174.367 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.488 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -79.0 -22.72 45.12 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-O 121.222 0.534 . . . . 0.0 109.582 171.833 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.673 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -86.18 -23.92 26.33 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.927 170.213 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.525 ' O ' HG23 ' A' 1030 ' ' VAL . 63.8 t60 -75.96 -22.58 55.76 Favored 'General case' 0 C--O 1.214 -0.777 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 164.689 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1027 ' ' ALA . . . . . 0.488 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -73.2 -39.11 65.83 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 123.282 0.633 . . . . 0.0 109.386 165.231 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.724 ' HA ' HD21 ' A' ' 991' ' ' LEU . 14.4 mt -59.87 -48.15 82.85 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 168.793 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1029 ' ' ALA . . . . . 0.456 ' CB ' HG22 ' A' ' 933' ' ' VAL . . . -57.73 -42.72 84.44 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.867 -0.151 . . . . 0.0 111.358 175.234 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.525 HG23 ' O ' ' A' 1026 ' ' HIS . 8.0 t -69.19 -51.79 39.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.318 0.58 . . . . 0.0 110.877 -176.623 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.537 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 12.4 m-20 -77.15 -29.38 54.56 Favored 'General case' 0 C--O 1.214 -0.779 0 CA-C-N 115.338 -0.847 . . . . 0.0 112.661 -174.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.426 ' HA ' ' CD2' ' A' 1035 ' ' LEU . . . -70.32 -31.24 68.46 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 172.224 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.55 ' O ' ' HE2' ' A' 1033 ' ' LYS . 1.0 OUTLIER -63.83 -49.95 70.81 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 168.892 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.537 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 42.2 t30 -64.13 -53.94 41.66 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-N 113.921 -1.49 . . . . 0.0 112.474 -175.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1035 ' ' LEU . . . . . 1.021 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 2.3 pp -60.47 -41.27 93.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 119.638 -0.22 . . . . 0.0 110.551 -172.242 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.597 HD11 ' CG ' ' A' ' 922' ' ' ASN . 1.0 OUTLIER -68.77 -43.95 74.69 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 117.974 -1.491 . . . . 0.0 109.142 179.12 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.524 ' HB3' ' O ' ' A' 1034 ' ' ASN . 12.1 t70 -49.28 -42.91 42.54 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 114.801 -1.091 . . . . 0.0 110.22 173.771 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.611 ' CG1' ' HG3' ' A' ' 983' ' ' GLU . 21.2 t -56.82 -48.7 80.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 113.488 -1.687 . . . . 0.0 111.966 176.064 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.731 ' O ' ' HG2' ' A' 1043 ' ' ARG . 2.0 mp -70.68 -31.48 46.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 118.761 0.709 . . . . 0.0 111.435 177.039 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.619 ' HB3' ' HA ' ' A' ' 919' ' ' ILE . 0.2 OUTLIER -63.38 -47.41 82.18 Favored 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.559 174.204 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.423 ' O ' ' HB2' ' A' 1045 ' ' LYS . 39.0 mt-30 -61.58 -43.87 98.06 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.006 0.432 . . . . 0.0 109.863 172.204 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.759 ' HB1' HG23 ' A' ' 980' ' ' THR . . . -54.1 -50.99 65.58 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -176.399 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.731 ' HG2' ' O ' ' A' 1039 ' ' ILE . 1.3 ptp180 -63.7 -46.94 83.2 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.477 -174.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.649 HD13 HD12 ' A' 1047 ' ' ILE . 3.7 mm? -74.82 -21.37 59.32 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.764 0.316 . . . . 0.0 111.016 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.491 ' O ' ' HG2' ' A' 1049 ' ' GLN . 2.5 tmtm? -80.65 -34.81 34.61 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 179.109 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.636 ' SD ' ' HA ' ' A' 1052 ' ' PRO . 4.4 mmm -63.23 -30.94 71.99 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 120.231 -0.587 . . . . 0.0 110.0 171.39 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.649 HD12 HD13 ' A' 1044 ' ' LEU . 53.5 mt -79.5 -21.62 12.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.357 0.599 . . . . 0.0 110.139 175.246 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1048 ' ' SER . . . . . 0.432 ' HB3' ' HA ' ' A' 1045 ' ' LYS . 33.7 t -90.58 -1.0 57.88 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.387 -175.529 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1049 ' ' GLN . . . . . 0.491 ' HG2' ' O ' ' A' 1045 ' ' LYS . 14.7 mm100 -116.84 -178.4 3.42 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.081 0.467 . . . . 0.0 110.835 -178.797 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 10.4 t -125.17 17.95 8.38 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 169.047 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 72.0 ttt180 -147.9 141.78 15.93 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 114.055 -1.43 . . . . 0.0 107.699 -174.68 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1052 ' ' PRO . . . . . 0.636 ' HA ' ' SD ' ' A' 1046 ' ' MET . 71.4 Cg_exo -49.47 90.89 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 123.248 2.632 . . . . 0.0 114.416 -175.142 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1053 ' ' HIS . . . . . 0.442 ' CD2' ' HA ' ' A' 1042 ' ' ALA . 54.5 t-80 . . . . . 0 CA--C 1.536 0.424 0 CA-C-N 114.755 -1.111 . . . . 0.0 112.053 178.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.706 0 N-CA-C 112.229 -0.348 . . . . 0.0 112.229 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 909' ' ' SER . . . . . 0.769 ' HB3' ' HD3' ' A' ' 910' ' ' PRO . 9.1 t -105.22 -56.75 0.08 OUTLIER Pre-proline 0 CA--C 1.538 0.498 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 176.612 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 910' ' ' PRO . . . . . 0.769 ' HD3' ' HB3' ' A' ' 909' ' ' SER . 3.8 Cg_exo -77.39 25.63 0.48 Allowed 'Trans proline' 0 C--N 1.362 1.26 0 C-N-CA 122.737 2.291 . . . . 0.0 111.827 177.813 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 911' ' ' GLY . . . . . 0.405 ' H ' ' C ' ' A' ' 909' ' ' SER . . . -144.63 146.73 17.45 Favored Glycine 0 N--CA 1.44 -1.034 0 N-CA-C 110.455 -1.058 . . . . 0.0 110.455 177.647 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 912' ' ' ILE . . . . . 0.505 HG13 ' H ' ' A' ' 914' ' ' GLY . 8.6 tp -78.62 112.78 17.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.483 0.658 . . . . 0.0 111.045 -176.28 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 50.7 m -98.36 18.31 16.77 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.704 179.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 914' ' ' GLY . . . . . 0.505 ' H ' HG13 ' A' ' 912' ' ' ILE . . . 115.02 114.09 2.97 Favored Glycine 0 N--CA 1.445 -0.74 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.45 -177.107 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 915' ' ' GLY . . . . . 0.528 ' O ' ' HA ' ' A' ' 921' ' ' SER . . . -99.92 169.26 21.88 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.896 -0.668 . . . . 0.0 112.09 -177.668 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . 169.98 -60.64 0.18 Allowed Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.089 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . 67.85 95.2 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 N-CA-C 111.385 -0.686 . . . . 0.0 111.385 -176.117 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 918' ' ' GLY . . . . . 0.513 ' O ' ' HB2' ' A' 1044 ' ' LEU . . . 83.32 -96.41 1.92 Allowed Glycine 0 N--CA 1.442 -0.935 0 C-N-CA 119.896 -1.145 . . . . 0.0 111.136 -170.475 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 919' ' ' ILE . . . . . 0.762 ' HA ' ' O ' ' A' 1040 ' ' ASP . 29.2 pt -60.96 -179.84 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.922 0 C-N-CA 124.035 0.934 . . . . 0.0 112.843 179.069 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.952 ' HA ' ' HG2' ' A' 1043 ' ' ARG . 0.2 OUTLIER -67.95 -61.71 1.74 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.973 -1.012 . . . . 0.0 113.138 -163.007 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 921' ' ' SER . . . . . 0.528 ' HA ' ' O ' ' A' ' 915' ' ' GLY . 49.7 m -153.91 -56.53 0.11 Allowed 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 121.302 0.573 . . . . 0.0 109.855 -177.554 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 0.477 ' CG ' ' H ' ' A' ' 923' ' ' ASP . 23.7 p-10 -152.33 -76.66 0.13 Allowed 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.372 172.944 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.811 ' HB3' ' CD1' ' A' ' 926' ' ' TYR . 9.4 m-20 -168.1 17.06 0.03 OUTLIER 'General case' 0 C--O 1.21 -0.992 0 C-N-CA 122.444 0.298 . . . . 0.0 111.071 -171.622 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.48 ' O ' ' HG2' ' A' ' 927' ' ' GLU . 4.9 tptp -58.16 -41.26 83.44 Favored 'General case' 0 C--N 1.319 -0.732 0 O-C-N 120.932 -1.105 . . . . 0.0 112.858 -165.256 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.825 HG13 ' HB2' ' A' 1036 ' ' LEU . 1.5 p -62.45 -28.81 45.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 CA-C-O 121.291 0.567 . . . . 0.0 110.83 177.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.811 ' CD1' ' HB3' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -68.09 -30.02 69.1 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.498 0.719 . . . . 0.0 111.555 174.986 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 927' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 924' ' ' LYS . 3.6 pt-20 -74.97 -23.22 58.25 Favored 'General case' 0 C--N 1.315 -0.935 0 C-N-CA 118.661 -1.215 . . . . 0.0 109.636 -179.531 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.419 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 1.6 m120 -75.48 -30.98 60.07 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 172.08 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.656 HG22 HD21 ' A' ' 932' ' ' LEU . 83.3 t -81.68 -30.41 10.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.745 178.247 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.466 HG22 ' O ' ' A' ' 927' ' ' GLU . 3.1 t -65.37 -26.69 68.12 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 170.139 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -72.03 -52.87 10.21 Favored Glycine 0 CA--C 1.531 1.044 0 CA-C-N 115.047 -0.978 . . . . 0.0 113.379 172.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.656 HD21 HG22 ' A' ' 929' ' ' VAL . 3.2 pp -65.8 -47.43 75.15 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -177.617 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 95.6 t -64.37 -34.39 69.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 CA-C-O 121.375 0.607 . . . . 0.0 110.237 -177.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.494 ' O ' ' HB3' ' A' ' 938' ' ' GLU . 37.9 tptt -62.48 -34.03 76.03 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.516 176.131 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -68.62 -40.31 80.4 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.316 -0.554 . . . . 0.0 110.644 174.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.834 HG22 ' HB1' ' A' 1025 ' ' ALA . 88.3 t -47.38 -78.92 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 123.417 0.687 . . . . 0.0 112.511 -178.46 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 19.2 pt -70.49 -41.94 78.22 Favored 'Isoleucine or valine' 0 C--O 1.249 1.028 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -175.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.677 ' O ' ' HB2' ' A' ' 942' ' ' LYS . 5.2 tp10 -70.46 -48.08 57.54 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.426 -168.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.651 ' HG3' HG13 ' A' ' 943' ' ' ILE . 16.2 ttt -74.49 -27.27 60.49 Favored 'General case' 0 C--N 1.308 -1.219 0 C-N-CA 119.276 -0.97 . . . . 0.0 110.05 -178.395 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.699 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 26.3 t -51.64 -55.68 17.95 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.512 -171.534 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 50.5 m -103.74 -21.1 13.75 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.398 -175.615 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.677 ' HB2' ' O ' ' A' ' 938' ' ' GLU . 11.8 mptt -85.35 -59.24 2.38 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 119.27 -0.972 . . . . 0.0 111.94 -167.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.651 HG13 ' HG3' ' A' ' 939' ' ' MET . 46.2 mm -56.26 -66.05 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 O-C-N 123.324 0.39 . . . . 0.0 111.711 -177.782 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.558 ' OE1' ' HA ' ' A' ' 949' ' ' GLU . 43.5 mt-30 -155.28 101.3 2.26 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-O 120.929 0.395 . . . . 0.0 111.23 -178.409 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.431 ' HD2' ' HD2' ' A' ' 947' ' ' PRO . 38.1 Cg_endo -85.47 -77.36 0.0 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.853 0 C-N-CA 122.568 2.179 . . . . 0.0 112.555 176.629 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.653 ' HB3' ' HD3' ' A' ' 947' ' ' PRO . . . -69.69 -49.42 21.17 Favored Pre-proline 0 CA--C 1.532 0.288 0 N-CA-C 111.532 0.197 . . . . 0.0 111.532 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.653 ' HD3' ' HB3' ' A' ' 946' ' ' ALA . 16.9 Cg_exo -68.44 137.32 39.27 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 121.328 1.352 . . . . 0.0 109.596 169.243 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.85 ' HB3' HG11 ' A' 1009 ' ' VAL . 10.0 Cg_endo -58.08 111.05 0.73 Allowed 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 121.747 1.631 . . . . 0.0 113.255 -175.318 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.655 ' HB3' ' CD1' ' A' ' 951' ' ' TYR . 28.7 tt0 -59.1 -16.12 17.67 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.412 -1.267 . . . . 0.0 108.558 165.098 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.717 ' HB3' ' HG2' ' A' ' 953' ' ' PRO . 30.2 tt0 74.92 -12.36 0.95 Allowed 'General case' 0 C--N 1.348 0.524 0 CA-C-N 114.526 -1.215 . . . . 0.0 108.572 -166.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 1.004 ' HB3' ' HG2' ' A' 1002 ' ' MET . 20.5 m-30 54.04 -50.09 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.475 1.51 . . . . 0.0 114.255 177.572 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 0.549 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 45.6 t -48.1 -44.69 62.07 Favored Pre-proline 0 CA--C 1.541 0.597 0 C-N-CA 122.849 0.46 . . . . 0.0 112.058 172.327 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 0.717 ' HG2' ' HB3' ' A' ' 950' ' ' GLU . 19.0 Cg_exo -47.62 -44.13 26.6 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 122.572 2.181 . . . . 0.0 113.185 173.864 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.779 ' HB3' ' HE1' ' A' 1002 ' ' MET . 14.1 ttt -71.76 -37.55 70.5 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 120.897 0.379 . . . . 0.0 110.227 175.774 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.519 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 86.2 t -52.96 -40.62 37.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.809 170.787 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.509 ' HE2' ' OE2' ' A' ' 957' ' ' GLU . 0.8 OUTLIER -62.7 -34.03 76.3 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.788 174.376 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 957' ' ' GLU . . . . . 0.509 ' OE2' ' HE2' ' A' ' 956' ' ' LYS . 69.7 mm-40 -77.87 -44.83 26.0 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.195 0.522 . . . . 0.0 111.111 -179.24 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.451 HG23 ' HB2' ' A' ' 932' ' ' LEU . 14.6 p -78.79 -29.37 14.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.928 -177.375 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -69.62 -35.52 74.6 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 110.549 -1.02 . . . . 0.0 110.549 172.801 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 960' ' ' LEU . . . . . 0.455 ' O ' ' HG2' ' A' ' 963' ' ' ARG . 8.6 tt -62.77 -41.22 99.13 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 174.121 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.422 ' CB ' ' HB3' ' A' ' 932' ' ' LEU . . . -69.32 -57.99 4.6 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 121.132 -0.227 . . . . 0.0 110.966 -179.593 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.597 ' HB2' HD22 ' A' ' 991' ' ' LEU . 0.1 OUTLIER -42.86 -49.22 5.85 Favored 'General case' 0 C--O 1.217 -0.642 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 169.763 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.466 ' N ' ' HG ' ' A' ' 962' ' ' LEU . 11.2 ptm180 -67.89 -28.77 67.8 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 120.108 1.322 . . . . 0.0 111.064 -179.529 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 28.0 m -68.3 -35.53 77.97 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 173.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.719 HD22 HD13 ' A' ' 991' ' ' LEU . 0.0 OUTLIER -66.57 -38.64 87.48 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 114.523 -1.217 . . . . 0.0 109.467 174.686 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 10.3 tt -65.92 -40.36 91.36 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-N 114.314 -1.312 . . . . 0.0 108.271 -177.082 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -65.29 -44.69 87.16 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.397 -0.82 . . . . 0.0 112.249 178.166 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 13.8 p -64.81 -41.02 96.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 118.858 0.753 . . . . 0.0 110.412 179.379 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.724 HG12 HG23 ' A' ' 984' ' ' ILE . 87.3 t -72.96 -41.85 60.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.021 176.811 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.605 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 14.0 t70 -67.03 -38.83 86.62 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 -177.57 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.625 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 14.2 tt0 -60.83 -33.85 73.66 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.012 -0.995 . . . . 0.0 109.773 174.231 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.506 ' HB2' ' O ' ' A' ' 969' ' ' VAL . 64.2 m -65.57 -18.29 65.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.085 177.728 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.727 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 10.5 tt -70.61 -52.02 11.45 Favored Pre-proline 0 CA--C 1.537 0.48 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.256 -178.529 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.727 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 2.2 Cg_endo -88.01 -4.7 6.95 Favored 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 121.758 1.639 . . . . 0.0 113.94 173.751 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 971' ' ' GLU . 15.9 t -74.71 -41.07 47.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 120.157 -0.617 . . . . 0.0 109.766 171.156 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.402 HD22 HG12 ' A' ' 975' ' ' VAL . 3.3 mm? -95.31 108.09 36.78 Favored Pre-proline 0 C--N 1.328 -0.362 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 172.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -50.78 101.1 0.04 OUTLIER 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 123.552 2.835 . . . . 0.0 114.418 -171.1 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . 69.78 -67.82 0.22 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.033 -0.985 . . . . 0.0 113.573 172.188 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.443 ' HB2' ' CE ' ' A' 1046 ' ' MET . 5.7 p -48.93 -50.64 34.39 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 114.464 1.283 . . . . 0.0 114.464 -166.388 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.603 HG22 ' CD1' ' A' ' 984' ' ' ILE . 32.5 m -70.61 -5.1 26.84 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -172.1 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.689 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 12.1 p-80 -50.13 -34.52 22.45 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -175.352 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -82.66 -20.79 35.55 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -168.137 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 983' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.59 -37.65 41.93 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.316 0.579 . . . . 0.0 109.684 172.58 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.779 HG13 HG12 ' A' 1039 ' ' ILE . 2.5 mp -65.68 -29.74 47.94 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.524 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 176.005 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 985' ' ' GLU . . . . . 0.689 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 42.3 mt-10 -63.79 -52.45 60.2 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-O 121.36 0.6 . . . . 0.0 110.579 176.164 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 58.7 mtt -70.06 -46.34 65.17 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 114.978 -1.01 . . . . 0.0 111.424 -169.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.466 ' HA ' HD12 ' A' ' 990' ' ' LEU . . . -75.09 -51.11 14.29 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.719 -1.128 . . . . 0.0 112.776 -169.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.677 ' O ' ' HB2' ' A' ' 992' ' ' ASN . 17.9 pt20 -63.29 -20.95 65.93 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 119.406 -0.918 . . . . 0.0 109.209 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 989' ' ' LYS . . . . . 0.62 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 9.1 ttmm -73.94 -42.43 60.58 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.042 -0.981 . . . . 0.0 112.591 170.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.498 HD13 HD11 ' A' 1035 ' ' LEU . 1.2 mt -56.29 -54.05 49.96 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -178.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.719 HD13 HD22 ' A' ' 965' ' ' LEU . 1.2 tt -65.22 -32.21 73.77 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 175.774 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 992' ' ' ASN . . . . . 0.677 ' HB2' ' O ' ' A' ' 988' ' ' GLN . 47.3 t-20 -53.95 -56.88 13.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.932 179.003 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 20.7 t -79.32 -33.88 42.77 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -177.42 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 994' ' ' ASP . . . . . 0.502 ' O ' ' HB3' ' A' ' 997' ' ' GLU . 0.2 OUTLIER -69.0 -33.41 73.63 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.17 -0.612 . . . . 0.0 111.705 178.946 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 0.611 ' N ' HD21 ' A' 1028 ' ' LEU . 2.9 tm? -69.33 -19.63 63.87 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 169.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -76.08 -21.76 56.36 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 119.434 -0.906 . . . . 0.0 110.415 167.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.594 ' HA ' ' ND2' ' A' 1000 ' ' ASN . 7.7 tp10 -75.25 -42.41 55.19 Favored 'General case' 0 C--O 1.239 0.528 0 C-N-CA 122.367 0.267 . . . . 0.0 110.532 173.228 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.961 HD12 ' HB2' ' A' 1025 ' ' ALA . 1.6 tt -56.53 -44.21 80.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.725 0.298 . . . . 0.0 110.366 177.518 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.546 HG13 ' O ' ' A' ' 995' ' ' LEU . 88.5 mt -66.46 -46.87 85.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 CA-C-N 115.868 -0.605 . . . . 0.0 112.274 -172.473 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1000 ' ' ASN . . . . . 0.594 ' ND2' ' HA ' ' A' ' 997' ' ' GLU . 10.2 p30 -63.21 -37.51 87.54 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.438 0.637 . . . . 0.0 111.374 -172.147 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.599 ' HD3' ' HB3' ' A' 1020 ' ' GLN . 49.9 mttp -83.96 -34.15 24.48 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.086 -178.883 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1002 ' ' MET . . . . . 1.004 ' HG2' ' HB3' ' A' ' 951' ' ' TYR . 12.7 ttt -62.48 -27.23 68.99 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 122.054 0.93 . . . . 0.0 109.013 175.537 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.55 ' O ' ' HG3' ' A' 1007 ' ' GLN . 10.3 tptp -72.91 -55.28 6.84 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-N 113.724 -1.58 . . . . 0.0 110.224 -170.812 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.417 HD23 ' CD ' ' A' 1007 ' ' GLN . 90.5 mt -66.24 -13.53 60.52 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.615 179.435 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.726 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -72.88 -51.76 17.4 Favored 'General case' 0 C--O 1.212 -0.898 0 C-N-CA 119.634 -0.827 . . . . 0.0 110.147 178.85 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.971 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.5 pp0? -68.86 -32.39 72.02 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 118.332 0.515 . . . . 0.0 111.94 174.272 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.55 ' HG3' ' O ' ' A' 1003 ' ' LYS . 67.5 mt-30 -51.79 -40.86 61.11 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.18 0.514 . . . . 0.0 111.282 175.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.514 ' HB2' ' HG ' ' A' 1013 ' ' LEU . 54.9 m-85 -126.49 39.06 4.01 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.333 173.268 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1009 ' ' VAL . . . . . 1.008 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 12.9 p -54.28 -22.14 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 CA-C-O 121.692 0.758 . . . . 0.0 110.332 177.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1010 ' ' MET . . . . . 0.497 ' O ' HG23 ' A' 1011 ' ' THR . 59.1 mtt -50.03 -29.32 8.47 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.355 -1.293 . . . . 0.0 111.831 177.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1011 ' ' THR . . . . . 0.497 HG23 ' O ' ' A' 1010 ' ' MET . 0.6 OUTLIER -163.79 -99.51 0.02 OUTLIER 'General case' 0 C--O 1.253 1.275 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 177.311 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 4.7 p -56.92 -65.24 0.65 Allowed 'General case' 0 C--O 1.237 0.438 0 CA-C-N 114.267 -1.333 . . . . 0.0 113.57 -163.065 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.609 ' HB3' ' CD2' ' A' 1017 ' ' TYR . 8.9 mt -52.1 -37.01 52.64 Favored 'General case' 0 CA--C 1.501 -0.913 0 N-CA-C 111.558 0.207 . . . . 0.0 111.558 -177.395 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1014 ' ' GLN . . . . . 1.008 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 4.3 tm0? -54.35 -52.72 60.69 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-O 121.202 0.525 . . . . 0.0 110.974 -168.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1015 ' ' GLN . . . . . 0.691 ' O ' ' HB3' ' A' 1019 ' ' LYS . 4.6 pp0? -71.42 -36.83 71.44 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.261 -174.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1016 ' ' GLU . . . . . 0.472 ' HA ' ' HD2' ' A' 1019 ' ' LYS . 17.3 tt0 -73.2 -51.64 17.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.8 0.809 . . . . 0.0 111.015 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.726 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 12.2 m-85 -66.85 -37.79 85.14 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -174.587 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.544 ' HE3' ' HA ' ' A' ' 940' ' ' SER . 45.7 tptt -79.99 -29.31 39.49 Favored 'General case' 0 N--CA 1.461 0.094 0 CA-C-N 115.056 -0.974 . . . . 0.0 109.967 -177.574 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1019 ' ' LYS . . . . . 0.691 ' HB3' ' O ' ' A' 1015 ' ' GLN . 0.0 OUTLIER -74.29 -40.41 62.29 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.778 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A 1020 ' ' GLN . . . . . 0.599 ' HB3' ' HD3' ' A' 1001 ' ' LYS . 61.8 mt-30 -60.86 -33.28 72.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.526 162.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.553 ' HG3' ' CG ' ' A' 1002 ' ' MET . 11.5 tmm? -65.19 -51.27 62.07 Favored 'General case' 0 CA--C 1.506 -0.723 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 -178.821 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1022 ' ' LEU . . . . . 0.862 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.1 OUTLIER -84.39 -2.67 57.52 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 119.231 -0.988 . . . . 0.0 109.76 -174.485 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 53.1 m -89.0 -34.07 16.96 Favored 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 171.271 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.529 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.76 -21.31 48.11 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 169.544 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.961 ' HB2' HD12 ' A' ' 998' ' ' LEU . . . -85.55 -24.4 27.26 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.785 169.514 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.583 ' O ' HG23 ' A' 1030 ' ' VAL . 53.6 t-80 -75.84 -23.09 55.71 Favored 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 164.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1027 ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -73.04 -40.47 65.08 Favored 'General case' 0 C--N 1.318 -0.8 0 C-N-CA 123.345 0.658 . . . . 0.0 109.419 165.528 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.611 HD21 ' N ' ' A' ' 995' ' ' LEU . 26.3 mt -61.3 -43.92 98.08 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 170.288 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -59.5 -42.78 92.95 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 111.429 0.159 . . . . 0.0 111.429 173.526 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' 1026 ' ' HIS . 10.5 t -66.42 -50.58 66.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.237 0 CA-C-O 121.61 0.719 . . . . 0.0 110.346 -178.276 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1031 ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -72.24 -39.54 68.4 Favored 'General case' 0 C--O 1.204 -1.308 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.113 -176.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.508 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -63.83 -35.44 80.63 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.917 -0.313 . . . . 0.0 110.235 176.429 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 8.0 tmtm? -61.57 -44.23 97.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.607 0.718 . . . . 0.0 109.624 172.218 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.511 ' O ' HG23 ' A' 1038 ' ' VAL . 40.5 t30 -70.8 -53.57 14.88 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 114.868 -1.06 . . . . 0.0 111.165 -177.881 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.634 HD23 ' HB2' ' A' ' 991' ' ' LEU . 0.0 OUTLIER -59.0 -42.17 89.43 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.192 -173.375 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.825 ' HB2' HG13 ' A' ' 925' ' ' VAL . 3.9 pp -62.9 -48.59 78.29 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 118.372 -1.331 . . . . 0.0 109.762 178.411 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.44 ' N ' HD12 ' A' 1036 ' ' LEU . 24.0 t70 -52.21 -38.61 58.45 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 114.165 -1.38 . . . . 0.0 110.784 175.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' 1034 ' ' ASN . 25.3 t -62.46 -50.62 79.14 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.916 0 CA-C-N 113.96 -1.473 . . . . 0.0 112.827 -179.383 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.779 HG12 HG13 ' A' ' 984' ' ' ILE . 1.5 mp -76.36 -29.33 18.79 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 CA-C-N 119.881 1.219 . . . . 0.0 111.666 -177.185 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.762 ' O ' ' HA ' ' A' ' 919' ' ' ILE . 1.2 m-20 -55.87 -51.16 68.53 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.278 167.346 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.619 ' O ' ' HB3' ' A' 1044 ' ' LEU . 36.2 mt-30 -77.1 -23.29 51.85 Favored 'General case' 0 C--N 1.312 -1.036 0 O-C-N 121.911 -0.493 . . . . 0.0 111.552 177.028 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.627 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -55.53 -52.94 62.01 Favored 'General case' 0 CA--C 1.495 -1.161 0 CA-C-O 121.577 0.703 . . . . 0.0 111.011 176.372 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.952 ' HG2' ' HA ' ' A' ' 920' ' ' ARG . 0.0 OUTLIER -63.55 -35.53 80.79 Favored 'General case' 0 N--CA 1.432 -1.365 0 CA-C-N 114.775 -1.102 . . . . 0.0 108.401 -179.536 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.941 ' HG ' ' HB3' ' A' 1053 ' ' HIS . 6.7 tt -59.0 -51.16 71.26 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.407 175.037 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.713 ' O ' ' HB2' ' A' 1049 ' ' GLN . 4.9 tmmm? -71.82 -32.42 67.54 Favored 'General case' 0 N--CA 1.438 -1.03 0 CA-C-N 114.779 -1.101 . . . . 0.0 110.981 -171.326 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.552 ' HG3' ' HA ' ' A' ' 980' ' ' THR . 71.3 mmm -73.62 -44.35 57.23 Favored 'General case' 0 C--N 1.311 -1.078 0 O-C-N 121.342 -0.849 . . . . 0.0 111.38 177.646 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.604 HG12 ' O ' ' A' 1043 ' ' ARG . 43.8 mm -58.75 -52.25 62.34 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.301 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 173.648 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1048 ' ' SER . . . . . 0.941 ' HB2' ' HB2' ' A' 1053 ' ' HIS . 70.7 m -140.28 79.9 1.73 Allowed 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.461 -179.161 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1049 ' ' GLN . . . . . 0.713 ' HB2' ' O ' ' A' 1045 ' ' LYS . 21.9 tm0? -82.54 -38.46 23.71 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.235 167.401 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 19.1 t -59.96 -40.05 87.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.098 0.475 . . . . 0.0 110.724 -176.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -127.0 139.85 36.2 Favored Pre-proline 0 C--N 1.32 -0.69 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 173.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -61.42 109.21 0.7 Allowed 'Trans proline' 0 N--CA 1.463 -0.32 0 C-N-CA 121.639 1.559 . . . . 0.0 111.967 -173.014 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1053 ' ' HIS . . . . . 0.941 ' HB2' ' HB2' ' A' 1048 ' ' SER . 17.9 t-160 . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.447 -178.237 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.692 0 N-CA-C 111.796 -0.522 . . . . 0.0 111.796 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 66.3 m -155.08 89.15 3.1 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-O 120.815 0.34 . . . . 0.0 110.477 178.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -63.12 -47.22 8.6 Favored 'Trans proline' 0 C--N 1.343 0.268 0 C-N-CA 122.804 2.336 . . . . 0.0 112.44 -178.363 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -153.87 78.9 0.2 Allowed Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.765 -0.731 . . . . 0.0 111.929 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 912' ' ' ILE . . . . . 0.41 ' H ' HG13 ' A' ' 912' ' ' ILE . 2.4 pp -92.7 16.62 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.995 0.426 . . . . 0.0 111.432 -178.708 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 35.2 t -82.97 148.13 27.8 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.994 178.302 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . -133.52 53.77 0.79 Allowed Glycine 0 N--CA 1.443 -0.896 0 N-CA-C 111.434 -0.666 . . . . 0.0 111.434 178.65 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . -119.91 22.93 8.44 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.711 -178.302 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 916' ' ' GLY . . . . . 0.486 ' O ' ' HA ' ' A' ' 921' ' ' SER . . . 169.3 142.11 3.43 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.314 -179.34 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . 133.77 160.67 9.41 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.88 -0.676 . . . . 0.0 112.085 178.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -107.43 -79.66 1.22 Allowed Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 121.03 -0.605 . . . . 0.0 112.315 177.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 919' ' ' ILE . . . . . 0.72 ' HB ' ' C ' ' A' 1040 ' ' ASP . 21.2 mm -80.77 15.44 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.917 0.865 . . . . 0.0 111.419 177.367 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.914 ' HG3' ' H ' ' A' ' 921' ' ' SER . 22.6 tpt180 -177.7 -156.29 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 174.785 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 921' ' ' SER . . . . . 0.914 ' H ' ' HG3' ' A' ' 920' ' ' ARG . 20.8 m -145.32 85.13 1.72 Allowed 'General case' 0 N--CA 1.443 -0.813 0 CA-C-O 121.207 0.527 . . . . 0.0 111.235 -175.591 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 0.436 ' HB3' ' CD1' ' A' 1036 ' ' LEU . 32.4 t30 -111.41 133.57 53.62 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 168.162 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.69 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 6.9 p-10 -111.45 -35.79 5.72 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -161.411 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.416 ' HB3' HG21 ' A' ' 968' ' ' THR . 65.3 mmtt -60.75 -19.67 59.59 Favored 'General case' 0 C--N 1.318 -0.763 0 O-C-N 121.378 -0.826 . . . . 0.0 112.545 -172.523 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.782 HG11 HD13 ' A' 1036 ' ' LEU . 0.2 OUTLIER -70.72 -29.88 39.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 172.899 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.69 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.1 OUTLIER -79.02 -21.0 47.58 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 178.566 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -73.15 -43.43 61.56 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 114.602 -1.181 . . . . 0.0 109.893 171.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.697 ' OD1' ' HB ' ' A' ' 964' ' ' THR . 69.7 m-80 -74.95 -27.32 60.14 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 119.159 0.89 . . . . 0.0 111.581 174.761 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.604 HG13 HG21 ' A' ' 933' ' ' VAL . 42.8 t -65.78 -33.31 62.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.194 167.245 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.679 ' O ' ' HB2' ' A' ' 934' ' ' LYS . 98.8 m -65.58 -42.68 91.46 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 119.372 0.987 . . . . 0.0 109.778 174.605 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -73.41 -53.9 7.21 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 120.603 -0.808 . . . . 0.0 113.621 179.148 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.503 ' O ' HG23 ' A' ' 936' ' ' VAL . 1.5 pp -64.47 -47.62 78.33 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -176.638 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.604 HG21 HG13 ' A' ' 929' ' ' VAL . 72.8 t -67.49 -36.61 76.87 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 CA-C-O 121.073 0.463 . . . . 0.0 111.028 -175.208 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.679 ' HB2' ' O ' ' A' ' 930' ' ' THR . 4.1 mmtp -62.75 -42.81 99.85 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.149 -179.642 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 0.511 ' HA ' ' SD ' ' A' ' 939' ' ' MET . . . -59.31 -35.47 73.86 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.717 0.294 . . . . 0.0 111.36 177.204 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.77 ' O ' ' HB2' ' A' ' 940' ' ' SER . 66.8 t -54.55 -74.87 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.729 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 21.1 pt -71.61 -42.5 71.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -174.304 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -64.42 -53.31 50.36 Favored 'General case' 0 C--O 1.243 0.738 0 CA-C-O 121.521 0.676 . . . . 0.0 110.634 -172.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.511 ' SD ' ' HA ' ' A' ' 935' ' ' ALA . 1.8 mpt? -71.21 -24.67 62.25 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 119.439 -0.904 . . . . 0.0 109.131 -178.545 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.77 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 5.0 t -55.87 -34.91 65.91 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 121.824 0.821 . . . . 0.0 110.867 -175.456 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 12.3 m -97.52 -13.82 21.44 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 114.874 -1.057 . . . . 0.0 110.63 -176.215 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 942' ' ' LYS . . . . . . . . . . . . . 8.2 tmtt? -83.19 -25.65 31.58 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 176.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.857 HG22 ' HB2' ' A' ' 949' ' ' GLU . 2.7 pp -71.75 -8.24 10.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -178.63 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.41 ' HB3' ' HD3' ' A' ' 945' ' ' PRO . 35.6 tt0 -90.12 -57.49 0.26 Allowed Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -177.507 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.41 ' HD3' ' HB3' ' A' ' 944' ' ' GLN . 42.9 Cg_endo -68.11 -28.02 35.06 Favored 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 121.75 1.633 . . . . 0.0 112.027 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.528 ' HB1' ' HD2' ' A' ' 947' ' ' PRO . . . -92.35 167.07 15.62 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.348 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.528 ' HD2' ' HB1' ' A' ' 946' ' ' ALA . 28.5 Cg_endo -63.27 170.0 8.57 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.508 2.139 . . . . 0.0 111.305 172.526 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.867 ' HB3' HG11 ' A' 1009 ' ' VAL . 4.7 Cg_exo -40.45 125.94 2.04 Favored 'Trans proline' 0 CA--C 1.507 -0.858 0 C-N-CA 123.423 2.749 . . . . 0.0 113.121 177.54 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.857 ' HB2' HG22 ' A' ' 943' ' ' ILE . 12.1 tp10 -63.21 -21.13 66.02 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 114.743 -1.117 . . . . 0.0 109.116 171.542 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.464 ' HB3' ' CD ' ' A' ' 953' ' ' PRO . 28.1 tt0 73.58 -12.88 0.78 Allowed 'General case' 0 C--N 1.346 0.426 0 O-C-N 124.106 0.879 . . . . 0.0 109.084 -167.612 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.728 ' HE1' HG21 ' A' ' 943' ' ' ILE . 23.1 m-85 53.67 -37.45 0.02 OUTLIER 'General case' 0 C--O 1.216 -0.69 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 178.513 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 0.754 ' HA ' ' CG2' ' A' ' 955' ' ' VAL . 43.4 t -56.13 -44.71 99.83 Favored Pre-proline 0 C--N 1.323 -0.57 0 C-N-CA 123.005 0.522 . . . . 0.0 111.322 171.014 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 0.593 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 47.0 Cg_exo -52.34 -36.36 68.31 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 121.843 1.696 . . . . 0.0 111.915 170.169 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.571 ' HE3' ' HG2' ' A' ' 949' ' ' GLU . 32.3 ttm -76.69 -31.01 56.95 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.123 176.001 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.754 ' CG2' ' HA ' ' A' ' 952' ' ' VAL . 85.4 t -53.26 -39.36 34.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 168.826 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.58 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 0.7 OUTLIER -63.8 -39.64 94.74 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.124 175.104 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -76.18 -46.7 27.23 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.442 -171.277 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.662 HG22 HD23 ' A' ' 962' ' ' LEU . 11.7 p -87.8 -28.45 5.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.347 -178.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 959' ' ' GLY . . . . . 0.505 ' O ' ' HG2' ' A' ' 963' ' ' ARG . . . -61.99 -46.93 93.05 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.471 -0.871 . . . . 0.0 111.2 176.379 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 960' ' ' LEU . . . . . 0.467 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 9.5 tt -64.62 -34.27 77.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.039 0.447 . . . . 0.0 110.206 177.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.413 ' O ' ' HB3' ' A' ' 928' ' ' ASN . . . -72.5 -46.78 53.12 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -178.527 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.881 HD13 HD22 ' A' ' 995' ' ' LEU . 4.0 pp -84.55 -18.07 36.86 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 119.345 -0.36 . . . . 0.0 111.482 -176.37 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.506 ' HG3' ' N ' ' A' ' 964' ' ' THR . 8.5 ptp180 -70.31 -37.9 74.84 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 118.829 -1.148 . . . . 0.0 110.091 166.673 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 964' ' ' THR . . . . . 0.697 ' HB ' ' OD1' ' A' ' 928' ' ' ASN . 10.5 m -71.13 -26.46 63.02 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.74 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.491 ' CD1' HG23 ' A' ' 925' ' ' VAL . 9.7 tp -63.27 -46.36 87.19 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.618 169.145 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 0.796 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 9.7 tt -66.62 -33.25 75.24 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -177.437 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 967' ' ' ALA . . . . . 0.55 ' HA ' ' HB3' ' A' ' 970' ' ' ASP . . . -75.24 -32.95 61.26 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 115.342 -0.845 . . . . 0.0 112.224 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.416 HG21 ' HB3' ' A' ' 924' ' ' LYS . 2.4 p -71.53 -35.26 70.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.173 0.511 . . . . 0.0 110.157 176.302 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.76 HG12 HG23 ' A' ' 984' ' ' ILE . 48.6 t -74.45 -34.92 37.41 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.731 170.345 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.601 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 12.8 t70 -66.66 -41.57 87.97 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 122.422 1.106 . . . . 0.0 108.77 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.681 ' O ' HG23 ' A' ' 975' ' ' VAL . 36.0 tt0 -66.23 -29.11 69.29 Favored 'General case' 0 N--CA 1.436 -1.171 0 CA-C-N 113.818 -1.537 . . . . 0.0 110.308 178.407 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 69.0 m -69.62 -19.09 63.64 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.643 175.635 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.93 ' HA ' HD13 ' A' ' 984' ' ' ILE . 5.8 tt -66.09 -51.14 47.58 Favored Pre-proline 0 N--CA 1.454 -0.272 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.333 -177.747 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.677 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 1.1 Cg_endo -85.7 0.18 8.53 Favored 'Trans proline' 0 C--N 1.357 1.01 0 C-N-CA 121.85 1.7 . . . . 0.0 113.416 173.191 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.681 HG23 ' O ' ' A' ' 971' ' ' GLU . 11.6 t -64.89 -43.1 96.33 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.045 171.768 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.441 HD22 ' OG1' ' A' ' 980' ' ' THR . 5.3 mp -99.31 127.18 35.29 Favored Pre-proline 0 C--N 1.324 -0.516 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.172 175.25 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 976' ' ' LEU . 4.9 Cg_exo -36.34 -78.54 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 125.21 3.94 . . . . 0.0 115.202 -170.449 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -153.13 91.18 1.5 Allowed 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 111.733 0.272 . . . . 0.0 111.733 -175.368 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 979' ' ' SER . . . . . . . . . . . . . 14.1 p 173.83 -57.51 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.315 0 O-C-N 123.841 0.713 . . . . 0.0 109.936 178.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.698 HG23 ' HB1' ' A' 1042 ' ' ALA . 14.4 m -61.8 -14.75 35.78 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.939 -179.394 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.656 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 16.1 m-70 -50.25 -39.1 43.95 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.013 -177.714 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 14.9 ptm180 -82.1 -18.56 42.59 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.675 -0.239 . . . . 0.0 111.121 -170.516 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.889 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 1.3 tp10 -75.19 -43.02 54.38 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 172.231 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.93 HD13 ' HA ' ' A' ' 973' ' ' LEU . 3.2 mp -65.54 -32.63 59.06 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 177.227 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 985' ' ' GLU . . . . . 0.656 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 34.6 mt-10 -55.25 -52.4 63.51 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.305 0.574 . . . . 0.0 110.262 174.417 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 45.8 ttm -72.71 -40.39 66.21 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 114.979 -1.01 . . . . 0.0 111.261 -173.47 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.867 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -75.02 -50.93 14.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.524 -1.216 . . . . 0.0 112.71 -172.189 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.796 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 22.4 pt20 -62.88 -21.99 66.39 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 120.074 -0.651 . . . . 0.0 109.803 175.443 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 989' ' ' LYS . . . . . 0.722 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 59.2 tttt -74.91 -39.97 61.14 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.491 170.625 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.432 ' HB3' ' O ' ' A' ' 987' ' ' ALA . 18.0 tp -52.54 -59.22 4.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.665 177.576 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.56 ' HB3' ' CD1' ' A' 1035 ' ' LEU . 2.4 pp -59.8 -34.84 73.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.771 0.796 . . . . 0.0 109.481 177.795 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 992' ' ' ASN . . . . . 0.722 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 24.6 t-20 -52.85 -54.03 40.27 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 113.747 -1.569 . . . . 0.0 112.08 -178.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 6.0 m -78.83 -30.32 45.22 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 112.054 0.391 . . . . 0.0 112.054 -179.328 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.12 -42.76 88.74 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 119.488 -0.885 . . . . 0.0 111.488 176.33 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 0.881 HD22 HD13 ' A' ' 962' ' ' LEU . 1.2 pp -62.62 -23.26 66.97 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 122.717 0.407 . . . . 0.0 110.223 170.549 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -78.45 -27.23 46.39 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 119.456 -0.898 . . . . 0.0 110.406 174.564 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -73.99 -45.71 48.29 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 170.504 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.853 HD21 ' HE2' ' A' 1021 ' ' MET . 0.7 OUTLIER -56.7 -42.97 80.05 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.559 -1.2 . . . . 0.0 111.184 -178.508 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.606 ' HA ' ' CE ' ' A' 1002 ' ' MET . 69.0 mt -65.37 -43.99 94.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 O-C-N 122.458 -0.151 . . . . 0.0 111.255 -179.175 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 23.6 m-80 -60.4 -36.02 77.12 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.233 0.54 . . . . 0.0 111.446 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.465 ' O ' ' HB3' ' A' 1017 ' ' TYR . 13.5 mptt -73.56 -47.18 42.63 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.729 -174.609 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1002 ' ' MET . . . . . 1.044 ' HB3' ' HG3' ' A' 1021 ' ' MET . 16.1 ptt? -65.1 -23.79 67.25 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.841 0.829 . . . . 0.0 109.577 179.139 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.528 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 8.7 tptm -70.99 -44.99 64.8 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.162 -165.793 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.566 ' HB2' ' CD1' ' A' 1017 ' ' TYR . 6.7 mp -83.02 -13.09 56.57 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.913 178.62 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.641 ' HB2' ' CB ' ' A' 1017 ' ' TYR . . . -70.47 -37.41 74.25 Favored 'General case' 0 C--O 1.211 -0.951 0 C-N-CA 118.904 -1.118 . . . . 0.0 109.532 178.202 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.799 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 3.9 pp0? -75.47 -40.12 57.81 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 119.151 -0.452 . . . . 0.0 111.874 171.665 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.585 ' HG3' ' CD2' ' A' 1008 ' ' TYR . 5.6 pt20 -53.68 -37.97 63.73 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 121.32 0.581 . . . . 0.0 110.349 -175.747 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.8 ' HB2' HD22 ' A' 1013 ' ' LEU . 73.4 m-85 -128.99 43.18 3.19 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.364 169.775 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1009 ' ' VAL . . . . . 1.071 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 14.7 p -48.99 -21.91 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.702 169.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1010 ' ' MET . . . . . 0.427 ' O ' HG23 ' A' 1011 ' ' THR . 65.3 mtt -31.8 -55.97 0.29 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.111 -1.404 . . . . 0.0 111.548 172.062 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1011 ' ' THR . . . . . 0.427 HG23 ' O ' ' A' 1010 ' ' MET . 1.7 p -159.25 -91.04 0.03 OUTLIER 'General case' 0 C--O 1.249 1.062 0 N-CA-C 113.332 0.864 . . . . 0.0 113.332 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 32.4 t -51.27 -65.57 0.53 Allowed 'General case' 0 C--O 1.237 0.41 0 CA-C-N 114.411 -1.268 . . . . 0.0 112.399 -166.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.8 HD22 ' HB2' ' A' 1008 ' ' TYR . 8.0 mp -47.88 -43.26 28.46 Favored 'General case' 0 CA--C 1.507 -0.674 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -179.741 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1014 ' ' GLN . . . . . 1.071 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.8 OUTLIER -57.08 -47.79 80.17 Favored 'General case' 0 C--N 1.319 -0.753 0 O-C-N 123.299 0.374 . . . . 0.0 111.509 -167.724 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A 1015 ' ' GLN . . . . . 0.737 ' O ' ' HB3' ' A' 1019 ' ' LYS . 15.0 mm100 -72.46 -37.98 68.37 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-O 120.93 0.395 . . . . 0.0 111.13 -176.651 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -69.33 -55.28 10.91 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.631 0.729 . . . . 0.0 110.828 -179.409 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.708 ' CE2' ' HG ' ' A' 1013 ' ' LEU . 13.6 m-85 -65.49 -39.57 92.07 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.758 -1.11 . . . . 0.0 113.779 -174.489 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.59 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 25.5 tptp -79.9 -28.91 39.8 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.501 -176.942 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1019 ' ' LYS . . . . . 0.737 ' HB3' ' O ' ' A' 1015 ' ' GLN . 0.0 OUTLIER -73.23 -45.32 56.77 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 175.072 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A 1020 ' ' GLN . . . . . 0.42 ' HB3' ' HG2' ' A' 1001 ' ' LYS . 55.9 mt-30 -54.91 -35.34 64.05 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.822 162.437 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1021 ' ' MET . . . . . 1.044 ' HG3' ' HB3' ' A' 1002 ' ' MET . 1.9 tmt? -64.71 -51.92 59.85 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 110.275 -0.268 . . . . 0.0 110.275 -179.021 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1022 ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' 1022 ' ' LEU . 0.0 OUTLIER -78.69 -8.61 58.86 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 119.511 -0.876 . . . . 0.0 109.778 -175.613 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 91.8 m -86.09 -36.88 19.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.08 174.547 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.553 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -79.28 -22.76 44.22 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-O 121.412 0.625 . . . . 0.0 109.415 173.743 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.728 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -86.27 -24.83 25.81 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.193 169.786 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.556 ' O ' HG23 ' A' 1030 ' ' VAL . 53.3 t60 -69.21 -36.28 77.09 Favored 'General case' 0 C--O 1.211 -0.947 0 N-CA-C 108.569 -0.901 . . . . 0.0 108.569 164.104 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1027 ' ' ALA . . . . . 0.553 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -58.4 -45.43 88.37 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 123.453 0.701 . . . . 0.0 111.204 162.043 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.637 HD21 ' N ' ' A' ' 995' ' ' LEU . 31.4 mt -56.96 -46.57 82.07 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 118.706 0.684 . . . . 0.0 109.64 173.642 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -59.33 -43.64 92.69 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 173.079 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' 1026 ' ' HIS . 17.0 t -66.15 -50.68 67.01 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 CA-C-O 121.854 0.835 . . . . 0.0 110.721 -177.104 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.78 ' O ' HD13 ' A' 1035 ' ' LEU . 17.3 m-20 -75.96 -31.05 58.85 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.139 -175.137 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.6 ' HA ' ' CD1' ' A' 1035 ' ' LEU . . . -69.13 -34.02 74.36 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 171.684 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.556 ' HB3' ' O ' ' A' 1030 ' ' VAL . 0.0 OUTLIER -58.63 -37.4 75.85 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 167.63 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.454 ' O ' ' HB3' ' A' 1037 ' ' ASP . 53.2 t30 -79.35 -51.41 9.44 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 114.334 -1.303 . . . . 0.0 112.702 -173.057 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.867 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 0.0 OUTLIER -59.8 -31.39 69.66 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 119.142 0.883 . . . . 0.0 111.485 -174.137 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.782 HD13 HG11 ' A' ' 925' ' ' VAL . 9.9 tp -68.82 -51.24 42.8 Favored 'General case' 0 C--N 1.344 0.338 0 C-N-CA 117.262 -1.775 . . . . 0.0 109.41 175.148 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.454 ' HB3' ' O ' ' A' 1034 ' ' ASN . 25.3 t70 -45.03 -42.32 8.3 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 114.856 -1.066 . . . . 0.0 111.251 173.181 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.491 ' CG1' ' HG3' ' A' ' 983' ' ' GLU . 45.6 t -61.7 -40.6 87.34 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.489 0 CA-C-N 114.559 -1.201 . . . . 0.0 112.476 177.635 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.789 HG12 HG13 ' A' ' 984' ' ' ILE . 1.9 mp -83.31 -25.0 7.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 118.589 0.632 . . . . 0.0 110.522 177.327 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.761 ' O ' ' HG3' ' A' 1043 ' ' ARG . 68.9 m-20 -61.2 -45.1 95.97 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 164.513 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.491 ' HG2' HG13 ' A' ' 919' ' ' ILE . 43.0 mt-30 -62.04 -48.89 78.25 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.653 173.375 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.889 ' HB2' ' HG2' ' A' ' 983' ' ' GLU . . . -54.98 -45.86 75.03 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.61 -176.394 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.761 ' HG3' ' O ' ' A' 1040 ' ' ASP . 0.0 OUTLIER -59.9 -42.76 94.54 Favored 'General case' 0 N--CA 1.441 -0.875 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.906 -174.799 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.408 ' N ' ' HD3' ' A' 1043 ' ' ARG . 43.0 tp -80.66 -34.72 34.59 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 121.13 0.49 . . . . 0.0 110.582 -178.684 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.564 ' HB2' ' HB2' ' A' 1053 ' ' HIS . 61.5 tttt -62.93 -49.8 73.35 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.016 -178.603 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.463 ' HG2' ' O ' ' A' 1042 ' ' ALA . 25.4 mmt -64.78 -36.91 85.85 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.676 -176.714 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.615 HG12 ' O ' ' A' 1043 ' ' ARG . 24.7 mm -52.88 -54.94 14.02 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.827 172.576 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 50.0 m -133.01 63.51 1.63 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.457 0.646 . . . . 0.0 111.805 -177.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -81.26 99.75 8.78 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.724 171.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1050 ' ' SER . . . . . 0.477 ' O ' ' HB2' ' A' 1051 ' ' ARG . 44.1 m -92.68 -1.78 56.59 Favored 'General case' 0 C--N 1.308 -1.236 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 173.037 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1051 ' ' ARG . . . . . 1.082 ' HB3' ' HD3' ' A' 1052 ' ' PRO . 44.8 ttp180 164.38 -68.34 0.0 OUTLIER Pre-proline 0 CA--C 1.538 0.494 0 CA-C-N 113.91 -1.495 . . . . 0.0 108.564 -177.204 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1052 ' ' PRO . . . . . 1.082 ' HD3' ' HB3' ' A' 1051 ' ' ARG . 67.4 Cg_endo -108.16 -152.33 0.02 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.173 0 C-N-CA 122.909 2.406 . . . . 0.0 112.028 177.419 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 1053 ' ' HIS . . . . . 0.564 ' HB2' ' HB2' ' A' 1045 ' ' LYS . 21.6 t-80 . . . . . 0 C--N 1.326 -0.421 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 171.426 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.747 0 N-CA-C 111.741 -0.544 . . . . 0.0 111.741 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 32.5 m -88.63 118.26 69.2 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-O 120.905 0.384 . . . . 0.0 111.125 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -92.05 25.55 0.46 Allowed 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 123.158 2.572 . . . . 0.0 110.995 174.034 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . 150.69 -155.65 26.28 Favored Glycine 0 N--CA 1.444 -0.801 0 N-CA-C 109.856 -1.298 . . . . 0.0 109.856 -175.361 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 9.5 tp -149.5 126.31 2.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 117.42 0.61 . . . . 0.0 110.568 176.246 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 8.3 p -172.02 -28.55 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.777 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 139.05 -27.35 2.67 Favored Glycine 0 N--CA 1.447 -0.613 0 N-CA-C 111.168 -0.773 . . . . 0.0 111.168 -176.746 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 82.89 -155.38 33.23 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.315 178.293 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . -82.87 60.09 4.91 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.985 -0.626 . . . . 0.0 112.661 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . -164.13 117.04 0.74 Allowed Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.031 178.461 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 918' ' ' GLY . . . . . 0.446 ' HA2' ' HD2' ' A' 1043 ' ' ARG . . . 171.88 150.84 7.41 Favored Glycine 0 C--O 1.226 -0.399 0 C-N-CA 120.862 -0.685 . . . . 0.0 111.792 179.257 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 919' ' ' ILE . . . . . 0.984 ' HA ' ' HB3' ' A' 1040 ' ' ASP . 38.7 pt -61.44 -175.78 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.344 0.336 0 CA-C-N 117.459 0.63 . . . . 0.0 111.675 -178.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.783 ' HG2' HG13 ' A' ' 919' ' ' ILE . 34.7 mmt180 71.33 20.5 4.96 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.745 174.737 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 921' ' ' SER . . . . . 0.422 ' HA ' ' OD2' ' A' 1040 ' ' ASP . 23.0 t 77.05 105.97 0.08 Allowed 'General case' 0 CA--C 1.513 -0.474 0 O-C-N 124.155 0.91 . . . . 0.0 110.293 -178.571 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -61.41 172.1 1.25 Allowed 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 114.675 -1.148 . . . . 0.0 108.968 173.043 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.682 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 38.8 t70 -83.99 -87.22 0.11 Allowed 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -159.698 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.434 ' HA ' ' HG2' ' A' ' 927' ' ' GLU . 35.0 mmtp -56.74 -27.96 60.27 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -171.821 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.656 HG23 HD22 ' A' 1036 ' ' LEU . 32.2 m -62.93 -30.95 50.82 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-O 121.365 0.602 . . . . 0.0 110.322 178.325 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.682 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -77.38 -30.69 53.84 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.696 178.479 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 927' ' ' GLU . . . . . 0.61 ' O ' HG22 ' A' ' 930' ' ' THR . 7.7 pt-20 -76.4 -24.0 54.06 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 119.096 -1.042 . . . . 0.0 110.785 176.582 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -71.41 -29.94 65.49 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 171.551 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.539 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 86.9 t -80.35 -30.07 12.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.236 175.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.61 HG22 ' O ' ' A' ' 927' ' ' GLU . 2.8 t -65.81 -33.73 76.54 Favored 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 118.215 -1.394 . . . . 0.0 108.257 171.24 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -74.01 -53.51 7.02 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-N 115.366 -0.834 . . . . 0.0 113.572 176.341 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.539 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.2 pp -64.38 -48.37 75.75 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -177.16 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.464 HG23 HG13 ' A' ' 929' ' ' VAL . 54.6 t -69.35 -31.78 50.86 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.319 0 CA-C-O 120.755 0.312 . . . . 0.0 110.852 -175.825 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.561 ' HD2' ' C ' ' A' ' 934' ' ' LYS . 2.1 tmmm? -56.26 -50.3 71.73 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 175.44 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -57.88 -36.26 72.12 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.154 0.284 . . . . 0.0 111.29 -178.539 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.821 HG22 ' HB1' ' A' 1025 ' ' ALA . 86.1 t -50.82 -73.9 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.583 178.083 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 28.4 pt -67.25 -35.83 75.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -177.505 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -67.49 -55.73 12.38 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.733 0.778 . . . . 0.0 110.77 -174.601 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.557 ' HA ' ' HD2' ' A' ' 942' ' ' LYS . 1.3 mpt? -73.47 -23.9 60.13 Favored 'General case' 0 N--CA 1.438 -1.067 0 C-N-CA 119.776 -0.77 . . . . 0.0 108.969 -176.83 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.608 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 44.5 t -53.16 -46.45 68.89 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.617 -178.809 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 5.7 m -86.82 -4.01 59.13 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 114.996 -1.002 . . . . 0.0 109.813 -175.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.7 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 33.5 mttp -81.01 -0.77 41.08 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 167.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.793 HD11 ' HA ' ' A' 1015 ' ' GLN . 9.6 tt -57.27 -16.58 4.94 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.116 162.511 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.725 ' HB3' ' HD3' ' A' ' 945' ' ' PRO . 34.3 tt0 -61.82 -52.75 66.3 Favored Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -175.517 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.725 ' HD3' ' HB3' ' A' ' 944' ' ' GLN . 50.7 Cg_exo -55.21 121.18 9.44 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 122.085 1.856 . . . . 0.0 112.181 172.281 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.479 ' HB3' ' HD3' ' A' ' 947' ' ' PRO . . . -61.49 -47.4 93.35 Favored Pre-proline 0 CA--C 1.539 0.528 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -176.875 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.479 ' HD3' ' HB3' ' A' ' 946' ' ' ALA . 52.7 Cg_exo -57.16 132.63 52.47 Favored 'Trans proline' 0 C--N 1.357 1.003 0 C-N-CA 121.823 1.682 . . . . 0.0 111.692 176.404 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.845 ' HB3' HG11 ' A' 1009 ' ' VAL . 1.9 Cg_endo -46.15 131.61 14.43 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 123.51 2.807 . . . . 0.0 114.384 -173.157 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.487 ' C ' ' H ' ' A' ' 951' ' ' TYR . 4.6 tt0 -70.26 -12.55 61.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.115 -0.948 . . . . 0.0 108.865 168.148 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.602 ' HB2' ' HG2' ' A' ' 953' ' ' PRO . 45.8 mm-40 75.98 -22.85 0.26 Allowed 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 114.364 -1.289 . . . . 0.0 109.772 -172.887 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.739 ' HB3' ' HG3' ' A' 1002 ' ' MET . 21.0 m-85 55.86 -54.91 0.02 OUTLIER 'General case' 0 C--O 1.221 -0.396 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 178.531 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 0.889 HG13 ' HD3' ' A' ' 953' ' ' PRO . 3.4 p -52.22 -36.81 36.05 Favored Pre-proline 0 CA--C 1.55 0.959 0 CA-C-N 118.506 0.594 . . . . 0.0 112.557 175.045 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 0.889 ' HD3' HG13 ' A' ' 952' ' ' VAL . 37.3 Cg_exo -53.47 -40.01 80.11 Favored 'Trans proline' 0 C--N 1.358 1.045 0 C-N-CA 121.699 1.599 . . . . 0.0 112.208 169.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.658 ' O ' HG23 ' A' ' 958' ' ' VAL . 8.5 ttt -76.33 -48.86 18.56 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.005 177.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.695 HG12 ' HA ' ' A' ' 952' ' ' VAL . 0.4 OUTLIER -54.05 -31.42 21.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.545 173.736 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 5.5 tttm -65.52 -40.97 93.61 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.064 170.738 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 957' ' ' GLU . . . . . 0.573 ' HG2' ' O ' ' A' ' 954' ' ' MET . 14.5 pt-20 -79.38 -42.95 24.4 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 120.393 -0.523 . . . . 0.0 111.023 -176.2 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.658 HG23 ' O ' ' A' ' 954' ' ' MET . 2.2 t -66.26 -38.26 81.49 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.821 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 173.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 959' ' ' GLY . . . . . 0.429 ' O ' ' HG2' ' A' ' 963' ' ' ARG . . . -58.49 -38.88 92.16 Favored Glycine 0 N--CA 1.434 -1.462 0 N-CA-C 110.813 -0.915 . . . . 0.0 110.813 176.15 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 960' ' ' LEU . . . . . 0.636 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 25.3 tp -69.14 -35.82 76.77 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 120.766 0.317 . . . . 0.0 110.818 174.888 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -72.29 -43.31 64.43 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.135 0.493 . . . . 0.0 111.643 -176.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.88 HD11 ' HG ' ' A' ' 995' ' ' LEU . 4.4 pp -86.33 -16.7 36.61 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.968 -176.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.636 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 0.5 OUTLIER -75.42 -32.79 60.83 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 119.064 -1.054 . . . . 0.0 109.939 164.239 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 964' ' ' THR . . . . . 0.562 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 59.1 m -64.55 -34.44 78.25 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 175.169 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.516 HD21 HD21 ' A' 1035 ' ' LEU . 26.9 tp -62.78 -41.51 99.28 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.776 173.328 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 0.744 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.0 tt -70.06 -36.68 75.16 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.049 -175.327 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -72.45 -38.13 68.37 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.306 178.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 7.9 p -66.07 -41.01 91.33 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 118.644 0.656 . . . . 0.0 110.005 175.616 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.564 HG12 HG23 ' A' ' 984' ' ' ILE . 74.4 t -68.25 -39.11 80.58 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.526 173.631 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 970' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -66.53 -39.68 88.75 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 122.228 1.014 . . . . 0.0 108.77 -177.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.569 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 28.7 tt0 -70.69 -30.58 67.19 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 114.488 -1.233 . . . . 0.0 110.335 178.179 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 70.2 m -66.26 -17.74 64.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.272 173.423 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.615 ' HA ' HD13 ' A' ' 984' ' ' ILE . 10.5 tt -69.41 -51.81 16.17 Favored Pre-proline 0 CA--C 1.53 0.187 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.776 -176.085 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.582 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 94.9 Cg_endo -87.42 2.04 6.9 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 121.178 1.252 . . . . 0.0 113.45 174.426 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' ' 971' ' ' GLU . 25.1 t -85.79 -42.27 15.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.253 172.678 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 976' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -106.67 111.75 63.82 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.249 -178.247 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -78.37 -141.93 0.02 OUTLIER 'Trans proline' 0 CA--C 1.532 0.382 0 C-N-CA 123.422 2.748 . . . . 0.0 111.967 178.051 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 978' ' ' ALA . . . . . 0.724 ' O ' ' HB3' ' A' 1046 ' ' MET . . . 67.74 16.13 9.72 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.881 173.912 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.431 ' HB2' ' O ' ' A' ' 978' ' ' ALA . 48.5 m 78.18 11.24 1.88 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.328 0.651 . . . . 0.0 112.471 179.534 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.629 ' OG1' ' HA ' ' A' 1043 ' ' ARG . 85.5 m -64.66 -21.94 66.85 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.147 0.499 . . . . 0.0 110.778 177.58 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 981' ' ' HIS . . . . . . . . . . . . . 9.8 p-80 -50.79 -27.36 7.11 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 178.764 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 982' ' ' ARG . . . . . 0.511 ' HA ' ' HG2' ' A' ' 985' ' ' GLU . 0.0 OUTLIER -83.11 -21.87 33.55 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 119.481 1.037 . . . . 0.0 111.149 -176.127 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.458 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 1.4 mp0 -77.03 -38.7 52.32 Favored 'General case' 0 CA--C 1.499 -0.981 0 CA-C-O 121.764 0.792 . . . . 0.0 109.143 168.552 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.847 HG12 HG12 ' A' 1039 ' ' ILE . 73.8 mt -68.17 -36.28 74.63 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.18 0 CA-C-N 114.145 -1.389 . . . . 0.0 109.503 -176.354 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 985' ' ' GLU . . . . . 0.78 ' O ' ' HD3' ' A' ' 989' ' ' LYS . 13.3 pt-20 -74.29 -40.8 62.03 Favored 'General case' 0 N--CA 1.439 -0.988 0 C-N-CA 118.159 -1.416 . . . . 0.0 109.426 -178.557 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 986' ' ' MET . . . . . 0.53 ' O ' ' HB2' ' A' ' 989' ' ' LYS . 2.1 tmt? -68.63 -40.0 80.5 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.56 -174.428 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.973 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -71.88 -45.78 60.09 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.571 -174.104 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.744 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 29.4 pt20 -60.31 -23.89 64.56 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.808 175.284 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 989' ' ' LYS . . . . . 0.799 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 2.6 mptp? -72.55 -39.05 67.78 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.986 0.898 . . . . 0.0 111.05 171.868 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.591 ' HB3' ' O ' ' A' ' 987' ' ' ALA . 18.6 tp -54.32 -59.66 4.38 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.414 -1.267 . . . . 0.0 111.853 179.135 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.528 ' HB2' HD13 ' A' 1035 ' ' LEU . 0.4 OUTLIER -59.96 -33.06 71.41 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.745 0.783 . . . . 0.0 109.417 177.722 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 992' ' ' ASN . . . . . 0.799 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 22.7 t-20 -52.03 -52.57 50.01 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 113.911 -1.495 . . . . 0.0 111.438 179.569 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 2.6 p -77.59 -31.61 53.12 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.673 0.619 . . . . 0.0 112.673 -178.313 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -68.47 -40.51 80.99 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 119.729 -0.789 . . . . 0.0 111.189 176.774 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 0.88 ' HG ' HD11 ' A' ' 962' ' ' LEU . 0.9 OUTLIER -57.09 -36.65 70.84 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.066 0.546 . . . . 0.0 109.935 166.843 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -66.65 -30.39 70.63 Favored 'General case' 0 C--N 1.312 -1.052 0 C-N-CA 118.985 -1.086 . . . . 0.0 110.903 174.756 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -75.42 -38.33 59.86 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.853 -0.53 . . . . 0.0 110.678 174.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.882 HD13 ' HB2' ' A' 1025 ' ' ALA . 1.7 tp -56.23 -44.85 80.0 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 120.968 0.413 . . . . 0.0 110.843 178.546 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.51 ' O ' ' HB2' ' A' 1003 ' ' LYS . 77.8 mt -61.21 -43.97 97.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.084 -176.493 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 32.0 m-80 -58.64 -37.49 76.06 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.251 0.548 . . . . 0.0 111.915 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.492 ' O ' ' HB3' ' A' 1017 ' ' TYR . 33.6 mmtp -79.1 -40.92 29.88 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 122.291 1.043 . . . . 0.0 108.656 -176.319 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.739 ' HG3' ' HB3' ' A' ' 951' ' ' TYR . 9.0 tpp -61.15 -30.09 70.18 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 113.693 -1.594 . . . . 0.0 109.461 176.635 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.563 ' O ' ' HG3' ' A' 1006 ' ' GLN . 4.8 tptm -75.41 -53.54 8.54 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 114.928 -1.033 . . . . 0.0 111.696 -166.652 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.752 ' HB3' HD23 ' A' 1013 ' ' LEU . 7.3 mp -76.61 -12.43 60.01 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.149 -178.593 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.677 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -67.91 -42.63 80.81 Favored 'General case' 0 C--O 1.212 -0.874 0 C-N-CA 119.525 -0.87 . . . . 0.0 109.153 177.034 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.879 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 1.2 pp0? -74.77 -33.16 62.25 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 119.024 -0.512 . . . . 0.0 111.668 170.3 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.602 ' CG ' ' HA ' ' A' 1004 ' ' LEU . 20.7 mm-40 -47.53 -53.37 14.62 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.116 0.484 . . . . 0.0 110.388 175.609 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.916 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 40.1 m-85 -119.6 40.35 3.4 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.277 -0.569 . . . . 0.0 110.407 175.249 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1009 ' ' VAL . . . . . 1.074 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 14.8 p -51.62 -22.29 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 121.382 0.611 . . . . 0.0 110.632 173.733 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 20.0 mmt -41.16 -38.18 1.03 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.242 -1.345 . . . . 0.0 111.706 175.486 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -174.47 -81.77 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 174.0 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 16.6 p -53.43 -73.52 0.04 OUTLIER 'General case' 0 C--O 1.241 0.649 0 CA-C-N 115.12 -0.945 . . . . 0.0 113.051 -166.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.916 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 3.2 mp -46.1 -42.17 13.27 Favored 'General case' 0 CA--C 1.501 -0.921 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -179.502 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1014 ' ' GLN . . . . . 1.074 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 1.5 tt0 -57.33 -46.37 83.33 Favored 'General case' 0 N--CA 1.438 -1.035 0 O-C-N 123.753 0.658 . . . . 0.0 111.616 -166.552 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1015 ' ' GLN . . . . . 0.793 ' HA ' HD11 ' A' ' 943' ' ' ILE . 47.2 mt-30 -72.52 -34.46 67.6 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 121.013 0.435 . . . . 0.0 110.103 -174.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -71.17 -53.25 15.11 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.856 0.836 . . . . 0.0 110.466 176.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.717 ' CE2' ' HG ' ' A' 1013 ' ' LEU . 7.1 m-85 -67.77 -38.82 83.92 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.618 -1.174 . . . . 0.0 113.95 -172.479 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.513 ' HD2' ' SD ' ' A' 1021 ' ' MET . 24.0 tptm -80.03 -29.88 39.42 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.91 -176.216 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1019 ' ' LYS . . . . . 0.716 ' HB3' ' O ' ' A' 1015 ' ' GLN . 1.5 tmtt? -76.21 -40.32 52.51 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.73 176.552 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1020 ' ' GLN . . . . . 0.419 ' N ' ' HD3' ' A' 1019 ' ' LYS . 94.1 mt-30 -63.9 -28.48 69.86 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.731 162.84 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.733 ' HG2' HD12 ' A' ' 998' ' ' LEU . 1.6 ttp -65.61 -47.11 76.77 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 176.622 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1022 ' ' LEU . . . . . 0.701 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -79.19 -8.96 59.42 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 119.165 -1.014 . . . . 0.0 109.767 -179.249 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 92.2 m -77.0 -44.03 32.5 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 172.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.47 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -78.88 -21.1 47.96 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-O 121.383 0.611 . . . . 0.0 109.659 175.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.882 ' HB2' HD13 ' A' ' 998' ' ' LEU . . . -83.94 -24.01 30.88 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.128 170.464 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.539 ' HB2' ' O ' ' A' 1022 ' ' LEU . 4.4 t-80 -77.96 -22.66 49.15 Favored 'General case' 0 C--O 1.216 -0.658 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 165.846 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1027 ' ' ALA . . . . . 0.47 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -69.6 -42.39 74.47 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 123.094 0.558 . . . . 0.0 109.768 162.378 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.66 HD21 ' N ' ' A' ' 995' ' ' LEU . 34.7 mt -57.25 -49.48 75.93 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 169.696 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -58.05 -43.23 86.77 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 174.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.469 ' O ' ' HB2' ' A' 1033 ' ' LYS . 2.8 t -67.72 -51.01 55.23 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.234 0 CA-C-O 121.287 0.565 . . . . 0.0 110.394 -176.1 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.635 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 18.0 m-20 -76.6 -27.31 55.73 Favored 'General case' 0 C--O 1.213 -0.821 0 CA-C-N 115.475 -0.784 . . . . 0.0 112.024 -176.424 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.652 ' HA ' HD22 ' A' 1035 ' ' LEU . . . -61.47 -40.7 95.47 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 167.835 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.469 ' HB2' ' O ' ' A' 1030 ' ' VAL . 94.3 mttt -62.86 -39.72 95.27 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.444 0.64 . . . . 0.0 109.72 171.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.635 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 46.6 t30 -76.26 -54.67 6.45 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.856 -170.853 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.973 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 0.6 OUTLIER -61.71 -42.99 99.69 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 118.782 -0.628 . . . . 0.0 110.953 -173.307 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.656 HD22 HG23 ' A' ' 925' ' ' VAL . 4.6 pp -70.04 -39.87 75.46 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 116.472 -2.091 . . . . 0.0 109.628 -178.67 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.51 ' N ' HD12 ' A' 1036 ' ' LEU . 38.2 t70 -53.23 -43.33 67.21 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 122.098 0.951 . . . . 0.0 110.83 173.249 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.559 ' HB ' ' O ' ' A' 1035 ' ' LEU . 9.7 t -50.83 -48.82 27.99 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.585 0 CA-C-N 114.061 -1.427 . . . . 0.0 111.299 172.29 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.847 HG12 HG12 ' A' ' 984' ' ' ILE . 2.7 mp -74.95 -34.05 31.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 118.45 0.568 . . . . 0.0 110.912 178.36 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.984 ' HB3' ' HA ' ' A' ' 919' ' ' ILE . 83.5 m-20 -51.39 -53.9 31.94 Favored 'General case' 0 C--O 1.246 0.88 0 CA-C-O 122.403 1.097 . . . . 0.0 109.237 172.165 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.605 ' HB3' ' CE1' ' A' 1053 ' ' HIS . 50.0 mt-30 -76.78 -32.14 57.48 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 115.122 -0.945 . . . . 0.0 110.9 -179.723 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.661 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -54.82 -50.84 67.6 Favored 'General case' 0 CA--C 1.501 -0.922 0 C-N-CA 123.389 0.676 . . . . 0.0 111.62 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.67 ' O ' HG12 ' A' 1047 ' ' ILE . 0.0 OUTLIER -61.94 -37.66 85.54 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.723 -176.622 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.663 ' N ' ' HD3' ' A' 1043 ' ' ARG . 15.4 mt -76.02 -41.95 49.4 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.967 178.316 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1045 ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -55.53 -49.61 72.18 Favored 'General case' 0 C--O 1.215 -0.743 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.091 179.226 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.724 ' HB3' ' O ' ' A' ' 978' ' ' ALA . 18.0 mmt -64.85 -37.02 86.24 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.841 -0.618 . . . . 0.0 112.105 -176.87 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.67 HG12 ' O ' ' A' 1043 ' ' ARG . 24.8 mm -48.34 -44.32 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.727 172.32 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 48.8 m -148.71 63.28 1.07 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.053 -176.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -64.35 -15.71 60.89 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -174.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 20.3 p -77.41 1.84 17.83 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 120.657 0.265 . . . . 0.0 111.38 177.077 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 -152.06 138.21 11.65 Favored Pre-proline 0 C--N 1.331 -0.197 0 CA-C-O 120.829 0.347 . . . . 0.0 110.51 174.304 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -64.25 117.63 4.65 Favored 'Trans proline' 0 CA--C 1.528 0.193 0 C-N-CA 122.517 2.145 . . . . 0.0 112.434 -178.403 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 1053 ' ' HIS . . . . . 0.605 ' CE1' ' HB3' ' A' 1041 ' ' GLN . 0.9 OUTLIER . . . . . 0 N--CA 1.466 0.359 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.578 178.393 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.681 0 N-CA-C 111.951 -0.459 . . . . 0.0 111.951 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 20.4 m -77.94 121.13 83.65 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-O 120.543 0.211 . . . . 0.0 110.728 179.145 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_exo -67.84 105.36 1.12 Allowed 'Trans proline' 0 N--CA 1.46 -0.441 0 C-N-CA 122.738 2.292 . . . . 0.0 111.34 175.59 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -83.15 160.44 38.48 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.637 -178.586 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 2.7 pp -121.37 156.84 25.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.262 0.077 . . . . 0.0 110.992 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 10.0 t 56.64 80.62 0.15 Allowed 'General case' 0 C--O 1.233 0.217 0 O-C-N 123.923 0.764 . . . . 0.0 110.893 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 78.69 11.86 84.82 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.511 -176.323 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . -89.79 134.72 12.53 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.033 -178.11 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . 81.69 9.92 84.95 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.633 177.504 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . 134.16 -109.7 0.81 Allowed Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.246 179.577 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 918' ' ' GLY . . . . . 0.714 ' H ' HD22 ' A' 1044 ' ' LEU . . . 64.61 -124.5 29.27 Favored Glycine 0 CA--C 1.521 0.413 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.849 -177.223 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 919' ' ' ILE . . . . . 0.539 ' HA ' ' HB3' ' A' 1040 ' ' ASP . 0.1 OUTLIER -75.16 122.97 29.94 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.49 0 C-N-CA 124.035 0.934 . . . . 0.0 111.058 -176.165 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 920' ' ' ARG . . . . . . . . . . . . . 36.1 ttp180 -173.13 -28.28 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 15.1 t -139.06 78.1 1.65 Allowed 'General case' 0 C--O 1.237 0.407 0 N-CA-C 113.588 0.959 . . . . 0.0 113.588 -167.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 0.528 ' O ' HG22 ' A' ' 925' ' ' VAL . 41.1 t-20 -179.48 56.55 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 168.816 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.649 ' HB2' ' CE1' ' A' ' 926' ' ' TYR . 2.0 p30 -72.37 14.77 0.21 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 114.217 1.192 . . . . 0.0 114.217 -174.716 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.573 ' HB3' HG21 ' A' ' 968' ' ' THR . 51.2 mmtt -76.74 -42.49 40.92 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 120.556 -1.34 . . . . 0.0 111.249 172.393 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.67 ' CG2' ' HB2' ' A' 1036 ' ' LEU . 17.0 m -62.04 -35.06 66.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.365 0.602 . . . . 0.0 110.8 -178.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.649 ' CE1' ' HB2' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -77.5 -27.16 51.78 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 118.598 -0.715 . . . . 0.0 111.863 177.383 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 927' ' ' GLU . . . . . 0.484 ' O ' HG22 ' A' ' 930' ' ' THR . 6.6 pt-20 -75.75 -23.81 56.03 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 120.482 1.492 . . . . 0.0 109.784 178.774 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -76.36 -29.14 57.07 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 121.347 0.594 . . . . 0.0 110.19 172.324 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.636 HG21 HD23 ' A' 1036 ' ' LEU . 82.0 t -82.15 -31.99 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.729 175.678 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.484 HG22 ' O ' ' A' ' 927' ' ' GLU . 5.8 t -62.47 -29.34 70.46 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 120.349 1.432 . . . . 0.0 107.873 171.714 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -70.32 -52.22 18.41 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-N 114.452 -1.249 . . . . 0.0 113.17 171.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.461 HD21 HG22 ' A' ' 929' ' ' VAL . 2.0 pp -62.16 -48.31 80.66 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 117.648 0.724 . . . . 0.0 112.792 -178.03 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.701 ' O ' HG22 ' A' ' 936' ' ' VAL . 56.7 t -60.81 -41.83 90.06 Favored 'Isoleucine or valine' 0 C--O 1.239 0.535 0 CA-C-O 121.777 0.799 . . . . 0.0 109.703 -177.813 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 934' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -53.72 -43.3 68.92 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.7 -1.136 . . . . 0.0 110.322 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -67.89 -31.64 71.57 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -176.559 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.701 HG22 ' O ' ' A' ' 933' ' ' VAL . 2.9 m -61.59 -56.95 14.45 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.271 0 C-N-CA 121.004 -0.278 . . . . 0.0 111.048 -174.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.431 ' N ' HG23 ' A' ' 936' ' ' VAL . 7.1 pt -78.52 -40.32 24.3 Favored 'Isoleucine or valine' 0 C--O 1.25 1.118 0 CA-C-O 121.12 0.486 . . . . 0.0 111.257 -178.478 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -65.55 -49.21 69.75 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.696 -171.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.704 ' O ' HG22 ' A' ' 943' ' ' ILE . 26.2 mmt -71.92 -26.18 62.2 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.6 -179.074 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 940' ' ' SER . . . . . . . . . . . . . 5.2 m -50.86 -43.13 59.33 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-O 121.218 0.533 . . . . 0.0 111.421 -176.121 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 941' ' ' SER . . . . . 0.602 ' HA ' ' HG3' ' A' ' 945' ' ' PRO . 42.6 m -105.59 -15.11 15.07 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 178.73 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 942' ' ' LYS . . . . . . . . . . . . . 6.6 tmtm? -85.18 -53.61 5.14 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 120.161 -0.616 . . . . 0.0 111.696 -172.607 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.704 HG22 ' O ' ' A' ' 939' ' ' MET . 10.8 tp -62.71 -0.14 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.924 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 178.541 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.72 ' HB3' ' HD2' ' A' ' 947' ' ' PRO . 47.4 mt-30 99.49 100.28 0.01 OUTLIER Pre-proline 0 N--CA 1.477 0.915 0 C-N-CA 124.927 1.291 . . . . 0.0 112.559 166.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.602 ' HG3' ' HA ' ' A' ' 941' ' ' SER . 80.8 Cg_endo -91.09 40.26 0.35 Allowed 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 123.784 2.989 . . . . 0.0 111.942 178.488 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.842 ' HB3' ' HD3' ' A' ' 947' ' ' PRO . . . -136.24 -51.83 0.02 OUTLIER Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.519 177.625 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.842 ' HD3' ' HB3' ' A' ' 946' ' ' ALA . 1.0 OUTLIER -85.95 171.39 8.1 Favored 'Trans proline' 0 N--CA 1.454 -0.811 0 C-N-CA 122.262 1.974 . . . . 0.0 108.62 160.87 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.804 ' HA ' HG21 ' A' 1009 ' ' VAL . 13.9 Cg_endo -64.21 116.21 3.6 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 120.91 1.074 . . . . 0.0 112.755 177.634 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.522 ' HG2' HG23 ' A' ' 943' ' ' ILE . 50.7 mt-10 -57.75 -19.61 28.95 Favored 'General case' 0 C--N 1.333 -0.127 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 165.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.69 ' HB3' ' HG2' ' A' ' 953' ' ' PRO . 21.2 tp10 73.12 -10.86 0.95 Allowed 'General case' 0 C--N 1.345 0.401 0 CA-C-N 114.302 -1.317 . . . . 0.0 108.85 -170.478 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.794 ' CE1' ' HD3' ' A' 1018 ' ' LYS . 39.0 m-85 53.01 -54.11 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 125.632 1.573 . . . . 0.0 114.397 -178.223 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 0.628 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 22.3 t -43.66 -48.45 19.72 Favored Pre-proline 0 C--N 1.322 -0.606 0 C-N-CA 122.793 0.437 . . . . 0.0 111.98 174.291 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 0.69 ' HG2' ' HB3' ' A' ' 950' ' ' GLU . 13.8 Cg_exo -47.6 -49.26 13.71 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 122.861 2.374 . . . . 0.0 113.995 178.303 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.621 ' HG3' ' O ' ' A' ' 951' ' ' TYR . 4.5 ppp? -76.43 -32.26 58.35 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.212 0.529 . . . . 0.0 110.54 179.297 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.51 ' HA ' HG12 ' A' ' 958' ' ' VAL . 78.5 t -57.42 -35.3 49.0 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.374 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.327 168.156 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.493 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 9.9 tmtt? -65.71 -32.25 73.7 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.626 0.25 . . . . 0.0 111.122 173.489 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -77.99 -45.45 23.74 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.831 0.348 . . . . 0.0 110.993 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.51 HG12 ' HA ' ' A' ' 955' ' ' VAL . 13.3 p -76.4 -31.95 21.21 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.19 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.069 178.386 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 959' ' ' GLY . . . . . 0.469 ' O ' ' HG2' ' A' ' 963' ' ' ARG . . . -61.21 -38.39 95.57 Favored Glycine 0 N--CA 1.446 -0.685 0 N-CA-C 110.867 -0.893 . . . . 0.0 110.867 173.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 960' ' ' LEU . . . . . 0.492 HD12 HH11 ' A' ' 963' ' ' ARG . 15.5 tp -64.26 -42.79 96.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.929 0.395 . . . . 0.0 110.506 175.285 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -73.28 -34.61 65.87 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.087 0.47 . . . . 0.0 111.936 -176.644 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.863 HD11 HD22 ' A' ' 995' ' ' LEU . 3.6 pp -80.83 -30.34 35.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.83 -179.092 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.492 HH11 HD12 ' A' ' 960' ' ' LEU . 9.8 ptp85 -72.71 -33.8 66.68 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 119.629 -0.828 . . . . 0.0 110.943 170.538 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 964' ' ' THR . . . . . 0.455 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 17.6 m -66.57 -33.52 75.85 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 119.603 -0.839 . . . . 0.0 108.974 176.845 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.487 ' O ' HG23 ' A' ' 969' ' ' VAL . 17.2 tp -60.84 -49.45 77.44 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.558 0.694 . . . . 0.0 109.612 170.306 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 0.573 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.4 tt -55.26 -45.34 76.1 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 114.459 -1.246 . . . . 0.0 109.735 -178.913 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -66.42 -42.01 88.39 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.007 -0.997 . . . . 0.0 112.131 178.896 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.573 HG21 ' HB3' ' A' ' 924' ' ' LYS . 0.8 OUTLIER -61.85 -34.91 76.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 119.193 0.906 . . . . 0.0 110.817 175.838 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.976 HG12 HG23 ' A' ' 984' ' ' ILE . 52.7 t -73.38 -42.03 57.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.916 175.54 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.471 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 31.4 t70 -69.9 -40.02 75.86 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 122.111 0.957 . . . . 0.0 109.228 -175.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.608 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 9.1 tp10 -66.69 -31.89 72.84 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.63 -1.168 . . . . 0.0 109.483 177.036 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.65 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 27.3 m -68.76 -17.35 64.02 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.256 174.681 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.753 ' HB2' HG21 ' A' ' 984' ' ' ILE . 9.0 tt -64.39 -51.94 57.07 Favored Pre-proline 0 C--O 1.226 -0.134 0 C-N-CA 120.451 -0.499 . . . . 0.0 109.969 -178.876 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.741 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 6.3 Cg_exo -80.99 -4.0 12.5 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 121.515 1.477 . . . . 0.0 113.262 171.571 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.65 ' HB ' ' HA ' ' A' ' 972' ' ' SER . 24.6 t -73.07 -49.76 36.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.204 172.206 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.523 ' HA ' ' HD3' ' A' ' 977' ' ' PRO . 3.9 mm? -80.81 125.51 80.04 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.254 -178.804 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 0.523 ' HD3' ' HA ' ' A' ' 976' ' ' LEU . 2.2 Cg_endo -83.38 0.31 9.54 Favored 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 123.452 2.768 . . . . 0.0 112.164 179.02 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -99.13 -174.92 2.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.431 179.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.613 ' HB2' ' SD ' ' A' 1046 ' ' MET . 27.4 m -77.5 20.95 0.29 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.895 0.332 . . . . 0.0 111.895 -178.276 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.512 HG23 ' CB ' ' A' 1042 ' ' ALA . 20.6 m -64.08 -14.2 52.88 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 121.382 0.611 . . . . 0.0 110.308 177.454 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.623 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 11.6 m170 -50.88 -39.71 54.63 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 115.061 -0.972 . . . . 0.0 111.722 177.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 982' ' ' ARG . . . . . 0.428 ' HE ' ' HB3' ' A' ' 982' ' ' ARG . 5.6 ptp180 -83.41 -20.71 33.67 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.629 -0.428 . . . . 0.0 112.116 -173.03 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.708 ' CG ' ' HB2' ' A' 1053 ' ' HIS . 1.3 mp0 -71.44 -34.7 70.51 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-O 121.614 0.721 . . . . 0.0 109.275 167.58 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.976 HG23 HG12 ' A' ' 969' ' ' VAL . 58.1 mt -72.24 -30.52 35.84 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-N 114.662 -1.154 . . . . 0.0 108.895 179.282 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 985' ' ' GLU . . . . . 0.623 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 35.5 mt-10 -65.41 -52.46 53.22 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.569 174.199 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 51.9 tpp -70.83 -42.52 70.09 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.913 -171.632 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.65 ' HB1' ' HB3' ' A' 1035 ' ' LEU . . . -74.21 -50.69 18.09 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.45 -172.263 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.631 ' O ' ' HB2' ' A' ' 992' ' ' ASN . 22.3 pt20 -65.48 -22.2 66.71 Favored 'General case' 0 C--O 1.226 -0.151 0 CA-C-O 121.617 0.723 . . . . 0.0 109.204 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 989' ' ' LYS . . . . . 0.723 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 9.0 ttmm -73.47 -44.42 58.01 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 114.786 -1.097 . . . . 0.0 112.018 171.214 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.67 ' HB3' HD21 ' A' 1035 ' ' LEU . 15.6 tp -57.39 -58.36 8.62 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 119.569 -0.852 . . . . 0.0 111.705 -179.173 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.525 ' HB3' HD23 ' A' 1035 ' ' LEU . 3.2 pp -57.86 -29.62 65.15 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.38 0.609 . . . . 0.0 110.358 177.82 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 992' ' ' ASN . . . . . 0.723 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 44.9 t-20 -55.55 -55.91 26.41 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.637 -1.165 . . . . 0.0 110.986 175.903 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 46.2 m -73.01 -32.98 65.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.997 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 994' ' ' ASP . . . . . 0.718 ' C ' HD22 ' A' ' 998' ' ' LEU . 2.6 m-20 -55.08 -62.5 1.62 Allowed 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.903 174.412 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 0.863 HD22 HD11 ' A' ' 962' ' ' LEU . 18.0 tp -48.2 -30.06 4.32 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 123.291 0.37 . . . . 0.0 111.165 175.894 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -69.74 -37.87 76.63 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 119.556 -0.858 . . . . 0.0 111.764 178.433 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -78.26 -39.55 39.81 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.523 0.677 . . . . 0.0 109.937 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 1.041 HD23 ' HG ' ' A' 1028 ' ' LEU . 0.0 OUTLIER -58.18 -34.18 70.05 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.086 179.746 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.693 ' O ' ' HG3' ' A' 1002 ' ' MET . 44.1 mt -67.1 -37.74 79.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 CA-C-N 115.11 -0.95 . . . . 0.0 111.78 172.881 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -60.56 -34.77 74.64 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.365 0.602 . . . . 0.0 111.668 179.159 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.723 ' HD2' ' OE1' ' A' 1020 ' ' GLN . 42.8 mmtm -82.61 -41.34 19.63 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.418 0.628 . . . . 0.0 110.904 -175.569 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.693 ' HG3' ' O ' ' A' ' 999' ' ' ILE . 0.0 OUTLIER -61.25 -25.95 67.43 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 122.248 1.023 . . . . 0.0 108.642 175.326 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.603 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 26.8 tptt -71.83 -54.07 11.29 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 113.913 -1.494 . . . . 0.0 110.458 -167.338 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.806 ' HB3' HD23 ' A' 1013 ' ' LEU . 8.7 mp -73.65 -13.48 61.0 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.671 -179.424 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.772 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -68.97 -44.98 71.82 Favored 'General case' 0 C--N 1.319 -0.747 0 C-N-CA 119.533 -0.867 . . . . 0.0 109.983 178.087 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.82 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 1.0 OUTLIER -74.44 -28.57 61.11 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 121.891 -0.506 . . . . 0.0 111.265 173.406 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.492 ' CG ' ' HA ' ' A' 1004 ' ' LEU . 15.3 mm-40 -50.16 -57.54 7.51 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.277 0.56 . . . . 0.0 110.25 173.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1008 ' ' TYR . . . . . 1.073 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 24.2 m-85 -107.16 35.06 3.17 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.984 175.355 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1009 ' ' VAL . . . . . 1.047 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 11.2 p -45.39 -29.11 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.494 0 O-C-N 123.536 0.522 . . . . 0.0 110.954 174.8 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 25.8 ttp -40.47 -45.78 2.31 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.52 -1.218 . . . . 0.0 111.599 178.745 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 28.1 m -161.53 -82.37 0.04 OUTLIER 'General case' 0 C--O 1.245 0.853 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 176.367 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 11.2 p -55.75 -71.64 0.08 Allowed 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.067 -0.97 . . . . 0.0 113.115 -164.328 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1013 ' ' LEU . . . . . 1.073 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 6.5 mp -51.84 -38.0 54.18 Favored 'General case' 0 CA--C 1.506 -0.736 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -178.207 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1014 ' ' GLN . . . . . 1.047 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.2 OUTLIER -55.19 -53.54 54.76 Favored 'General case' 0 N--CA 1.442 -0.837 0 O-C-N 123.423 0.452 . . . . 0.0 111.599 -168.264 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -73.45 -36.55 65.91 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.569 -175.677 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1016 ' ' GLU . . . . . 0.466 ' HG2' ' NE2' ' A' 1020 ' ' GLN . 36.5 tt0 -68.27 -57.63 5.67 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.566 178.775 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.772 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 7.3 m-85 -62.03 -33.15 73.82 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 113.696 0.999 . . . . 0.0 113.696 -176.324 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.794 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 35.0 tptt -80.24 -32.12 38.43 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.582 -176.545 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1019 ' ' LYS . . . . . 0.445 ' HA ' ' HD2' ' A' 1019 ' ' LYS . 0.2 OUTLIER -74.59 -35.37 63.0 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 176.347 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A 1020 ' ' GLN . . . . . 0.723 ' OE1' ' HD2' ' A' 1001 ' ' LYS . 77.5 mt-30 -56.59 -41.16 76.52 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.718 158.679 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.567 ' HG3' ' HB3' ' A' 1002 ' ' MET . 1.5 tmt? -65.99 -51.8 55.12 Favored 'General case' 0 C--O 1.219 -0.544 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -172.468 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.84 -18.5 53.91 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 119.676 -0.81 . . . . 0.0 110.394 -172.454 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 34.6 m -84.17 -27.02 28.36 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 175.209 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.754 ' HB1' ' CD1' ' A' ' 998' ' ' LEU . . . -81.36 -28.14 34.59 Favored 'General case' 0 C--O 1.212 -0.904 0 CA-C-N 115.454 -0.793 . . . . 0.0 109.596 172.542 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.484 ' HA ' ' HB2' ' A' 1028 ' ' LEU . . . -83.38 -19.6 35.76 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 169.399 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.522 ' O ' HG23 ' A' 1030 ' ' VAL . 32.7 t-80 -75.12 -21.75 58.65 Favored 'General case' 0 C--O 1.213 -0.863 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 161.522 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1027 ' ' ALA . . . . . 0.681 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -74.32 -39.46 62.84 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.33 0.652 . . . . 0.0 110.098 166.464 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1028 ' ' LEU . . . . . 1.041 ' HG ' HD23 ' A' ' 998' ' ' LEU . 23.0 mt -55.92 -49.59 73.03 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 164.037 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1029 ' ' ALA . . . . . 0.514 ' CB ' HG22 ' A' ' 933' ' ' VAL . . . -60.21 -38.79 84.4 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 112.64 0.607 . . . . 0.0 112.64 177.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.522 HG23 ' O ' ' A' 1026 ' ' HIS . 11.3 t -75.89 -51.46 20.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.358 0.599 . . . . 0.0 110.995 -175.763 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.591 ' O ' HD22 ' A' 1035 ' ' LEU . 6.6 m-20 -75.39 -33.59 61.02 Favored 'General case' 0 C--O 1.212 -0.907 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.149 -176.384 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.432 ' HB1' HD22 ' A' ' 965' ' ' LEU . . . -70.88 -24.99 62.6 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.559 -0.456 . . . . 0.0 109.938 174.333 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.501 ' HB3' ' O ' ' A' 1030 ' ' VAL . 50.6 tttm -63.38 -52.2 62.64 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 167.4 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.48 ' O ' HG23 ' A' 1038 ' ' VAL . 52.5 t30 -63.51 -50.12 70.84 Favored 'General case' 0 C--O 1.209 -1.038 0 CA-C-N 114.599 -1.182 . . . . 0.0 111.48 -177.834 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.67 HD21 ' HB3' ' A' ' 990' ' ' LEU . 0.0 OUTLIER -59.29 -42.07 90.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 119.395 -0.336 . . . . 0.0 110.498 -178.067 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.67 ' HB2' ' CG2' ' A' ' 925' ' ' VAL . 3.2 pp -69.69 -41.26 75.66 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 117.549 -1.66 . . . . 0.0 109.295 179.712 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 14.1 t70 -56.3 -40.0 73.64 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 114.37 -1.287 . . . . 0.0 109.786 175.246 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.542 ' HB ' ' O ' ' A' 1035 ' ' LEU . 6.6 t -53.47 -48.34 58.0 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.091 0 CA-C-N 113.822 -1.536 . . . . 0.0 111.053 174.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.601 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 2.0 mp -74.27 -33.96 35.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 118.792 0.723 . . . . 0.0 111.044 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.539 ' HB3' ' HA ' ' A' ' 919' ' ' ILE . 0.5 OUTLIER -62.06 -49.87 74.23 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.21 0.529 . . . . 0.0 110.084 174.353 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.467 ' HB2' ' NE2' ' A' 1053 ' ' HIS . 36.7 mt-30 -63.7 -40.71 97.47 Favored 'General case' 0 C--O 1.213 -0.862 0 C-N-CA 120.334 -0.546 . . . . 0.0 109.612 172.488 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.601 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -53.3 -52.83 57.85 Favored 'General case' 0 CA--C 1.494 -1.205 0 C-N-CA 123.619 0.768 . . . . 0.0 112.115 -175.79 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.689 ' O ' HG12 ' A' 1047 ' ' ILE . 0.1 OUTLIER -61.93 -44.12 97.42 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.034 -174.83 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.714 HD22 ' H ' ' A' ' 918' ' ' GLY . 3.7 tt -80.07 -27.78 39.27 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 121.484 0.659 . . . . 0.0 110.291 -175.387 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.629 ' HG2' ' HG3' ' A' 1049 ' ' GLN . 0.3 OUTLIER -77.39 -41.24 40.84 Favored 'General case' 0 C--O 1.215 -0.73 0 N-CA-C 108.598 -0.889 . . . . 0.0 108.598 -179.964 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.613 ' SD ' ' HB2' ' A' ' 979' ' ' SER . 7.1 mmt -65.07 -31.52 72.77 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.207 175.125 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.689 HG12 ' O ' ' A' 1043 ' ' ARG . 19.0 mm -52.94 -50.7 42.8 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.935 168.745 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 34.5 t -132.45 64.51 1.6 Allowed 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 119.851 -0.74 . . . . 0.0 112.18 -177.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1049 ' ' GLN . . . . . 0.629 ' HG3' ' HG2' ' A' 1045 ' ' LYS . 10.9 mm100 -149.34 -170.63 3.68 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 114.819 -1.082 . . . . 0.0 109.47 167.833 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 8.2 t -144.58 25.0 1.52 Allowed 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 171.289 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 77.7 mtp180 -140.79 147.21 47.51 Favored Pre-proline 0 N--CA 1.453 -0.285 0 CA-C-N 114.747 -1.115 . . . . 0.0 109.618 -177.755 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 1052 ' ' PRO . . . . . 0.418 ' HA ' ' HZ3' ' A' 1045 ' ' LYS . 57.7 Cg_endo -73.52 168.28 25.15 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 122.047 1.831 . . . . 0.0 111.224 173.128 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 1053 ' ' HIS . . . . . 0.708 ' HB2' ' CG ' ' A' ' 983' ' ' GLU . 3.2 t-80 . . . . . 0 C--N 1.324 -0.527 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.043 -167.561 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.748 0 N-CA-C 111.944 -0.463 . . . . 0.0 111.944 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 909' ' ' SER . . . . . 0.644 ' O ' ' HB2' ' A' ' 913' ' ' SER . 16.2 m -109.75 136.51 20.33 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 -178.33 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -48.43 -45.09 27.96 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 123.839 3.026 . . . . 0.0 113.058 -176.093 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -62.25 115.54 8.13 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.722 -0.752 . . . . 0.0 111.733 175.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 912' ' ' ILE . . . . . 0.451 HG22 ' O ' ' A' ' 912' ' ' ILE . 20.2 mt 67.86 25.98 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-O 121.695 0.759 . . . . 0.0 110.586 -178.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 913' ' ' SER . . . . . 0.644 ' HB2' ' O ' ' A' ' 909' ' ' SER . 27.1 t -81.8 -23.45 36.54 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.261 0.553 . . . . 0.0 110.515 176.524 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 162.65 84.43 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.978 -0.63 . . . . 0.0 111.534 -178.598 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . -76.24 115.78 4.55 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.563 -0.827 . . . . 0.0 111.53 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . -79.04 59.8 4.25 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 121.022 -0.609 . . . . 0.0 111.79 -179.631 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . 92.04 -165.79 29.44 Favored Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 121.186 -0.531 . . . . 0.0 112.057 -178.158 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -94.76 -70.48 1.09 Allowed Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.539 -0.838 . . . . 0.0 111.945 178.326 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 919' ' ' ILE . . . . . 0.688 HG22 HD12 ' A' 1044 ' ' LEU . 0.1 OUTLIER -65.8 151.5 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.996 0 C-N-CA 123.51 0.724 . . . . 0.0 111.584 178.838 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.587 ' H ' ' CG ' ' A' 1040 ' ' ASP . 22.2 ptt180 45.3 71.5 0.27 Allowed 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 126.237 1.815 . . . . 0.0 112.328 -167.424 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 15.9 t -136.52 3.14 2.76 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.417 -1.265 . . . . 0.0 109.289 173.313 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -142.31 61.99 1.43 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.349 -177.761 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.695 ' O ' ' HD2' ' A' ' 926' ' ' TYR . 4.3 m-20 -70.65 -2.06 13.21 Favored 'General case' 0 C--O 1.217 -0.655 0 N-CA-C 113.702 1.001 . . . . 0.0 113.702 -169.093 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 924' ' ' LYS . . . . . . . . . . . . . 2.0 tppp? -57.68 -33.75 68.67 Favored 'General case' 0 C--N 1.316 -0.855 0 O-C-N 121.19 -0.944 . . . . 0.0 111.38 -175.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.726 HG21 HD23 ' A' 1036 ' ' LEU . 26.9 m -64.15 -29.34 47.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.316 0.579 . . . . 0.0 111.092 176.043 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.695 ' HD2' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -70.51 -32.93 70.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.441 -178.628 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 927' ' ' GLU . . . . . 0.691 ' HA ' ' HB ' ' A' ' 930' ' ' THR . 10.8 pt-20 -76.91 -24.22 52.47 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 118.951 -1.1 . . . . 0.0 111.004 176.059 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -69.14 -31.08 69.5 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 172.316 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.587 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 43.7 t -80.45 -30.76 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.516 173.174 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.691 ' HB ' ' HA ' ' A' ' 927' ' ' GLU . 6.2 m -56.09 -43.32 77.94 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 166.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -69.54 -52.9 18.91 Favored Glycine 0 CA--C 1.531 1.074 0 CA-C-N 114.744 -1.116 . . . . 0.0 113.941 175.518 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.587 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.9 pp -65.78 -45.88 80.83 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 117.508 0.654 . . . . 0.0 112.763 -174.893 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 56.0 t -66.05 -36.43 77.45 Favored 'Isoleucine or valine' 0 C--O 1.239 0.509 0 CA-C-O 121.21 0.529 . . . . 0.0 110.636 -177.159 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.519 ' O ' ' HB3' ' A' ' 938' ' ' GLU . 60.9 tttt -63.79 -31.88 73.2 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.574 179.15 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 0.608 ' O ' ' HB2' ' A' ' 939' ' ' MET . . . -66.27 -40.88 90.43 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 121.946 -0.472 . . . . 0.0 110.724 175.124 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.847 HG22 ' HB1' ' A' 1025 ' ' ALA . 54.1 t -50.38 -76.73 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.342 -177.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.442 HG13 ' N ' ' A' ' 938' ' ' GLU . 25.0 pt -80.35 -45.29 22.15 Favored 'Isoleucine or valine' 0 C--O 1.244 0.776 0 CA-C-O 121.191 0.52 . . . . 0.0 112.188 -173.539 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.519 ' HB3' ' O ' ' A' ' 934' ' ' LYS . 31.7 tt0 -67.92 -47.36 68.97 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-O 121.267 0.556 . . . . 0.0 109.665 -169.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.608 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 63.6 mtt -74.46 -23.94 58.97 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.814 178.896 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.659 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 29.1 p -50.61 -40.85 53.87 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.578 0.704 . . . . 0.0 110.512 -176.632 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 8.8 m -104.67 -21.27 13.42 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.641 -179.324 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.469 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 45.6 tttp -83.85 -48.3 10.19 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -167.787 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.58 HG12 ' O ' ' A' ' 939' ' ' MET . 24.9 pt -73.77 1.5 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 N-CA-C 113.774 1.028 . . . . 0.0 113.774 178.347 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.443 ' N ' ' CD ' ' A' ' 945' ' ' PRO . 23.1 tp60 -83.19 -1.16 0.05 OUTLIER Pre-proline 0 CA--C 1.576 1.944 0 N-CA-C 116.276 1.954 . . . . 0.0 116.276 -174.153 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.469 ' HD3' ' O ' ' A' ' 942' ' ' LYS . 39.9 Cg_exo -60.75 -25.21 80.63 Favored 'Trans proline' 0 C--N 1.369 1.63 0 CA-C-N 123.131 2.154 . . . . 0.0 112.561 174.562 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 946' ' ' ALA . . . . . . . . . . . . . . . -73.96 165.66 51.28 Favored Pre-proline 0 C--N 1.326 -0.419 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 173.642 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.974 ' HB2' ' HD3' ' A' ' 948' ' ' PRO . 52.6 Cg_exo -49.87 -57.77 2.12 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 121.418 1.412 . . . . 0.0 111.446 177.178 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.974 ' HD3' ' HB2' ' A' ' 947' ' ' PRO . 90.9 Cg_endo -106.36 166.1 0.13 Allowed 'Trans proline' 0 N--CA 1.443 -1.458 0 C-N-CA 122.32 2.013 . . . . 0.0 112.038 165.84 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.525 ' HB2' ' CE1' ' A' ' 951' ' ' TYR . 55.3 mt-10 -72.92 -5.21 36.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.605 0.717 . . . . 0.0 109.695 169.761 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.851 ' HB3' ' HG2' ' A' ' 953' ' ' PRO . 32.2 mt-10 62.88 58.87 1.45 Allowed 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 114.179 -1.373 . . . . 0.0 108.388 -172.747 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.996 ' HB3' ' HG2' ' A' 1002 ' ' MET . 24.9 m-85 -52.75 -43.3 65.66 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 113.336 -1.756 . . . . 0.0 113.424 -178.708 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 0.716 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 64.4 t -60.54 -53.14 67.46 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 110.466 -0.198 . . . . 0.0 110.466 175.398 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 0.851 ' HG2' ' HB3' ' A' ' 950' ' ' GLU . 17.3 Cg_exo -48.55 -34.5 26.61 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 122.315 2.01 . . . . 0.0 113.03 167.169 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.49 ' O ' HG12 ' A' ' 958' ' ' VAL . 34.3 tpp -73.26 -31.99 64.42 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.145 177.049 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.549 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 89.0 t -52.33 -39.53 28.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 169.62 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.513 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 8.0 tttt -67.31 -37.36 83.21 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.692 174.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -78.68 -46.82 18.24 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.992 0.368 . . . . 0.0 111.992 -173.223 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.535 HG11 HD21 ' A' ' 998' ' ' LEU . 12.5 p -86.63 -24.87 6.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 -178.206 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -65.25 -27.13 72.05 Favored Glycine 0 N--CA 1.445 -0.754 0 N-CA-C 110.24 -1.144 . . . . 0.0 110.24 171.492 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 960' ' ' LEU . . . . . 0.571 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 10.3 tt -76.92 -35.14 57.54 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.253 -0.473 . . . . 0.0 109.957 175.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.417 ' HB1' ' HB3' ' A' ' 932' ' ' LEU . . . -71.17 -42.09 69.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.306 -175.749 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.855 HD13 HD22 ' A' ' 991' ' ' LEU . 0.5 OUTLIER -67.41 -42.83 82.62 Favored 'General case' 0 C--O 1.217 -0.628 0 CA-C-O 118.853 -0.594 . . . . 0.0 111.056 170.757 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.571 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 29.2 ptt180 -64.87 -31.55 72.84 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 119.912 1.233 . . . . 0.0 110.381 -179.067 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 34.2 m -68.79 -33.99 74.79 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.497 HD21 HD21 ' A' 1035 ' ' LEU . 22.0 tp -70.92 -36.27 72.6 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.581 -1.19 . . . . 0.0 109.556 176.027 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 0.6 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.5 tt -71.77 -39.5 69.92 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 114.828 -1.078 . . . . 0.0 108.399 -175.312 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -74.05 -28.05 61.22 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 114.986 -1.006 . . . . 0.0 112.155 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.51 ' OG1' HG12 ' A' ' 925' ' ' VAL . 5.2 p -74.46 -41.05 61.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 118.475 0.579 . . . . 0.0 110.164 175.324 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.898 HG12 HG23 ' A' ' 984' ' ' ILE . 60.8 t -68.73 -36.48 74.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.564 172.251 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.458 ' O ' ' HB3' ' A' ' 973' ' ' LEU . 24.1 t70 -70.87 -37.37 73.07 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.626 0.727 . . . . 0.0 109.175 179.652 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.615 ' O ' HG23 ' A' ' 975' ' ' VAL . 14.0 tp10 -65.88 -32.85 74.6 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.418 176.434 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.401 ' HA ' ' CG2' ' A' ' 975' ' ' VAL . 69.8 m -69.04 -17.59 63.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.055 175.406 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.724 ' HB2' HG21 ' A' ' 984' ' ' ILE . 9.2 tt -67.68 -51.42 30.79 Favored Pre-proline 0 CA--C 1.538 0.505 0 CA-C-O 119.543 -0.265 . . . . 0.0 110.43 -178.184 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.469 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 90.2 Cg_endo -82.9 2.07 8.72 Favored 'Trans proline' 0 C--N 1.356 0.932 0 C-N-CA 121.359 1.373 . . . . 0.0 112.955 170.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.615 HG23 ' O ' ' A' ' 971' ' ' GLU . 26.0 t -67.9 -43.79 85.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 166.675 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 976' ' ' LEU . . . . . . . . . . . . . 36.5 tp -139.6 94.11 9.47 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.518 174.059 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -77.77 34.17 0.47 Allowed 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 123.367 2.711 . . . . 0.0 113.163 -173.2 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 978' ' ' ALA . . . . . 0.729 ' O ' ' HB3' ' A' ' 981' ' ' HIS . . . -104.73 -148.98 0.41 Allowed 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.269 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.754 ' HB2' ' SD ' ' A' 1046 ' ' MET . 53.7 m -74.23 3.96 6.43 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.415 ' HA ' ' HB1' ' A' 1042 ' ' ALA . 89.7 m -76.38 -29.42 57.12 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 167.373 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.729 ' HB3' ' O ' ' A' ' 978' ' ' ALA . 0.3 OUTLIER -58.12 -33.43 69.14 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 114.152 -1.386 . . . . 0.0 111.669 -179.861 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -84.25 -21.02 31.28 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 120.29 -0.564 . . . . 0.0 112.404 -176.168 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.516 ' HG3' HG13 ' A' 1038 ' ' VAL . 0.3 OUTLIER -73.14 -33.62 65.62 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 168.382 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.898 HG23 HG12 ' A' ' 969' ' ' VAL . 52.6 mt -68.66 -31.99 53.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.213 176.812 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 985' ' ' GLU . . . . . 0.568 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 46.2 mt-10 -62.69 -53.48 53.8 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.348 0.594 . . . . 0.0 109.751 175.687 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 89.8 mtp -69.84 -43.45 71.9 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.557 -171.688 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 1.065 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -67.78 -51.03 53.64 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.062 -0.972 . . . . 0.0 112.636 -171.842 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.6 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 25.3 pt20 -63.52 -28.39 69.92 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 119.815 -0.754 . . . . 0.0 111.232 -179.33 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 989' ' ' LYS . . . . . 0.721 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 90.9 mttt -70.04 -40.95 74.84 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.59 0.709 . . . . 0.0 111.492 172.46 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.62 HD23 ' HB3' ' A' 1035 ' ' LEU . 14.2 tp -49.6 -60.81 2.53 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 114.799 -1.092 . . . . 0.0 113.013 -176.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.855 HD22 HD13 ' A' ' 962' ' ' LEU . 5.1 tt -69.14 -27.45 65.57 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.239 0.542 . . . . 0.0 109.547 -179.53 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 992' ' ' ASN . . . . . 0.721 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 33.1 t-20 -51.08 -50.67 58.27 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.355 177.371 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 14.6 m -76.85 -33.32 57.9 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -65.31 -40.82 94.28 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 120.499 -0.481 . . . . 0.0 111.872 177.428 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 0.573 ' N ' HD21 ' A' 1028 ' ' LEU . 6.3 tt -71.28 -14.33 62.18 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 174.16 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -76.51 -26.27 55.09 Favored 'General case' 0 C--N 1.315 -0.893 0 C-N-CA 119.633 -0.827 . . . . 0.0 110.023 167.643 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.656 ' O ' ' HG2' ' A' 1001 ' ' LYS . 5.4 mm-40 -74.4 -43.75 54.98 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 173.223 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.678 HD13 ' HB2' ' A' 1025 ' ' ALA . 0.1 OUTLIER -55.08 -46.45 75.44 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.162 -0.926 . . . . 0.0 111.205 -178.657 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.495 ' O ' ' HB2' ' A' 1003 ' ' LYS . 95.1 mt -64.97 -42.66 95.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.666 -176.292 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -60.82 -41.62 96.08 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.174 0.511 . . . . 0.0 111.829 -178.386 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.871 ' HB3' ' HG3' ' A' 1020 ' ' GLN . 59.8 mmtt -73.86 -42.86 60.19 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 122.63 1.205 . . . . 0.0 108.457 -176.168 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.996 ' HG2' ' HB3' ' A' ' 951' ' ' TYR . 31.6 ttp -62.09 -28.57 69.71 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 113.101 -1.863 . . . . 0.0 109.307 179.499 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 8.7 tptm -69.43 -52.66 24.74 Favored 'General case' 0 N--CA 1.439 -0.999 0 CA-C-N 114.17 -1.377 . . . . 0.0 110.726 -169.172 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.613 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 93.1 mt -74.7 -13.24 60.59 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.443 -179.103 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.56 ' HB2' ' CB ' ' A' 1017 ' ' TYR . . . -66.72 -46.95 73.86 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 119.585 -0.846 . . . . 0.0 109.797 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.913 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 3.5 pp0? -70.61 -31.41 68.37 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 118.942 -0.551 . . . . 0.0 112.145 171.003 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.584 ' HG3' HD23 ' A' 1004 ' ' LEU . 12.7 mm100 -48.76 -51.1 30.83 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.149 0.499 . . . . 0.0 111.287 178.321 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.901 ' HB2' ' HG ' ' A' 1013 ' ' LEU . 89.2 m-85 -121.87 43.13 2.93 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 120.279 -0.569 . . . . 0.0 109.861 172.033 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.992 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 7.7 p -51.71 -19.9 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.515 -0.4 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.81 172.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 87.6 mmm -32.09 -53.61 0.29 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.055 -1.43 . . . . 0.0 111.065 170.727 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 23.9 m -161.66 -80.77 0.04 OUTLIER 'General case' 0 C--O 1.246 0.878 0 CA-C-O 121.188 0.518 . . . . 0.0 112.265 176.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 3.2 p -55.51 -65.45 0.59 Allowed 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.256 -0.883 . . . . 0.0 113.224 -167.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.901 ' HG ' ' HB2' ' A' 1008 ' ' TYR . 1.9 mm? -44.81 -45.38 10.06 Favored 'General case' 0 CA--C 1.508 -0.649 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 178.155 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1014 ' ' GLN . . . . . 0.992 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.6 OUTLIER -59.58 -48.13 82.87 Favored 'General case' 0 N--CA 1.442 -0.843 0 C-N-CA 119.985 -0.686 . . . . 0.0 110.941 -164.984 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -70.44 -40.42 73.77 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.639 -174.49 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -73.89 -41.04 62.72 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.286 0.565 . . . . 0.0 111.558 -177.783 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.746 ' CE1' HD13 ' A' 1013 ' ' LEU . 19.2 m-85 -81.1 -28.97 34.98 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 122.019 0.914 . . . . 0.0 112.442 -170.874 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.659 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 38.0 tptt -78.71 -28.4 45.08 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 113.933 -1.485 . . . . 0.0 110.29 178.775 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -71.86 -56.86 4.97 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.398 176.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1020 ' ' GLN . . . . . 0.871 ' HG3' ' HB3' ' A' 1001 ' ' LYS . 10.3 pt20 -53.69 -26.21 21.72 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 119.708 -0.187 . . . . 0.0 110.799 166.726 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.565 ' HB3' ' HA ' ' A' 1018 ' ' LYS . 2.1 tmt? -66.51 -51.75 53.3 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 118.207 0.458 . . . . 0.0 110.62 173.705 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1022 ' ' LEU . . . . . 0.835 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.2 OUTLIER -88.63 -1.76 58.24 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 119.205 -0.998 . . . . 0.0 109.84 -175.234 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A 1023 ' ' THR . . . . . 0.42 ' HB ' ' HA ' ' A' 1020 ' ' GLN . 33.1 m -87.1 -39.15 15.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.447 171.99 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.531 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -76.92 -21.24 55.16 Favored 'General case' 0 C--O 1.222 -0.356 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 170.636 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.847 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -84.52 -25.44 28.79 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.169 169.624 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.623 ' O ' HG23 ' A' 1030 ' ' VAL . 29.0 t-80 -74.17 -26.82 60.52 Favored 'General case' 0 C--O 1.217 -0.639 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 167.045 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1027 ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -68.01 -42.46 80.67 Favored 'General case' 0 C--N 1.321 -0.654 0 C-N-CA 123.454 0.701 . . . . 0.0 110.327 164.318 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.628 HD11 HD22 ' A' ' 998' ' ' LEU . 20.3 mt -57.08 -46.61 82.39 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 170.463 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -58.07 -41.75 84.04 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 111.711 0.263 . . . . 0.0 111.711 173.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' 1026 ' ' HIS . 19.3 t -67.8 -51.79 46.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 121.276 0.56 . . . . 0.0 110.952 -175.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.508 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 12.9 m-20 -76.64 -28.9 56.21 Favored 'General case' 0 C--O 1.217 -0.611 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.882 -175.833 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.577 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -59.38 -38.29 80.14 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 168.729 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 65.2 tttp -65.45 -47.42 76.2 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.748 0.785 . . . . 0.0 109.621 172.432 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.508 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 38.2 t30 -68.13 -52.38 35.5 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 114.319 -1.31 . . . . 0.0 112.202 -172.076 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1035 ' ' LEU . . . . . 1.065 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 3.8 pp -60.67 -37.05 80.27 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 -176.166 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.726 HD23 HG21 ' A' ' 925' ' ' VAL . 0.3 OUTLIER -68.17 -46.38 70.9 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 117.521 -1.672 . . . . 0.0 109.638 176.077 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 19.1 t70 -49.66 -39.15 35.28 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 122.238 1.018 . . . . 0.0 110.299 176.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.516 HG13 ' HG3' ' A' ' 983' ' ' GLU . 19.0 t -58.35 -45.25 89.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 113.665 -1.607 . . . . 0.0 112.38 175.716 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.642 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 2.0 mp -78.32 -31.59 16.23 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 CA-C-N 118.599 0.636 . . . . 0.0 110.722 177.504 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.621 ' HB3' ' HB ' ' A' ' 919' ' ' ILE . 27.0 m-20 -58.42 -40.58 82.9 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-O 120.945 0.403 . . . . 0.0 110.377 172.289 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -76.12 -37.94 57.48 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.642 0.258 . . . . 0.0 110.689 172.102 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.642 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -54.48 -46.36 73.37 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.908 -179.681 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.624 ' HG2' ' O ' ' A' 1039 ' ' ILE . 11.5 ptm180 -71.97 -42.53 66.41 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.205 -176.662 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.688 HD12 HG22 ' A' ' 919' ' ' ILE . 3.3 tt -61.07 -39.14 88.75 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 177.402 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.592 ' HD2' ' HG2' ' A' 1046 ' ' MET . 2.7 tmmm? -60.87 -32.74 72.17 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.855 -179.449 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.754 ' SD ' ' HB2' ' A' ' 979' ' ' SER . 35.5 mmm -94.79 -26.75 16.1 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 113.588 0.958 . . . . 0.0 113.588 -176.686 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.468 HG12 ' O ' ' A' 1043 ' ' ARG . 43.8 mm -83.31 -43.56 18.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.137 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1048 ' ' SER . . . . . 0.487 ' C ' ' H ' ' A' 1050 ' ' SER . 21.6 t -75.83 -56.9 4.23 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 175.564 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 44.8 tt0 68.49 -29.21 0.16 Allowed 'General case' 0 N--CA 1.471 0.622 0 O-C-N 123.525 0.516 . . . . 0.0 112.1 177.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1050 ' ' SER . . . . . 0.487 ' H ' ' C ' ' A' 1048 ' ' SER . 31.5 t -68.05 100.77 1.03 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 170.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 20.5 ttp180 63.13 85.17 0.17 Allowed Pre-proline 0 C--N 1.33 -0.241 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 -174.278 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -79.64 156.02 24.41 Favored 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 122.957 2.438 . . . . 0.0 113.98 -170.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 1053 ' ' HIS . . . . . 0.565 ' HB2' ' HB2' ' A' 1045 ' ' LYS . 86.5 m-70 . . . . . 0 C--N 1.327 -0.374 0 CA-C-N 115.081 -0.963 . . . . 0.0 109.032 173.793 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.756 0 N-CA-C 111.856 -0.498 . . . . 0.0 111.856 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 909' ' ' SER . . . . . 0.757 ' HB2' ' HD3' ' A' ' 910' ' ' PRO . 19.8 m -77.3 -54.86 1.42 Allowed Pre-proline 0 CA--C 1.538 0.495 0 CA-C-N 116.809 0.305 . . . . 0.0 111.111 178.873 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 910' ' ' PRO . . . . . 0.757 ' HD3' ' HB2' ' A' ' 909' ' ' SER . 3.2 Cg_endo -86.13 99.15 0.58 Allowed 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 122.304 2.003 . . . . 0.0 111.375 174.874 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -105.67 -42.53 1.69 Allowed Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.054 -179.659 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 45.9 mm -120.31 -45.84 2.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.075 0.464 . . . . 0.0 109.958 177.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 5.4 p -75.78 110.37 10.15 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.872 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 115.08 -168.2 12.51 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.003 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 130.81 -3.69 5.7 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.184 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . 136.15 67.57 0.06 OUTLIER Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 111.451 -0.66 . . . . 0.0 111.451 -176.459 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . 116.3 -65.88 0.31 Allowed Glycine 0 N--CA 1.449 -0.451 0 N-CA-C 111.432 -0.667 . . . . 0.0 111.432 -175.577 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 918' ' ' GLY . . . . . 0.855 ' H ' HD13 ' A' 1044 ' ' LEU . . . 83.49 128.1 1.38 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 121.083 -0.579 . . . . 0.0 112.449 178.077 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 919' ' ' ILE . . . . . 0.533 ' HB ' ' N ' ' A' 1041 ' ' GLN . 0.0 OUTLIER -56.13 153.19 1.94 Allowed 'Isoleucine or valine' 0 N--CA 1.424 -1.734 0 CA-C-O 121.378 0.609 . . . . 0.0 112.029 176.645 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.594 ' H ' ' HB3' ' A' 1040 ' ' ASP . 5.3 tmm_? 83.43 90.56 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 113.717 -1.583 . . . . 0.0 108.428 -176.518 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 1.7 m -117.76 29.79 7.63 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.923 -1.035 . . . . 0.0 111.323 -173.395 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 7.6 t30 63.42 87.5 0.11 Allowed 'General case' 0 N--CA 1.469 0.524 0 O-C-N 123.468 0.48 . . . . 0.0 109.868 -178.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.511 ' HB3' HG22 ' A' ' 925' ' ' VAL . 2.2 t70 -131.95 138.74 48.45 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 115.338 1.607 . . . . 0.0 115.338 -166.14 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 924' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -55.2 -30.74 60.54 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 112.724 -2.035 . . . . 0.0 112.553 173.183 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.511 HG22 ' HB3' ' A' ' 923' ' ' ASP . 28.6 m -55.19 -41.41 60.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-N 117.959 0.345 . . . . 0.0 111.312 -179.695 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.493 ' HA ' ' HB ' ' A' ' 929' ' ' VAL . 0.2 OUTLIER -79.26 -20.25 48.57 Favored 'General case' 0 CA--C 1.504 -0.801 0 O-C-N 122.105 -0.372 . . . . 0.0 111.003 179.583 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.73 -24.07 45.08 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 118.09 -1.444 . . . . 0.0 112.541 171.891 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -70.9 -26.78 63.37 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 167.604 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.553 HG21 HD23 ' A' 1036 ' ' LEU . 53.7 t -74.99 -32.22 26.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 114.223 -1.353 . . . . 0.0 110.419 174.67 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.499 ' O ' ' HB2' ' A' ' 934' ' ' LYS . 9.7 m -59.82 -42.99 94.75 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 119.032 0.833 . . . . 0.0 108.986 170.584 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -69.58 -52.46 20.85 Favored Glycine 0 CA--C 1.528 0.86 0 CA-C-N 115.242 -0.89 . . . . 0.0 113.557 178.31 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.55 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.9 pp -65.73 -49.39 68.61 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -176.097 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.546 HG22 ' HA ' ' A' 1029 ' ' ALA . 54.0 t -66.86 -40.85 86.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-O 120.872 0.368 . . . . 0.0 111.186 -173.806 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.654 ' O ' ' HG2' ' A' ' 938' ' ' GLU . 0.1 OUTLIER -58.3 -47.08 84.81 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.206 179.984 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -57.13 -43.19 82.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.19 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.828 HG22 ' HB1' ' A' 1025 ' ' ALA . 70.9 t -43.53 -68.32 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.892 177.731 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 13.7 pt -71.11 -49.69 47.18 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 N-CA-C 112.802 0.668 . . . . 0.0 112.802 -176.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.841 ' O ' ' HB3' ' A' ' 942' ' ' LYS . 11.6 pt-20 -73.06 -34.93 66.57 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 119.779 -0.768 . . . . 0.0 111.295 -169.142 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.599 ' HA ' HG22 ' A' ' 943' ' ' ILE . 62.5 mtt -74.33 -36.74 63.68 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 118.388 -1.325 . . . . 0.0 109.356 177.537 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.668 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 44.8 t -49.43 -54.73 16.03 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 114.609 -1.178 . . . . 0.0 113.082 -168.522 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 23.5 m -125.23 -18.26 5.44 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.608 -173.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.841 ' HB3' ' O ' ' A' ' 938' ' ' GLU . 1.5 tttp -83.45 -63.18 1.4 Allowed 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 119.83 -0.748 . . . . 0.0 110.644 -179.665 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.841 HG23 ' HG2' ' A' ' 950' ' ' GLU . 4.9 tp -74.76 -14.21 15.74 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 -172.655 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.66 ' HA ' HE21 ' A' ' 944' ' ' GLN . 0.0 OUTLIER -55.74 106.95 0.74 Allowed Pre-proline 0 N--CA 1.469 0.501 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 173.398 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.497 ' HB2' ' HD2' ' A' ' 947' ' ' PRO . 73.7 Cg_endo -99.34 -159.4 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.098 0 C-N-CA 123.614 2.876 . . . . 0.0 112.861 -174.571 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.697 ' HB3' ' HD3' ' A' ' 947' ' ' PRO . . . -69.74 -50.32 18.32 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.616 174.737 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.697 ' HD3' ' HB3' ' A' ' 946' ' ' ALA . 17.3 Cg_exo -68.74 107.73 1.73 Allowed 'Trans proline' 0 C--N 1.361 1.19 0 C-N-CA 121.833 1.689 . . . . 0.0 110.129 167.863 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.458 ' HB2' HG11 ' A' 1009 ' ' VAL . 9.1 Cg_exo -70.35 -176.29 1.6 Allowed 'Trans proline' 0 N--CA 1.464 -0.245 0 C-N-CA 122.993 2.462 . . . . 0.0 114.388 -168.395 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.633 ' HB3' ' CB ' ' A' 1006 ' ' GLN . 7.5 pt-20 42.36 89.73 0.01 OUTLIER 'General case' 0 CA--C 1.507 -0.709 0 CA-C-N 113.674 -1.603 . . . . 0.0 114.832 -174.445 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.841 ' HG2' HG23 ' A' ' 943' ' ' ILE . 0.1 OUTLIER -92.3 16.49 11.5 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 150.775 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.576 ' HB3' ' CG ' ' A' 1002 ' ' MET . 0.3 OUTLIER -72.21 -62.79 1.31 Allowed 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.989 -173.77 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 0.659 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 59.0 t -53.7 -48.23 94.02 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.867 170.762 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 0.659 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 81.7 Cg_exo -53.07 -34.16 66.72 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 121.917 1.744 . . . . 0.0 112.499 172.547 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.531 ' HA ' ' HB2' ' A' ' 957' ' ' GLU . 6.9 tpt -76.19 -31.43 58.46 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.065 177.641 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.513 HG22 ' HE3' ' A' 1002 ' ' MET . 75.4 t -53.39 -44.05 53.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 173.666 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 6.1 tmtt? -67.81 -34.01 75.91 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.828 -1.078 . . . . 0.0 112.055 175.009 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 957' ' ' GLU . . . . . 0.531 ' HB2' ' HA ' ' A' ' 954' ' ' MET . 25.3 mm-40 -77.63 -46.87 20.76 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -175.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.504 HG12 ' O ' ' A' ' 954' ' ' MET . 12.0 p -80.17 -31.86 13.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -59.35 -40.1 95.58 Favored Glycine 0 N--CA 1.444 -0.767 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 175.525 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 960' ' ' LEU . . . . . 0.543 HD12 ' HD3' ' A' ' 963' ' ' ARG . 23.7 tp -67.1 -33.6 75.83 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.66 -0.27 . . . . 0.0 111.112 176.917 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -80.38 -59.33 2.74 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.829 0.347 . . . . 0.0 110.696 -176.126 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.98 HD13 HD22 ' A' ' 995' ' ' LEU . 3.3 pp -50.76 -35.27 30.8 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.547 -0.751 . . . . 0.0 112.512 172.451 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.543 ' HD3' HD12 ' A' ' 960' ' ' LEU . 12.2 ptm180 -71.67 -38.77 70.6 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 119.958 1.254 . . . . 0.0 110.825 174.24 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 41.7 m -62.89 -34.42 77.35 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 176.188 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.891 HD23 HD22 ' A' ' 991' ' ' LEU . 26.3 tp -66.84 -45.31 78.65 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 114.845 -1.071 . . . . 0.0 111.021 176.044 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 0.632 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.4 tt -66.98 -36.14 81.53 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 -176.4 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 967' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 971' ' ' GLU . . . -72.66 -34.44 67.25 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 115.168 -0.923 . . . . 0.0 112.15 178.336 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 1.9 p -67.71 -37.63 82.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 119.031 0.832 . . . . 0.0 109.9 174.129 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.612 HG12 HG23 ' A' ' 984' ' ' ILE . 84.6 t -69.29 -40.6 80.43 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.535 172.518 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 970' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -68.17 -39.67 82.51 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.876 0.846 . . . . 0.0 109.216 -178.26 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.587 ' O ' HG23 ' A' ' 975' ' ' VAL . 6.8 tp10 -61.78 -36.56 81.44 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.553 -1.203 . . . . 0.0 109.135 176.082 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.446 ' HB2' ' O ' ' A' ' 969' ' ' VAL . 71.5 m -65.66 -19.56 65.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.361 176.23 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.662 ' HA ' HD13 ' A' ' 984' ' ' ILE . 51.7 tp -66.75 -52.31 34.29 Favored Pre-proline 0 CA--C 1.53 0.187 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.539 -174.145 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.625 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 95.7 Cg_endo -85.37 2.65 7.67 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 121.055 1.17 . . . . 0.0 112.996 172.148 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.587 HG23 ' O ' ' A' ' 971' ' ' GLU . 33.8 t -71.33 -50.81 38.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 166.564 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.583 ' HG ' HG12 ' A' ' 975' ' ' VAL . 96.8 mt -126.1 82.44 65.09 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.924 177.495 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -83.0 27.27 0.61 Allowed 'Trans proline' 0 N--CA 1.462 -0.372 0 C-N-CA 123.706 2.938 . . . . 0.0 112.864 -174.109 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -131.42 101.16 5.41 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.375 0.131 . . . . 0.0 111.03 -178.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.666 ' HB2' ' SD ' ' A' 1046 ' ' MET . 55.5 m 68.92 -47.68 0.57 Allowed 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.294 1.038 . . . . 0.0 112.843 175.066 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.523 HG23 ' HB1' ' A' 1042 ' ' ALA . 65.4 m -56.0 -25.69 45.3 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 169.554 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 981' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -55.19 -35.87 65.3 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 113.772 -1.558 . . . . 0.0 111.264 176.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 982' ' ' ARG . . . . . 0.517 ' HA ' ' HG2' ' A' ' 985' ' ' GLU . 1.5 ptp180 -82.99 -19.79 36.36 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.408 -0.517 . . . . 0.0 111.124 -178.276 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.533 ' HG3' HG13 ' A' 1038 ' ' VAL . 1.2 mp0 -77.17 -33.64 56.5 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 119.69 -0.804 . . . . 0.0 109.126 171.178 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.755 ' HA ' HD11 ' A' 1039 ' ' ILE . 67.9 mt -71.87 -34.78 52.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 CA-C-N 114.952 -1.022 . . . . 0.0 109.909 179.34 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 985' ' ' GLU . . . . . 0.517 ' HG2' ' HA ' ' A' ' 982' ' ' ARG . 10.7 pt-20 -70.21 -44.96 67.56 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.697 0.76 . . . . 0.0 109.563 -179.252 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 986' ' ' MET . . . . . 0.551 ' HA ' ' HD3' ' A' ' 989' ' ' LYS . 66.3 mtt -73.63 -42.92 60.79 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 114.786 -1.097 . . . . 0.0 111.715 -172.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.843 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -68.24 -51.37 46.03 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.809 -173.824 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.632 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 25.9 pt20 -61.44 -24.32 66.47 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 120.497 -0.481 . . . . 0.0 110.754 177.727 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 989' ' ' LYS . . . . . 0.655 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 0.0 OUTLIER -76.12 -38.86 56.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.011 0.434 . . . . 0.0 111.181 173.842 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 12.3 tp -53.24 -59.74 4.18 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.692 -0.686 . . . . 0.0 112.107 178.622 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.891 HD22 HD23 ' A' ' 965' ' ' LEU . 9.9 tp -57.82 -38.5 75.72 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-O 121.529 0.68 . . . . 0.0 109.711 177.682 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 992' ' ' ASN . . . . . 0.655 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 42.4 t-20 -49.34 -51.32 35.26 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 113.895 -1.502 . . . . 0.0 111.549 -176.396 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 993' ' ' SER . . . . . 0.456 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 28.7 t -78.17 -31.53 49.68 Favored 'General case' 0 C--N 1.319 -0.717 0 C-N-CA 120.163 -0.615 . . . . 0.0 111.969 179.267 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 994' ' ' ASP . . . . . 0.4 ' O ' ' HB2' ' A' ' 997' ' ' GLU . 0.1 OUTLIER -71.32 -34.6 70.72 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 119.146 -1.021 . . . . 0.0 111.76 -179.925 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 0.98 HD22 HD13 ' A' ' 962' ' ' LEU . 3.0 pp -71.71 -16.95 62.25 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 171.22 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -78.59 -27.0 45.58 Favored 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 119.981 -0.688 . . . . 0.0 109.898 167.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.456 ' HG2' ' O ' ' A' ' 993' ' ' SER . 5.0 mm-40 -72.15 -45.29 61.09 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 173.012 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.882 HD13 ' HB2' ' A' 1025 ' ' ALA . 0.1 OUTLIER -56.17 -48.03 77.12 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.941 -176.074 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.585 ' O ' ' HB2' ' A' 1003 ' ' LYS . 91.6 mt -66.75 -40.59 86.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.265 -175.329 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 16.7 m-80 -62.04 -40.15 94.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.344 0.592 . . . . 0.0 111.709 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.866 ' HD3' ' HG2' ' A' 1020 ' ' GLN . 86.6 mttt -79.84 -40.84 27.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 122.097 0.951 . . . . 0.0 109.288 -175.806 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.576 ' CG ' ' HB3' ' A' ' 951' ' ' TYR . 22.5 ttp -61.06 -26.38 67.6 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.232 -1.349 . . . . 0.0 109.637 175.18 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.585 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 11.5 tptp -74.12 -54.96 6.69 Favored 'General case' 0 N--CA 1.438 -1.037 0 CA-C-N 114.894 -1.048 . . . . 0.0 111.551 -171.43 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.73 ' HA ' ' HB2' ' A' 1007 ' ' GLN . 7.6 mp -68.05 -13.73 62.43 Favored 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 120.305 -0.558 . . . . 0.0 110.73 179.389 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.885 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -69.86 -42.2 73.84 Favored 'General case' 0 C--O 1.213 -0.841 0 C-N-CA 119.768 -0.773 . . . . 0.0 109.326 176.075 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.954 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -77.35 -34.57 55.09 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 119.063 -0.494 . . . . 0.0 111.754 171.224 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.73 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 14.7 mm100 -46.14 -49.01 17.26 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.399 0.618 . . . . 0.0 110.637 175.107 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.553 ' HB2' HD22 ' A' 1013 ' ' LEU . 60.0 m-85 -126.99 46.28 2.54 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.602 0.715 . . . . 0.0 110.584 172.738 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1009 ' ' VAL . . . . . 1.11 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 10.7 p -54.05 -18.53 2.45 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.352 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.219 170.255 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 84.5 mtp -49.32 -38.17 26.82 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 113.796 -1.547 . . . . 0.0 111.731 174.725 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1011 ' ' THR . . . . . 0.419 ' O ' ' HB3' ' A' 1014 ' ' GLN . 0.0 OUTLIER -162.55 -102.82 0.02 OUTLIER 'General case' 0 C--O 1.245 0.862 0 N-CA-C 114.976 1.473 . . . . 0.0 114.976 179.729 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 19.7 m -57.7 -60.52 3.56 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.906 -164.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.713 ' HG ' ' CE2' ' A' 1017 ' ' TYR . 3.1 mp -45.85 -43.09 13.21 Favored 'General case' 0 CA--C 1.506 -0.734 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 177.08 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1014 ' ' GLN . . . . . 1.11 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 1.4 tt0 -54.99 -50.21 69.57 Favored 'General case' 0 N--CA 1.443 -0.822 0 O-C-N 123.752 0.658 . . . . 0.0 111.879 -168.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1015 ' ' GLN . . . . . 0.687 ' O ' ' HB3' ' A' 1019 ' ' LYS . 78.3 mm-40 -70.26 -41.62 73.25 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.433 -174.383 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1016 ' ' GLU . . . . . 0.476 ' O ' ' HD3' ' A' 1019 ' ' LYS . 30.2 tt0 -69.3 -55.04 11.65 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.338 0.59 . . . . 0.0 110.833 178.531 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.885 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 9.9 m-85 -60.08 -38.8 83.98 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -176.602 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.601 ' HA ' ' HB3' ' A' 1021 ' ' MET . 23.5 tptm -81.21 -30.45 34.26 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.539 -178.406 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1019 ' ' LYS . . . . . 0.687 ' HB3' ' O ' ' A' 1015 ' ' GLN . 0.1 OUTLIER -73.34 -39.04 65.53 Favored 'General case' 0 C--O 1.222 -0.36 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 175.17 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A 1020 ' ' GLN . . . . . 0.866 ' HG2' ' HD3' ' A' 1001 ' ' LYS . 61.8 tt0 -63.66 -32.41 73.88 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.424 165.24 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.601 ' HB3' ' HA ' ' A' 1018 ' ' LYS . 2.0 tmt? -64.25 -51.12 65.19 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 177.538 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1022 ' ' LEU . . . . . 0.555 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -81.82 -6.82 59.4 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 119.343 -0.943 . . . . 0.0 109.919 -175.005 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 62.8 m -87.33 -36.75 17.66 Favored 'General case' 0 C--O 1.223 -0.313 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 173.728 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.514 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -79.08 -22.72 44.88 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 172.74 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.882 ' HB2' HD13 ' A' ' 998' ' ' LEU . . . -86.14 -22.44 27.05 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.113 169.612 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.591 ' O ' HG23 ' A' 1030 ' ' VAL . 83.7 t60 -76.43 -25.0 53.99 Favored 'General case' 0 C--O 1.214 -0.792 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 165.319 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1027 ' ' ALA . . . . . 0.514 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -69.14 -41.09 77.77 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 123.783 0.833 . . . . 0.0 109.959 163.332 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.681 ' CD1' HD22 ' A' ' 998' ' ' LEU . 18.0 mt -60.44 -45.58 93.14 Favored 'General case' 0 C--N 1.314 -0.95 0 C-N-CA 119.933 -0.707 . . . . 0.0 109.259 170.072 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1029 ' ' ALA . . . . . 0.546 ' HA ' HG22 ' A' ' 933' ' ' VAL . . . -57.55 -42.91 83.93 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.41 0.148 . . . . 0.0 111.274 173.41 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' 1026 ' ' HIS . 12.3 t -67.4 -52.16 44.84 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 CA-C-O 121.652 0.739 . . . . 0.0 110.648 -177.781 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.503 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 38.8 m-20 -77.34 -29.39 53.44 Favored 'General case' 0 C--O 1.216 -0.681 0 CA-C-N 114.742 -1.117 . . . . 0.0 112.207 -174.51 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.945 ' HA ' HD22 ' A' 1035 ' ' LEU . . . -71.82 -29.9 64.92 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 170.87 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.418 ' O ' ' HG ' ' A' 1036 ' ' LEU . 87.9 tttt -65.68 -49.36 68.86 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.823 0.821 . . . . 0.0 109.18 168.304 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.503 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 10.6 t30 -68.74 -44.3 74.08 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 114.383 -1.28 . . . . 0.0 112.8 -174.856 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.945 HD22 ' HA ' ' A' 1032 ' ' ALA . 0.2 OUTLIER -64.52 -37.63 88.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 118.039 0.382 . . . . 0.0 110.099 -176.75 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.553 HD23 HG21 ' A' ' 929' ' ' VAL . 4.0 pp -72.03 -41.57 67.37 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 117.25 -1.78 . . . . 0.0 108.888 178.408 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.495 ' HB3' ' O ' ' A' 1034 ' ' ASN . 7.6 t70 -49.85 -46.23 51.18 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 114.272 -1.331 . . . . 0.0 110.117 172.479 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.533 HG13 ' HG3' ' A' ' 983' ' ' GLU . 15.5 t -54.51 -47.28 71.42 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.643 0 CA-C-N 114.004 -1.453 . . . . 0.0 111.822 174.935 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.755 HD11 ' HA ' ' A' ' 984' ' ' ILE . 1.4 mp -77.77 -35.68 21.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 118.775 0.716 . . . . 0.0 112.076 179.338 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.777 ' HA ' ' HE ' ' A' 1043 ' ' ARG . 1.9 m-20 -59.23 -45.9 89.92 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-O 120.73 0.3 . . . . 0.0 110.832 173.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.533 ' N ' ' HB ' ' A' ' 919' ' ' ILE . 0.0 OUTLIER -77.73 -26.33 49.91 Favored 'General case' 0 N--CA 1.432 -1.353 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 176.294 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.664 ' HA ' ' CD2' ' A' 1053 ' ' HIS . . . -54.29 -48.45 71.24 Favored 'General case' 0 CA--C 1.505 -0.773 0 C-N-CA 122.997 0.519 . . . . 0.0 111.804 175.929 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.777 ' HE ' ' HA ' ' A' 1040 ' ' ASP . 3.2 ptt180 -70.61 -40.5 73.15 Favored 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 120.432 -0.507 . . . . 0.0 109.75 -177.962 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.855 HD13 ' H ' ' A' ' 918' ' ' GLY . 12.3 tp -57.21 -47.0 82.38 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.104 173.608 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.434 ' HB3' ' CD2' ' A' 1053 ' ' HIS . 1.1 tmtt? -71.81 -35.79 70.07 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 123.571 0.749 . . . . 0.0 109.636 -175.188 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.666 ' SD ' ' HB2' ' A' ' 979' ' ' SER . 1.2 tmm? -64.11 -36.02 82.67 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 120.173 -0.611 . . . . 0.0 111.027 175.599 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.453 HG12 ' O ' ' A' 1043 ' ' ARG . 49.0 mm -82.39 -43.39 19.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.522 0.201 . . . . 0.0 111.293 179.395 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 30.0 t -65.08 -30.11 71.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.388 -176.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 49.7 mm-40 -81.48 -95.75 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.353 177.072 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 40.6 t 179.28 -56.53 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 -173.495 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 1051 ' ' ARG . . . . . 0.808 ' HB2' ' HD3' ' A' 1052 ' ' PRO . 83.9 mtm180 -136.07 -64.04 0.02 OUTLIER Pre-proline 0 C--O 1.219 -0.511 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.896 -178.714 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1052 ' ' PRO . . . . . 0.808 ' HD3' ' HB2' ' A' 1051 ' ' ARG . 94.7 Cg_endo -88.48 138.11 3.74 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 121.765 1.643 . . . . 0.0 113.91 -172.458 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 1053 ' ' HIS . . . . . 0.664 ' CD2' ' HA ' ' A' 1042 ' ' ALA . 3.2 t-80 . . . . . 0 C--N 1.325 -0.464 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 170.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.787 0 N-CA-C 111.663 -0.575 . . . . 0.0 111.663 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 11.0 p -132.88 150.13 74.81 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 116.76 0.28 . . . . 0.0 110.412 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -60.32 -43.05 36.95 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.441 2.094 . . . . 0.0 111.647 176.349 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . 93.88 92.22 1.6 Allowed Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.82 175.218 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 34.3 pt -129.5 141.12 47.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 175.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 14.7 m -101.22 -42.1 6.47 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.133 0.492 . . . . 0.0 109.933 179.706 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . -77.89 67.72 2.91 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.652 -0.703 . . . . 0.0 111.926 178.487 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . -83.0 88.61 1.49 Allowed Glycine 0 N--CA 1.444 -0.799 0 N-CA-C 111.603 -0.599 . . . . 0.0 111.603 178.402 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . -59.59 107.15 1.15 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 121.343 -0.456 . . . . 0.0 112.303 178.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . 166.33 -129.39 1.92 Allowed Glycine 0 N--CA 1.445 -0.731 0 N-CA-C 111.044 -0.822 . . . . 0.0 111.044 -178.278 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -119.15 -65.01 0.29 Allowed Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 120.63 -0.795 . . . . 0.0 111.786 178.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 919' ' ' ILE . . . . . 0.811 HG21 ' HB2' ' A' 1044 ' ' LEU . 46.5 mm -108.09 30.93 1.02 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 CA-C-O 122.431 1.11 . . . . 0.0 109.635 -177.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 919' ' ' ILE . 8.0 mpt_? 77.66 54.22 0.03 OUTLIER 'General case' 0 C--O 1.234 0.253 0 CA-C-N 114.292 -1.322 . . . . 0.0 113.397 168.762 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 14.7 m -128.36 89.13 2.85 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.908 0.385 . . . . 0.0 110.248 169.062 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 0.588 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 57.5 t30 -84.85 -59.76 2.25 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 177.689 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.656 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 4.7 m-20 46.49 -174.42 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 116.594 2.072 . . . . 0.0 116.594 166.794 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.458 ' HA ' ' HG2' ' A' ' 927' ' ' GLU . 12.2 mmtp -57.36 -23.27 47.95 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 113.659 -1.609 . . . . 0.0 112.2 177.514 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.619 HG23 HD22 ' A' 1036 ' ' LEU . 33.9 m -62.22 -29.86 47.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 176.788 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.656 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -77.02 -32.95 57.42 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 118.854 -0.594 . . . . 0.0 111.651 176.535 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 927' ' ' GLU . . . . . 0.826 ' HA ' ' HB ' ' A' ' 930' ' ' THR . 4.1 pt-20 -75.64 -25.59 56.98 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.833 1.197 . . . . 0.0 111.268 176.808 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.589 ' OD1' ' HB ' ' A' ' 964' ' ' THR . 69.8 m-80 -75.63 -26.89 58.15 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 119.338 0.972 . . . . 0.0 110.582 173.013 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.728 HG22 ' HB1' ' A' 1032 ' ' ALA . 98.4 t -75.15 -30.1 22.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 167.189 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.826 ' HB ' ' HA ' ' A' ' 927' ' ' GLU . 0.9 OUTLIER -63.26 -42.85 99.2 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 169.907 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -72.56 -54.02 7.97 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 120.667 -0.778 . . . . 0.0 113.585 176.551 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.556 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.8 pp -62.33 -48.47 79.67 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -176.577 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 79.7 t -67.28 -39.89 83.82 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 CA-C-O 121.103 0.477 . . . . 0.0 110.913 -175.87 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.602 ' HB2' ' O ' ' A' ' 930' ' ' THR . 0.2 OUTLIER -62.07 -35.38 78.47 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.683 179.036 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -64.16 -42.18 96.86 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.832 176.754 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.746 HG22 ' HB1' ' A' 1025 ' ' ALA . 49.6 t -49.76 -85.01 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 C-N-CA 123.36 0.664 . . . . 0.0 112.218 -179.114 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.452 ' O ' ' HB2' ' A' ' 940' ' ' SER . 15.8 pt -61.61 -42.47 94.24 Favored 'Isoleucine or valine' 0 C--O 1.248 1.005 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -173.03 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.523 ' HB3' ' O ' ' A' ' 934' ' ' LYS . 23.9 tp10 -61.5 -53.2 59.61 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.271 -172.504 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.508 ' HA ' HG12 ' A' ' 943' ' ' ILE . 78.4 mtp -71.3 -26.55 62.91 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.36 -177.076 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.601 ' HA ' ' OE1' ' A' ' 949' ' ' GLU . 6.9 m -51.4 -49.73 61.01 Favored 'General case' 0 CA--C 1.514 -0.441 0 O-C-N 124.238 0.961 . . . . 0.0 112.122 -172.45 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 7.4 m -104.1 -30.73 10.05 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.215 -174.117 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.489 ' HG3' ' O ' ' A' ' 938' ' ' GLU . 0.0 OUTLIER -85.96 -46.7 10.3 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 118.622 -1.231 . . . . 0.0 112.111 -164.614 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.508 HG12 ' HA ' ' A' ' 939' ' ' MET . 32.6 mm -50.28 -39.31 16.53 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 -175.358 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.624 ' HG2' ' CA ' ' A' ' 949' ' ' GLU . 0.0 OUTLIER -139.29 110.26 7.62 Favored Pre-proline 0 C--N 1.321 -0.654 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 -169.434 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.421 ' HD2' ' HD2' ' A' ' 947' ' ' PRO . 21.9 Cg_endo -96.86 2.6 1.78 Allowed 'Trans proline' 0 N--CA 1.45 -1.051 0 C-N-CA 123.454 2.769 . . . . 0.0 111.669 169.172 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.55 ' H ' ' HD2' ' A' ' 947' ' ' PRO . . . -158.62 -53.48 0.01 OUTLIER Pre-proline 0 CA--C 1.536 0.417 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.83 -176.364 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.616 ' O ' ' HB2' ' A' ' 944' ' ' GLN . 86.7 Cg_endo -79.67 -177.47 3.87 Favored 'Trans proline' 0 C--N 1.359 1.1 0 C-N-CA 122.094 1.862 . . . . 0.0 111.476 177.165 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.746 ' HB3' ' HB2' ' A' 1006 ' ' GLN . 49.0 Cg_endo -70.83 160.21 50.12 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 121.986 1.791 . . . . 0.0 112.118 173.595 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.624 ' CA ' ' HG2' ' A' ' 944' ' ' GLN . 38.2 tt0 -69.19 -2.38 10.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.017 -178.203 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.482 ' HB3' ' HG2' ' A' ' 953' ' ' PRO . 49.2 mt-10 53.89 43.13 31.33 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 -163.387 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 1.119 ' HA ' ' HB3' ' A' ' 954' ' ' MET . 0.4 OUTLIER -75.64 -15.03 60.38 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.081 -0.648 . . . . 0.0 111.975 -167.785 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 0.698 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 56.8 t -64.42 -52.41 53.49 Favored Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 166.332 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 0.698 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 25.6 Cg_exo -50.01 -37.81 47.88 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 121.845 1.696 . . . . 0.0 112.474 162.944 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 954' ' ' MET . . . . . 1.119 ' HB3' ' HA ' ' A' ' 951' ' ' TYR . 3.6 tpt -64.96 -32.73 74.59 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 122.764 0.426 . . . . 0.0 110.825 174.359 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.624 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 87.9 t -53.75 -41.65 48.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 169.336 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.507 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 8.9 tmtt? -67.78 -32.04 72.35 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.482 176.071 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -78.0 -48.06 17.07 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.967 0.413 . . . . 0.0 111.597 -175.624 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.559 HG22 HD23 ' A' ' 962' ' ' LEU . 12.5 p -84.99 -35.52 10.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.279 -178.453 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -62.26 -41.25 99.73 Favored Glycine 0 N--CA 1.448 -0.546 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 179.182 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 960' ' ' LEU . . . . . 0.57 ' O ' ' HG3' ' A' ' 963' ' ' ARG . 24.9 tp -71.75 -31.2 66.41 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.667 -0.123 . . . . 0.0 110.667 178.039 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -73.7 -60.83 2.07 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.968 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 1.058 HD13 HD22 ' A' ' 995' ' ' LEU . 4.0 pp -50.64 -35.35 30.11 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 172.039 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.604 ' N ' HD12 ' A' ' 962' ' ' LEU . 0.0 OUTLIER -71.09 -36.21 72.11 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 120.173 1.351 . . . . 0.0 111.022 175.2 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 964' ' ' THR . . . . . 0.589 ' HB ' ' OD1' ' A' ' 928' ' ' ASN . 17.6 m -71.56 -27.0 62.86 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.281 -0.567 . . . . 0.0 109.498 177.563 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.635 HD23 HD22 ' A' ' 991' ' ' LEU . 36.8 tp -65.65 -45.55 82.54 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-O 122.103 0.954 . . . . 0.0 109.566 169.303 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 0.717 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 9.2 tt -65.54 -37.25 86.19 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 114.484 -1.235 . . . . 0.0 108.664 -176.084 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 967' ' ' ALA . . . . . 0.585 ' O ' ' HB2' ' A' ' 971' ' ' GLU . . . -75.53 -29.47 59.44 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.492 179.277 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 1.1 p -72.03 -36.48 69.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 118.497 0.59 . . . . 0.0 110.029 174.726 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.702 HG12 HG23 ' A' ' 984' ' ' ILE . 96.9 t -72.43 -39.25 62.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.311 171.677 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.583 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 26.1 t70 -65.9 -38.15 87.98 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 122.19 0.995 . . . . 0.0 108.435 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.687 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 4.9 tp10 -63.56 -37.0 85.67 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.045 -1.434 . . . . 0.0 109.496 176.376 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.469 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 24.1 m -63.26 -17.97 63.07 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.559 175.596 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.765 ' HA ' HD13 ' A' ' 984' ' ' ILE . 8.4 tt -68.88 -52.62 16.73 Favored Pre-proline 0 CA--C 1.535 0.372 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.265 -177.199 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.736 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 1.8 Cg_endo -87.8 -14.3 3.65 Favored 'Trans proline' 0 C--N 1.358 1.036 0 C-N-CA 121.667 1.578 . . . . 0.0 113.676 174.409 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.498 HG23 ' O ' ' A' ' 971' ' ' GLU . 13.7 t -62.37 -44.75 99.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 173.035 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.456 HD21 ' HB3' ' A' 1043 ' ' ARG . 10.0 mp -80.44 152.94 73.6 Favored Pre-proline 0 C--N 1.323 -0.552 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 171.612 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_exo -39.19 -64.71 0.2 Allowed 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 123.517 2.811 . . . . 0.0 113.919 -175.237 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . 178.6 -34.24 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.251 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.261 -179.413 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.452 ' HB3' ' CE ' ' A' 1046 ' ' MET . 1.5 m -44.84 -49.74 10.66 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.181 -177.093 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.486 HG23 ' HB1' ' A' 1042 ' ' ALA . 16.1 m -73.33 -5.82 42.11 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -171.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 981' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -50.27 -36.26 30.62 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 -171.692 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 982' ' ' ARG . . . . . 0.534 ' HA ' ' HG2' ' A' ' 985' ' ' GLU . 7.0 ptp180 -83.2 -22.36 33.19 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 118.986 -1.085 . . . . 0.0 112.142 -168.74 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.515 ' OE2' HG13 ' A' 1038 ' ' VAL . 2.0 mt-10 -80.03 -35.74 36.81 Favored 'General case' 0 CA--C 1.501 -0.931 0 C-N-CA 119.39 -0.924 . . . . 0.0 109.734 171.095 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.765 HD13 ' HA ' ' A' ' 973' ' ' LEU . 48.7 mt -64.97 -37.44 80.25 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-N 114.795 -1.093 . . . . 0.0 108.927 178.863 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 985' ' ' GLU . . . . . 0.722 ' HA ' HE21 ' A' ' 988' ' ' GLN . 11.3 pt-20 -74.09 -38.52 63.85 Favored 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 118.317 -1.353 . . . . 0.0 110.362 -177.835 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 986' ' ' MET . . . . . 0.654 ' O ' ' HB3' ' A' ' 989' ' ' LYS . 26.3 ttt -72.22 -37.28 69.24 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.889 -173.746 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.995 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -76.34 -49.74 16.08 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.878 -1.056 . . . . 0.0 111.879 -172.528 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.722 HE21 ' HA ' ' A' ' 985' ' ' GLU . 28.0 pt20 -59.73 -26.15 65.41 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.559 0.695 . . . . 0.0 109.629 173.378 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 989' ' ' LYS . . . . . 0.796 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 7.8 tmtm? -71.11 -39.73 71.9 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.586 -1.188 . . . . 0.0 111.287 172.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 18.2 tp -55.97 -58.36 8.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.569 176.627 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.635 HD22 HD23 ' A' ' 965' ' ' LEU . 13.0 tp -55.19 -36.07 65.5 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.557 0.694 . . . . 0.0 109.804 177.068 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 992' ' ' ASN . . . . . 0.796 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 25.4 t-20 -48.86 -52.04 26.43 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 113.751 -1.568 . . . . 0.0 112.119 -177.106 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 32.1 t -74.39 -35.83 63.49 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.33 -36.69 77.2 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 119.246 -0.982 . . . . 0.0 111.829 -178.358 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 1.058 HD22 HD13 ' A' ' 962' ' ' LEU . 3.2 pp -70.45 -23.47 62.72 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 122.808 0.443 . . . . 0.0 110.416 172.294 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -73.44 -28.1 61.78 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 119.527 -0.869 . . . . 0.0 109.978 170.318 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.766 ' O ' ' HG2' ' A' 1001 ' ' LYS . 17.0 mt-10 -75.25 -41.72 56.74 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 172.091 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.648 ' HB3' ' HA ' ' A' ' 995' ' ' LEU . 0.4 OUTLIER -54.78 -46.76 74.47 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.968 -175.611 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 995' ' ' LEU . 71.5 mt -66.84 -43.28 89.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.199 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 10.3 m-80 -58.5 -44.89 89.61 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.453 0.644 . . . . 0.0 112.34 -178.343 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.766 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 28.5 mmtp -74.7 -40.38 61.38 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 122.29 1.043 . . . . 0.0 108.381 -171.624 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.569 ' HG2' ' CG ' ' A' ' 951' ' ' TYR . 16.2 ttp -57.03 -43.89 82.36 Favored 'General case' 0 N--CA 1.428 -1.531 0 CA-C-N 113.894 -1.503 . . . . 0.0 108.419 176.841 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.494 ' HA ' ' CE1' ' A' ' 951' ' ' TYR . 1.5 tptm -64.0 -33.0 74.75 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 114.141 -1.391 . . . . 0.0 112.313 -168.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.801 HD13 ' HG3' ' A' 1007 ' ' GLN . 4.2 mm? -84.06 -14.87 49.39 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.007 -0.677 . . . . 0.0 110.948 177.273 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.64 ' HB1' ' HA ' ' A' 1014 ' ' GLN . . . -63.45 -50.81 68.26 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 119.391 -0.924 . . . . 0.0 110.55 -177.944 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1006 ' ' GLN . . . . . 1.026 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 2.2 pp0? -76.99 -24.66 52.23 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 118.979 0.809 . . . . 0.0 110.936 177.328 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.801 ' HG3' HD13 ' A' 1004 ' ' LEU . 18.4 mm-40 -41.75 -40.08 1.91 Allowed 'General case' 0 C--N 1.344 0.336 0 CA-C-O 121.363 0.601 . . . . 0.0 109.795 169.737 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.921 ' HD2' HD22 ' A' 1013 ' ' LEU . 82.7 m-85 -132.1 45.1 2.81 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.631 166.829 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1009 ' ' VAL . . . . . 1.032 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 7.3 p -49.48 -22.96 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 CA-C-O 121.251 0.548 . . . . 0.0 109.987 171.469 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 21.6 mmt -42.7 -45.83 4.86 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.938 174.043 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 15.9 m -162.23 -84.24 0.03 OUTLIER 'General case' 0 C--O 1.248 0.987 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 176.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1012 ' ' SER . . . . . 0.454 ' O ' ' HG2' ' A' 1015 ' ' GLN . 15.6 m -55.27 -73.41 0.05 Allowed 'General case' 0 C--O 1.234 0.256 0 CA-C-N 114.807 -1.088 . . . . 0.0 112.844 -164.803 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.921 HD22 ' HD2' ' A' 1008 ' ' TYR . 8.7 mp -47.72 -42.85 26.22 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -177.823 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1014 ' ' GLN . . . . . 1.032 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -55.8 -45.73 78.16 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.206 -0.598 . . . . 0.0 111.083 -169.403 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A 1015 ' ' GLN . . . . . 0.46 ' O ' ' HD3' ' A' 1019 ' ' LYS . 11.0 pt20 -75.57 -41.04 55.76 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.153 -176.287 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -72.39 -56.33 5.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.328 0.585 . . . . 0.0 110.834 -178.184 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.695 ' CE2' ' HG ' ' A' 1013 ' ' LEU . 8.7 m-85 -58.03 -39.01 77.32 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.097 -0.956 . . . . 0.0 113.241 -178.12 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.572 ' HA ' ' CB ' ' A' 1021 ' ' MET . 8.4 ttpp -82.17 -24.59 34.91 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.844 -176.557 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1019 ' ' LYS . . . . . 0.46 ' HD3' ' O ' ' A' 1015 ' ' GLN . 4.0 mptp? -71.57 -46.12 60.28 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 171.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -56.19 -31.93 63.9 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 114.867 -1.061 . . . . 0.0 110.986 164.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.587 ' HG2' HD22 ' A' ' 998' ' ' LEU . 18.2 tmm? -69.21 -53.69 18.66 Favored 'General case' 0 CA--C 1.509 -0.611 0 O-C-N 122.16 -0.337 . . . . 0.0 110.793 176.076 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1022 ' ' LEU . . . . . 0.5 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.3 OUTLIER -80.29 -8.55 59.52 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 119.478 -0.889 . . . . 0.0 109.78 -171.229 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 85.3 m -88.83 -31.43 18.32 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.725 172.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.474 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -79.42 -24.73 42.32 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-O 121.419 0.628 . . . . 0.0 109.444 171.489 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.746 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -86.44 -24.74 25.55 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.222 170.59 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.563 ' O ' HG23 ' A' 1030 ' ' VAL . 47.0 t-80 -74.6 -26.73 60.1 Favored 'General case' 0 C--O 1.214 -0.765 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 164.533 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1027 ' ' ALA . . . . . 0.47 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -68.97 -40.72 78.67 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 123.664 0.785 . . . . 0.0 110.118 163.576 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.668 HD21 ' N ' ' A' ' 995' ' ' LEU . 22.6 mt -59.81 -44.69 93.86 Favored 'General case' 0 C--N 1.315 -0.898 0 C-N-CA 119.996 -0.682 . . . . 0.0 109.456 169.638 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -58.46 -43.25 88.8 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.755 0.312 . . . . 0.0 111.383 173.09 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.563 HG23 ' O ' ' A' 1026 ' ' HIS . 13.2 t -67.79 -50.55 59.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.168 0.509 . . . . 0.0 110.747 -177.113 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.6 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 47.0 m-20 -75.32 -28.93 59.85 Favored 'General case' 0 C--O 1.214 -0.804 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.551 -175.961 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.766 ' HA ' HD12 ' A' 1035 ' ' LEU . . . -64.35 -39.58 94.16 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 168.635 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.404 ' HE2' ' HB3' ' A' 1033 ' ' LYS . 13.4 ttpt -63.1 -43.94 97.07 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 122.092 0.948 . . . . 0.0 109.25 171.905 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.6 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 51.2 t30 -72.93 -52.56 14.15 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-N 113.975 -1.466 . . . . 0.0 112.465 -171.47 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.995 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 0.0 OUTLIER -64.32 -34.95 79.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 119.468 -0.301 . . . . 0.0 110.759 -173.284 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.678 ' N ' HD13 ' A' 1035 ' ' LEU . 4.6 pp -72.97 -36.47 67.11 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 116.88 -1.928 . . . . 0.0 109.673 177.252 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.541 ' HB3' ' O ' ' A' 1034 ' ' ASN . 20.5 t70 -55.24 -43.54 74.68 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 122.336 1.065 . . . . 0.0 110.087 172.637 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.547 ' HB ' ' O ' ' A' 1035 ' ' LEU . 15.2 t -51.95 -58.18 2.69 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.512 0 CA-C-N 113.302 -1.772 . . . . 0.0 111.019 172.854 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.763 HG12 HG12 ' A' ' 984' ' ' ILE . 2.5 mp -67.52 -23.87 30.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 118.188 0.449 . . . . 0.0 111.604 179.371 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.533 ' CG ' ' H ' ' A' ' 919' ' ' ILE . 1.5 t0 -62.3 -48.98 77.48 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.694 0.759 . . . . 0.0 110.285 171.79 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -72.58 -36.31 68.13 Favored 'General case' 0 C--N 1.31 -1.136 0 O-C-N 122.021 -0.424 . . . . 0.0 109.951 176.183 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.702 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -53.02 -48.93 67.18 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 123.462 0.705 . . . . 0.0 112.499 -179.544 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.652 ' O ' HG12 ' A' 1047 ' ' ILE . 9.7 ptp180 -61.07 -51.8 67.62 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.353 179.444 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.811 ' HB2' HG21 ' A' ' 919' ' ' ILE . 3.2 tm? -61.16 -40.08 92.51 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.213 0.53 . . . . 0.0 109.836 179.612 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.716 ' HE2' ' HB2' ' A' 1053 ' ' HIS . 47.5 mtpt -61.58 -42.67 99.19 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.404 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.452 ' CE ' ' HB3' ' A' ' 979' ' ' SER . 86.3 mmm -74.71 -27.48 60.4 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.538 -0.465 . . . . 0.0 112.102 176.821 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.652 HG12 ' O ' ' A' 1043 ' ' ARG . 28.8 mm -58.63 -48.34 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-O 121.079 0.466 . . . . 0.0 110.522 175.544 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 47.9 m -145.74 72.26 1.3 Allowed 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.124 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1049 ' ' GLN . . . . . 0.434 ' NE2' ' H ' ' A' 1053 ' ' HIS . 32.1 tt0 -71.22 127.9 34.13 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 122.211 1.005 . . . . 0.0 111.902 -176.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 70.0 p -133.22 8.65 4.02 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 113.567 -1.652 . . . . 0.0 107.307 171.05 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1051 ' ' ARG . . . . . 0.761 ' HB3' ' HD2' ' A' 1052 ' ' PRO . 52.1 mtp85 -133.01 178.89 1.55 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 113.865 -1.516 . . . . 0.0 109.083 -169.236 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1052 ' ' PRO . . . . . 0.761 ' HD2' ' HB3' ' A' 1051 ' ' ARG . 67.7 Cg_endo -78.08 112.1 3.19 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 121.035 1.157 . . . . 0.0 112.745 176.414 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 1053 ' ' HIS . . . . . 0.716 ' HB2' ' HE2' ' A' 1045 ' ' LYS . 1.1 t-80 . . . . . 0 C--N 1.323 -0.544 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 172.57 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.748 0 N-CA-C 111.914 -0.475 . . . . 0.0 111.914 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 8.7 t -114.76 113.84 44.57 Favored Pre-proline 0 C--N 1.321 -0.653 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 178.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -77.73 17.3 0.98 Allowed 'Trans proline' 0 CA--C 1.528 0.222 0 C-N-CA 122.956 2.438 . . . . 0.0 112.742 -177.444 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . 96.81 -176.39 32.11 Favored Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.866 -0.683 . . . . 0.0 111.963 -179.023 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 22.4 pt -133.12 -175.0 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 179.649 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 23.1 t -123.93 116.46 22.93 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.051 0.453 . . . . 0.0 110.605 179.117 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . -135.59 155.69 22.36 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.989 179.305 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 155.95 149.51 5.36 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 121.04 -0.6 . . . . 0.0 112.102 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . 151.45 124.39 1.13 Allowed Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.073 -179.517 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . -151.61 159.2 28.14 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.458 178.333 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . 79.55 170.83 40.65 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 121.263 -0.494 . . . . 0.0 112.929 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 919' ' ' ILE . . . . . 0.66 ' HB ' ' HB3' ' A' 1040 ' ' ASP . 0.1 OUTLIER -80.32 143.75 11.87 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 174.189 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 920' ' ' ARG . . . . . . . . . . . . . 11.2 ttp180 179.86 -47.26 0.01 OUTLIER 'General case' 0 C--O 1.234 0.28 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -169.689 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 11.3 m -78.3 6.08 9.05 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 115.548 1.684 . . . . 0.0 115.548 -153.361 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -106.15 -74.98 0.64 Allowed 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 118.383 -1.327 . . . . 0.0 110.352 178.17 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.645 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 7.6 t70 75.45 -48.46 0.61 Allowed 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 168.348 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 924' ' ' LYS . . . . . . . . . . . . . 15.0 tptp -56.98 -31.3 64.91 Favored 'General case' 0 C--N 1.321 -0.646 0 O-C-N 121.583 -0.698 . . . . 0.0 111.779 -177.387 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.639 ' CG2' ' HB3' ' A' 1036 ' ' LEU . 1.5 p -61.11 -31.83 51.09 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 CA-C-O 121.295 0.569 . . . . 0.0 110.894 174.764 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.645 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -67.25 -36.64 82.04 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 123.591 0.756 . . . . 0.0 111.882 178.031 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -75.04 -23.41 58.13 Favored 'General case' 0 C--N 1.313 -1.001 0 C-N-CA 118.374 -1.33 . . . . 0.0 110.195 -179.36 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.44 ' O ' ' HB1' ' A' ' 961' ' ' ALA . 1.6 m120 -69.21 -31.11 69.48 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 173.916 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.586 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 46.6 t -81.13 -28.87 10.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 114.79 -1.095 . . . . 0.0 110.154 174.898 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 930' ' ' THR . . . . . . . . . . . . . 22.3 m -55.61 -43.12 75.79 Favored 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 165.547 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -71.03 -53.13 11.26 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-N 115.318 -0.855 . . . . 0.0 114.087 178.05 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.586 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.4 pp -62.22 -47.92 82.29 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 117.513 0.657 . . . . 0.0 112.694 -176.817 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 75.9 t -65.32 -36.12 76.95 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 CA-C-O 121.083 0.468 . . . . 0.0 110.862 -176.483 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.525 ' HD2' ' C ' ' A' ' 934' ' ' LYS . 0.1 OUTLIER -55.35 -45.39 76.46 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.822 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 935' ' ' ALA . . . . . 0.4 ' HB3' HG12 ' A' ' 958' ' ' VAL . . . -63.26 -34.15 77.06 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.625 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.769 HG22 ' HB1' ' A' 1025 ' ' ALA . 59.0 t -54.03 -76.03 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 CA-C-O 121.11 0.481 . . . . 0.0 112.166 -179.391 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 21.0 pt -68.7 -38.63 79.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -175.24 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.503 ' O ' ' HD3' ' A' ' 942' ' ' LYS . 34.9 tt0 -66.45 -52.22 48.61 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.613 0.72 . . . . 0.0 110.288 -175.174 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.49 ' HA ' ' HB2' ' A' ' 942' ' ' LYS . 23.2 mmt -69.66 -24.35 63.6 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 119.596 -0.842 . . . . 0.0 109.231 -179.048 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.523 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 5.7 p -53.47 -38.45 63.61 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-O 121.187 0.518 . . . . 0.0 110.022 -175.642 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 11.2 m -94.81 -10.5 31.25 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.701 -178.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.503 ' HD3' ' O ' ' A' ' 938' ' ' GLU . 13.7 mptt -80.71 -1.48 42.81 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 177.091 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 943' ' ' ILE . . . . . . . . . . . . . 37.9 pt -42.05 -33.33 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 165.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.565 ' H ' ' HD2' ' A' ' 945' ' ' PRO . 0.0 OUTLIER -101.88 -54.46 0.14 Allowed Pre-proline 0 CA--C 1.54 0.566 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -171.837 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.565 ' HD2' ' H ' ' A' ' 944' ' ' GLN . 29.2 Cg_endo -62.22 -11.31 21.61 Favored 'Trans proline' 0 C--N 1.36 1.172 0 C-N-CA 122.182 1.922 . . . . 0.0 113.488 -174.452 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 946' ' ' ALA . . . . . . . . . . . . . . . -136.98 152.91 74.87 Favored Pre-proline 0 C--N 1.321 -0.667 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 177.618 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 947' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -58.51 162.89 11.53 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.345 2.03 . . . . 0.0 110.839 173.522 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.753 ' HB3' HG11 ' A' 1009 ' ' VAL . 33.7 Cg_exo -26.69 116.88 0.03 OUTLIER 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 124.666 3.578 . . . . 0.0 113.334 -178.182 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.481 ' C ' ' H ' ' A' ' 951' ' ' TYR . 10.1 mt-10 -54.6 -22.07 12.29 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.672 175.151 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.615 ' HB3' ' HG2' ' A' ' 953' ' ' PRO . 23.2 tt0 69.96 -0.35 2.77 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.659 179.165 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.597 ' O ' HG23 ' A' ' 955' ' ' VAL . 27.4 m-85 47.65 -52.09 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 116.222 1.934 . . . . 0.0 116.222 176.063 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 0.601 ' O ' ' HB ' ' A' ' 955' ' ' VAL . 43.2 t -49.76 -45.56 79.68 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 118.667 0.667 . . . . 0.0 112.041 174.601 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 0.619 ' O ' ' HB3' ' A' ' 956' ' ' LYS . 36.3 Cg_exo -50.01 -44.55 36.91 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 122.089 1.859 . . . . 0.0 112.899 174.162 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.561 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 4.4 ptp -75.32 -29.75 60.12 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 178.158 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.601 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 99.2 t -54.67 -36.5 36.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.145 168.802 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.619 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 23.2 ttpt -59.07 -43.44 91.77 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.886 171.636 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 957' ' ' GLU . . . . . 0.52 ' HG2' ' HA ' ' A' ' 954' ' ' MET . 14.6 pt-20 -79.63 -43.41 22.9 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 119.75 -0.78 . . . . 0.0 112.087 -178.133 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.534 HG22 ' HA ' ' A' ' 955' ' ' VAL . 16.7 m -76.52 -33.04 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-O 120.689 0.281 . . . . 0.0 110.904 -179.042 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -68.88 -35.77 80.23 Favored Glycine 0 N--CA 1.436 -1.33 0 N-CA-C 110.474 -1.05 . . . . 0.0 110.474 175.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 960' ' ' LEU . . . . . 0.607 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 16.5 tp -65.73 -38.33 88.86 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 172.712 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.44 ' HB1' ' O ' ' A' ' 928' ' ' ASN . . . -68.45 -58.46 4.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.647 -0.251 . . . . 0.0 110.757 -177.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.576 HD22 HD22 ' A' ' 995' ' ' LEU . 0.1 OUTLIER -43.54 -49.91 7.32 Favored 'General case' 0 C--O 1.215 -0.748 0 CA-C-O 118.596 -0.716 . . . . 0.0 112.698 167.591 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.607 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 6.4 ptp180 -68.43 -29.0 67.56 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 120.303 1.41 . . . . 0.0 110.805 -179.163 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 964' ' ' THR . . . . . 0.408 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 43.7 m -68.24 -37.99 81.37 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 174.572 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.619 HD11 HD21 ' A' 1035 ' ' LEU . 0.0 OUTLIER -66.28 -40.01 89.79 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.17 174.423 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 0.422 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.4 tt -67.91 -41.45 82.64 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 114.727 -1.124 . . . . 0.0 108.307 -175.669 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 967' ' ' ALA . . . . . 0.579 ' O ' ' HB2' ' A' ' 971' ' ' GLU . . . -72.59 -38.77 67.75 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-N 114.966 -1.015 . . . . 0.0 112.021 -179.508 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 9.8 p -61.92 -40.98 97.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 118.657 0.662 . . . . 0.0 110.3 177.161 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.985 HG12 HG23 ' A' ' 984' ' ' ILE . 67.7 t -73.94 -38.54 49.99 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.712 174.493 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.53 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 12.1 t70 -67.75 -44.38 77.66 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.805 0.812 . . . . 0.0 109.585 -177.741 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.592 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 0.6 OUTLIER -63.83 -32.5 74.04 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 114.667 -1.152 . . . . 0.0 109.26 177.536 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.631 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 39.8 m -65.3 -18.02 64.98 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.53 175.397 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.753 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 9.7 tt -69.62 -52.65 13.77 Favored Pre-proline 0 CA--C 1.532 0.262 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.087 -179.171 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.753 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 3.0 Cg_exo -80.36 -2.12 11.77 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.627 1.551 . . . . 0.0 113.116 172.54 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.631 ' HB ' ' HA ' ' A' ' 972' ' ' SER . 15.0 t -83.38 -50.66 15.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 110.094 -0.336 . . . . 0.0 110.094 173.585 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 976' ' ' LEU . . . . . . . . . . . . . 97.4 mt -76.41 153.53 83.9 Favored Pre-proline 0 C--N 1.325 -0.476 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 176.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -36.05 -64.67 0.16 Allowed 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 123.962 3.108 . . . . 0.0 114.199 -174.664 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . 176.06 -29.84 0.0 OUTLIER 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 121.342 0.591 . . . . 0.0 110.115 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.419 ' HB2' ' HB3' ' A' 1046 ' ' MET . 0.8 OUTLIER -51.27 -50.07 59.97 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.955 -1.02 . . . . 0.0 113.351 -174.078 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.661 HG22 ' HG3' ' A' 1046 ' ' MET . 40.9 p -78.39 9.12 4.17 Favored 'General case' 0 C--N 1.33 -0.258 0 O-C-N 122.162 -0.336 . . . . 0.0 111.75 -171.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.714 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 1.8 p-80 -55.56 -34.34 64.65 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.345 -178.65 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 982' ' ' ARG . . . . . 0.457 HH11 ' HD3' ' A' ' 982' ' ' ARG . 9.5 ptp180 -84.48 -19.21 33.71 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.477 -178.479 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.733 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 0.5 OUTLIER -73.98 -38.85 64.04 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 172.586 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.985 HG23 HG12 ' A' ' 969' ' ' VAL . 65.6 mt -72.01 -29.51 33.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 114.225 -1.352 . . . . 0.0 109.206 179.387 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 985' ' ' GLU . . . . . 0.714 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 26.6 mt-10 -65.0 -51.63 60.63 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.402 0.62 . . . . 0.0 110.444 174.162 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 25.5 ttt -70.23 -43.28 70.95 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.311 -170.749 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.982 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -74.54 -50.85 16.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.066 -0.97 . . . . 0.0 112.827 -171.236 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.599 ' O ' ' HB2' ' A' ' 992' ' ' ASN . 24.5 pt20 -65.29 -23.04 66.93 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 119.817 -0.753 . . . . 0.0 109.94 179.432 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 989' ' ' LYS . . . . . 0.772 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 6.8 tttp -74.31 -40.67 62.07 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.327 171.816 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.422 ' HB3' ' O ' ' A' ' 987' ' ' ALA . 27.5 tp -52.19 -59.79 3.97 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.208 178.675 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.648 ' HB2' ' CD2' ' A' 1035 ' ' LEU . 0.3 OUTLIER -66.04 -28.91 69.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.519 0.676 . . . . 0.0 109.789 179.059 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 992' ' ' ASN . . . . . 0.772 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 23.7 t-20 -52.05 -56.39 14.65 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.436 -1.257 . . . . 0.0 111.485 179.752 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 34.1 t -77.84 -33.99 52.07 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 111.776 0.288 . . . . 0.0 111.776 -178.42 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 994' ' ' ASP . . . . . 0.433 ' O ' ' HB3' ' A' ' 997' ' ' GLU . 0.6 OUTLIER -66.99 -36.34 81.95 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 120.176 -0.61 . . . . 0.0 112.354 -179.823 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 0.627 HD12 HD13 ' A' 1028 ' ' LEU . 8.4 tt -73.7 -17.45 61.13 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 173.041 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -75.29 -26.46 58.76 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 119.77 -0.772 . . . . 0.0 109.77 167.84 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.433 ' HB3' ' O ' ' A' ' 994' ' ' ASP . 3.8 tp10 -74.51 -40.63 61.67 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 173.14 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.95 HD13 ' HB2' ' A' 1025 ' ' ALA . 2.2 tp -55.91 -46.98 78.25 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.039 0.447 . . . . 0.0 110.747 178.058 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.78 ' HA ' ' SD ' ' A' 1002 ' ' MET . 80.1 mt -68.57 -38.5 79.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.881 -171.093 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -60.59 -46.86 88.65 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.442 0.639 . . . . 0.0 111.254 -177.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.531 ' O ' ' HB3' ' A' 1017 ' ' TYR . 89.7 mttt -84.62 -31.8 24.06 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.962 -173.165 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.78 ' SD ' ' HA ' ' A' ' 999' ' ' ILE . 13.1 ptm -64.29 -27.81 69.29 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 122.099 0.952 . . . . 0.0 108.512 173.47 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.616 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 9.4 tptp -67.26 -54.01 24.73 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 114.145 -1.389 . . . . 0.0 110.352 -171.255 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.578 ' HA ' ' HG3' ' A' 1007 ' ' GLN . 9.1 mp -71.14 -13.8 62.07 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.388 -178.68 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.655 ' HB1' ' NE2' ' A' 1014 ' ' GLN . . . -69.26 -55.15 11.37 Favored 'General case' 0 C--O 1.217 -0.638 0 C-N-CA 119.888 -0.725 . . . . 0.0 110.289 179.554 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.968 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -63.88 -24.91 67.93 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 118.871 -0.585 . . . . 0.0 112.467 171.787 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.578 ' HG3' ' HA ' ' A' 1004 ' ' LEU . 58.0 mt-30 -51.98 -50.22 61.73 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.625 0.726 . . . . 0.0 110.07 175.528 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.738 ' HB2' ' HG ' ' A' 1013 ' ' LEU . 76.5 m-85 -124.99 49.74 1.83 Allowed 'General case' 0 N--CA 1.442 -0.835 0 CA-C-O 121.588 0.709 . . . . 0.0 109.617 172.361 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1009 ' ' VAL . . . . . 1.052 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 9.3 p -55.41 -19.27 5.29 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.282 0 CA-C-N 114.157 -1.383 . . . . 0.0 109.678 170.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 65.0 mtt -40.01 -51.31 2.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.55 -1.204 . . . . 0.0 110.655 171.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 41.6 m -162.54 -75.66 0.05 OUTLIER 'General case' 0 C--O 1.239 0.52 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 175.815 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 13.1 p -55.93 -79.9 0.02 OUTLIER 'General case' 0 C--O 1.248 0.986 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -163.622 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.738 ' HG ' ' HB2' ' A' 1008 ' ' TYR . 13.0 mt -48.19 -42.62 30.39 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.453 -175.82 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1014 ' ' GLN . . . . . 1.052 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.1 OUTLIER -52.66 -59.15 4.82 Favored 'General case' 0 N--CA 1.437 -1.113 0 O-C-N 123.989 0.806 . . . . 0.0 110.477 -165.73 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A 1015 ' ' GLN . . . . . 0.514 ' O ' ' HD3' ' A' 1019 ' ' LYS . 77.5 mt-30 -65.92 -38.21 88.07 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.651 -169.201 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -70.03 -44.94 68.22 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.468 0.652 . . . . 0.0 110.574 178.164 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.628 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 13.4 m-85 -71.94 -30.76 65.65 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.758 -176.808 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.596 ' HD3' ' CZ ' ' A' ' 951' ' ' TYR . 23.4 tptm -78.86 -33.99 45.4 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 114.172 -1.376 . . . . 0.0 109.951 -176.001 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1019 ' ' LYS . . . . . 0.514 ' HD3' ' O ' ' A' 1015 ' ' GLN . 4.6 mptp? -71.1 -44.65 65.21 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 175.924 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -57.8 -33.01 68.12 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.72 165.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.548 ' HB3' ' HA ' ' A' 1018 ' ' LYS . 1.9 tmt? -65.85 -51.5 58.31 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 110.294 -0.262 . . . . 0.0 110.294 179.21 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1022 ' ' LEU . . . . . 0.542 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -81.15 -9.69 59.76 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 119.423 -0.911 . . . . 0.0 109.869 -175.713 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 72.7 m -81.97 -41.11 21.22 Favored 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 173.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.503 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -78.51 -22.13 47.84 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-O 121.139 0.495 . . . . 0.0 109.843 174.733 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.95 ' HB2' HD13 ' A' ' 998' ' ' LEU . . . -85.57 -23.57 27.57 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.216 170.441 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.51 ' O ' HG23 ' A' 1030 ' ' VAL . 22.2 t-80 -76.04 -25.92 56.09 Favored 'General case' 0 C--O 1.214 -0.779 0 C-N-CA 120.164 -0.614 . . . . 0.0 109.422 164.154 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1027 ' ' ALA . . . . . 0.503 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -66.5 -40.15 89.07 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 162.552 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.627 HD13 HD12 ' A' ' 995' ' ' LEU . 16.6 mt -60.17 -49.16 78.73 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 170.629 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -57.11 -41.02 78.18 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 175.29 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.51 HG23 ' O ' ' A' 1026 ' ' HIS . 10.6 t -71.88 -51.55 30.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.44 0.638 . . . . 0.0 110.794 -176.17 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1031 ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -77.11 -30.12 55.11 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.907 -174.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.516 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -70.7 -32.83 70.2 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 172.342 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 52.5 tttm -62.81 -45.69 91.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.768 0.794 . . . . 0.0 109.37 169.062 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.506 ' O ' ' HB3' ' A' 1037 ' ' ASP . 53.7 t30 -68.14 -50.32 55.35 Favored 'General case' 0 C--O 1.218 -0.595 0 CA-C-N 114.369 -1.287 . . . . 0.0 111.738 -176.408 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.982 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 1.9 pp -62.52 -40.84 98.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 119.084 -0.484 . . . . 0.0 111.047 -171.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.639 ' HB3' ' CG2' ' A' ' 925' ' ' VAL . 3.9 pp -66.26 -42.34 88.63 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 117.66 -1.616 . . . . 0.0 109.587 177.656 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.506 ' HB3' ' O ' ' A' 1034 ' ' ASN . 23.6 t70 -54.47 -38.36 66.29 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-N 113.982 -1.463 . . . . 0.0 110.128 175.663 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' 1034 ' ' ASN . 27.3 t -63.93 -36.5 76.95 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.614 0 CA-C-N 114.453 -1.249 . . . . 0.0 112.366 177.078 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.611 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 1.7 mp -86.56 -32.37 6.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 119.04 0.836 . . . . 0.0 111.094 177.452 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.66 ' HB3' ' HB ' ' A' ' 919' ' ' ILE . 4.0 m-20 -62.9 -41.27 99.38 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 169.599 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -68.2 -39.25 82.5 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.056 170.204 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.733 ' HB2' ' HG2' ' A' ' 983' ' ' GLU . . . -55.41 -48.75 73.91 Favored 'General case' 0 CA--C 1.49 -1.339 0 C-N-CA 123.066 0.546 . . . . 0.0 110.782 -176.742 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.639 ' HD3' ' N ' ' A' 1044 ' ' LEU . 0.0 OUTLIER -65.01 -34.97 79.7 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.402 -174.08 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.639 ' N ' ' HD3' ' A' 1043 ' ' ARG . 3.1 tm? -78.04 -47.09 19.16 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 121.567 0.698 . . . . 0.0 110.123 179.7 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.53 ' O ' ' HB3' ' A' 1049 ' ' GLN . 31.1 ttpt -56.96 -46.48 82.11 Favored 'General case' 0 C--O 1.214 -0.79 0 C-N-CA 124.752 1.221 . . . . 0.0 111.09 178.764 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.661 ' HG3' HG22 ' A' ' 980' ' ' THR . 5.1 mmt -71.77 -24.17 61.71 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.151 -0.968 . . . . 0.0 111.407 -178.417 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.605 HG12 ' O ' ' A' 1043 ' ' ARG . 23.1 mm -67.35 -62.33 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.56 170.21 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 31.7 t -128.39 48.85 2.25 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 119.397 -0.921 . . . . 0.0 112.293 -175.559 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1049 ' ' GLN . . . . . 0.53 ' HB3' ' O ' ' A' 1045 ' ' LYS . 6.3 tp-100 -130.17 -71.58 0.59 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.331 -0.85 . . . . 0.0 108.75 166.012 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 78.8 p 53.8 12.29 0.4 Allowed 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 175.643 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1051 ' ' ARG . . . . . 0.64 ' HB3' ' HD3' ' A' 1052 ' ' PRO . 1.8 tmt_? -90.96 -61.62 0.21 Allowed Pre-proline 0 C--N 1.327 -0.392 0 O-C-N 122.222 -0.299 . . . . 0.0 110.99 -176.091 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 1052 ' ' PRO . . . . . 0.64 ' HD3' ' HB3' ' A' 1051 ' ' ARG . 1.0 OUTLIER -83.29 23.95 0.78 Allowed 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 122.371 2.047 . . . . 0.0 112.982 -174.18 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A 1053 ' ' HIS . . . . . 0.53 ' HB2' ' HE1' ' A' 1046 ' ' MET . 13.6 m-70 . . . . . 0 C--N 1.32 -0.711 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.566 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.907 0 N-CA-C 112.09 -0.404 . . . . 0.0 112.09 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 16.4 p 50.56 92.08 0.06 OUTLIER Pre-proline 0 N--CA 1.47 0.573 0 C-N-CA 123.672 0.789 . . . . 0.0 112.692 178.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -75.22 48.71 2.12 Favored 'Trans proline' 0 CA--C 1.531 0.371 0 C-N-CA 123.502 2.802 . . . . 0.0 112.739 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -109.71 35.19 5.03 Favored Glycine 0 N--CA 1.448 -0.548 0 N-CA-C 111.562 -0.615 . . . . 0.0 111.562 178.752 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 56.9 mt -86.53 94.42 4.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.15 0.5 . . . . 0.0 110.685 -177.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 36.8 t -118.03 -71.24 0.75 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.602 -0.727 . . . . 0.0 109.079 175.426 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . -95.16 -40.31 4.31 Favored Glycine 0 N--CA 1.442 -0.943 0 N-CA-C 110.19 -1.164 . . . . 0.0 110.19 171.431 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 133.32 -119.46 2.35 Favored Glycine 0 N--CA 1.446 -0.666 0 N-CA-C 111.666 -0.574 . . . . 0.0 111.666 177.477 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . -141.11 84.63 0.21 Allowed Glycine 0 N--CA 1.446 -0.675 0 N-CA-C 111.266 -0.733 . . . . 0.0 111.266 177.247 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . -161.25 109.94 0.42 Allowed Glycine 0 N--CA 1.445 -0.732 0 C-N-CA 120.51 -0.853 . . . . 0.0 112.799 -177.74 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . 119.62 119.87 2.82 Favored Glycine 0 CA--C 1.517 0.211 0 C-N-CA 120.593 -0.813 . . . . 0.0 113.438 172.245 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 919' ' ' ILE . . . . . 0.716 HG22 ' HA ' ' A' 1041 ' ' GLN . 6.6 pt -68.07 142.13 16.78 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.955 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 175.691 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.566 ' HG3' ' NH1' ' A' 1043 ' ' ARG . 5.5 ptm180 -164.27 124.18 2.03 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.027 0.442 . . . . 0.0 111.956 -177.714 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 921' ' ' SER . . . . . 0.409 ' HB3' ' OH ' ' A' ' 926' ' ' TYR . 9.9 t -116.35 -169.2 1.57 Allowed 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 171.466 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 922' ' ' ASN . . . . . 0.565 ' OD1' ' HE3' ' A' ' 924' ' ' LYS . 15.0 t-20 -77.58 -126.29 0.01 OUTLIER 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 176.245 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.841 ' HA ' ' CD1' ' A' ' 926' ' ' TYR . 4.1 p30 -149.06 2.98 0.59 Allowed 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 120.884 0.374 . . . . 0.0 111.251 174.069 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.565 ' HE3' ' OD1' ' A' ' 922' ' ' ASN . 16.4 mmtp -76.3 -44.68 35.88 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -174.95 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.627 HG23 HD22 ' A' 1036 ' ' LEU . 20.7 m -57.87 -29.12 34.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.709 0.766 . . . . 0.0 110.352 -179.73 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.841 ' CD1' ' HA ' ' A' ' 923' ' ' ASP . 14.3 m-85 -72.94 -39.78 65.93 Favored 'General case' 0 CA--C 1.483 -1.603 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.582 175.503 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 927' ' ' GLU . . . . . 0.506 ' HA ' ' OG1' ' A' ' 930' ' ' THR . 9.3 pt-20 -74.38 -22.29 59.26 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 117.749 -1.58 . . . . 0.0 109.982 -176.406 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -75.05 -32.04 61.43 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.038 -0.726 . . . . 0.0 109.038 172.095 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.672 HG22 ' HB1' ' A' 1032 ' ' ALA . 85.4 t -81.13 -29.79 11.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.244 175.536 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.506 ' OG1' ' HA ' ' A' ' 927' ' ' GLU . 66.5 p -68.82 -29.28 67.58 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 169.351 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -70.19 -53.26 14.6 Favored Glycine 0 CA--C 1.529 0.958 0 CA-C-N 115.113 -0.949 . . . . 0.0 113.14 172.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.661 HD21 HG22 ' A' ' 929' ' ' VAL . 2.6 pp -65.28 -49.32 70.0 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -178.453 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.426 HG22 ' HA ' ' A' 1029 ' ' ALA . 88.6 t -64.27 -41.18 91.58 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-O 121.069 0.461 . . . . 0.0 110.238 -176.906 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 934' ' ' LYS . . . . . . . . . . . . . 1.4 ttpt -54.73 -39.92 68.74 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.133 -0.939 . . . . 0.0 109.958 177.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -66.72 -39.95 88.21 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.613 0.227 . . . . 0.0 111.613 -178.541 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.751 HG22 ' HB1' ' A' 1025 ' ' ALA . 59.7 t -47.46 -68.32 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 O-C-N 123.81 0.694 . . . . 0.0 111.3 179.506 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 26.5 pt -65.45 -37.29 79.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.905 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -58.89 -56.55 20.81 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.57 0.7 . . . . 0.0 110.747 -172.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.558 ' HB3' ' OE2' ' A' ' 949' ' ' GLU . 13.3 mmt -76.52 -25.82 54.56 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.52 -0.763 . . . . 0.0 110.394 -177.076 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.546 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 76.9 p -52.98 -41.55 64.69 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.447 0.642 . . . . 0.0 110.995 -169.842 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 8.7 p -104.44 -19.22 14.11 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 114.907 -1.042 . . . . 0.0 112.203 -177.46 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 942' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -82.73 -3.78 56.97 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 119.949 -0.7 . . . . 0.0 110.214 -177.59 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.572 HD13 ' HG2' ' A' 1018 ' ' LYS . 47.3 pt -50.69 -47.01 28.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.921 162.274 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.555 ' N ' HG13 ' A' ' 943' ' ' ILE . 27.4 pt20 50.51 170.66 0.03 OUTLIER Pre-proline 0 N--CA 1.475 0.778 0 C-N-CA 125.095 1.358 . . . . 0.0 113.232 177.19 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 945' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -67.84 86.82 0.37 Allowed 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 121.953 1.768 . . . . 0.0 110.747 168.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.612 ' HB1' ' HD2' ' A' ' 947' ' ' PRO . . . -162.03 179.1 1.36 Allowed Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.652 -175.258 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.612 ' HD2' ' HB1' ' A' ' 946' ' ' ALA . 54.3 Cg_exo -54.04 149.7 34.17 Favored 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 122.283 1.989 . . . . 0.0 111.883 172.616 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.598 ' HB3' HG11 ' A' 1009 ' ' VAL . 3.0 Cg_endo -47.52 135.79 20.86 Favored 'Trans proline' 0 CA--C 1.517 -0.364 0 C-N-CA 123.513 2.808 . . . . 0.0 113.948 -176.015 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.571 ' HB3' ' CD1' ' A' ' 951' ' ' TYR . 13.5 tt0 -58.72 -23.31 59.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.072 -0.967 . . . . 0.0 108.477 167.164 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.587 ' HB2' ' HG2' ' A' ' 953' ' ' PRO . 46.1 mt-10 74.59 -7.92 1.61 Allowed 'General case' 0 C--N 1.344 0.366 0 CA-C-N 114.368 -1.287 . . . . 0.0 109.592 -171.957 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.992 ' HB3' ' HG3' ' A' 1002 ' ' MET . 22.9 m-85 50.17 -53.4 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.063 1.745 . . . . 0.0 115.509 176.544 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 0.653 ' O ' ' HB ' ' A' ' 955' ' ' VAL . 61.4 t -43.87 -46.12 19.63 Favored Pre-proline 0 C--N 1.32 -0.709 0 C-N-CA 122.868 0.467 . . . . 0.0 111.65 172.297 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 0.635 ' HA ' ' HD3' ' A' ' 956' ' ' LYS . 14.1 Cg_exo -45.5 -51.07 8.47 Favored 'Trans proline' 0 CA--C 1.544 0.987 0 C-N-CA 122.434 2.089 . . . . 0.0 113.59 173.591 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.431 ' HE3' ' HB2' ' A' ' 939' ' ' MET . 6.8 ptm -69.56 -30.96 68.87 Favored 'General case' 0 N--CA 1.463 0.199 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 177.615 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.653 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 73.5 t -54.13 -36.68 32.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.778 171.723 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.635 ' HD3' ' HA ' ' A' ' 953' ' ' PRO . 2.4 mptp? -59.22 -41.63 89.09 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 119.097 -0.477 . . . . 0.0 111.371 171.179 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -77.54 -39.6 45.41 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 118.929 -1.108 . . . . 0.0 111.378 -177.548 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.649 HG22 ' HA ' ' A' ' 955' ' ' VAL . 24.3 m -73.97 -35.33 41.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 O-C-N 122.208 -0.308 . . . . 0.0 111.2 179.716 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -66.07 -34.96 89.87 Favored Glycine 0 N--CA 1.44 -1.082 0 N-CA-C 110.672 -0.971 . . . . 0.0 110.672 177.318 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 960' ' ' LEU . . . . . 0.545 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 9.4 tt -71.29 -33.11 69.43 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.127 -0.537 . . . . 0.0 109.803 176.007 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 961' ' ' ALA . . . . . 0.415 ' HB1' ' HB3' ' A' ' 932' ' ' LEU . . . -73.83 -37.8 64.74 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.513 -176.519 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.874 HD13 HD22 ' A' ' 991' ' ' LEU . 0.2 OUTLIER -66.5 -49.38 66.76 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-O 119.303 -0.38 . . . . 0.0 110.638 171.792 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.545 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 12.7 ptm180 -64.24 -30.29 71.35 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 118.856 0.753 . . . . 0.0 111.042 -177.416 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 964' ' ' THR . . . . . 0.402 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 38.7 m -69.14 -33.89 74.15 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 176.641 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.466 ' CD1' ' HB ' ' A' ' 925' ' ' VAL . 31.9 tp -71.34 -39.87 71.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 122.053 0.93 . . . . 0.0 109.669 175.176 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 10.4 tt -63.18 -43.94 96.82 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 114.505 -1.225 . . . . 0.0 108.812 -177.251 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -70.19 -38.61 75.38 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 114.787 -1.097 . . . . 0.0 111.977 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 3.2 p -65.46 -44.17 88.03 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.544 177.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.869 HG12 HG23 ' A' ' 984' ' ' ILE . 61.2 t -68.35 -36.41 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.246 175.134 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 970' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -69.38 -41.96 75.8 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 122.24 1.019 . . . . 0.0 109.031 -179.547 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.619 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 39.1 tt0 -73.24 -22.31 60.44 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 114.482 -1.236 . . . . 0.0 109.476 -179.324 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.699 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 58.7 m -72.9 -15.97 61.57 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.925 172.324 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.764 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 8.1 tt -64.08 -50.65 67.8 Favored Pre-proline 0 C--N 1.329 -0.302 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 175.717 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.764 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 13.2 Cg_exo -72.34 -11.85 27.01 Favored 'Trans proline' 0 C--N 1.355 0.916 0 C-N-CA 121.705 1.603 . . . . 0.0 113.396 169.766 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.699 ' HB ' ' HA ' ' A' ' 972' ' ' SER . 45.9 t -76.35 -52.1 18.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 O-C-N 122.034 -0.416 . . . . 0.0 110.269 174.112 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.823 HD13 ' HB3' ' A' 1043 ' ' ARG . 83.0 mt -97.7 107.18 38.28 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.814 178.396 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -70.82 -178.92 3.0 Favored 'Trans proline' 0 N--CA 1.463 -0.292 0 C-N-CA 122.533 2.155 . . . . 0.0 112.653 -175.616 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . 65.87 -149.83 0.23 Allowed 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.882 176.613 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.412 ' HA ' ' CD2' ' A' ' 981' ' ' HIS . 17.8 m -83.42 32.46 0.46 Allowed 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 -169.655 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.488 ' OG1' ' HG2' ' A' 1046 ' ' MET . 88.4 m -80.4 -20.06 44.85 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.104 0.478 . . . . 0.0 110.369 172.332 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.47 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 14.1 p80 -50.36 -57.37 8.09 Favored 'General case' 0 C--O 1.219 -0.517 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 -176.118 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 5.5 ptp180 -56.23 -22.65 30.9 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 113.974 1.101 . . . . 0.0 113.974 -176.587 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.54 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 2.6 mp0 -77.08 -38.21 52.92 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 119.11 0.868 . . . . 0.0 109.97 174.796 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.869 HG23 HG12 ' A' ' 969' ' ' VAL . 32.7 mt -71.11 -30.68 41.91 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.935 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.096 177.408 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 985' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 42.7 mt-10 -66.88 -51.77 51.45 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.437 177.511 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 986' ' ' MET . . . . . 0.414 ' O ' ' HB3' ' A' ' 989' ' ' LYS . 68.5 mtt -70.79 -42.08 70.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 114.64 -1.163 . . . . 0.0 111.468 -175.387 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 1.053 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -69.4 -51.64 34.61 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.457 -0.792 . . . . 0.0 112.225 -170.957 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.51 ' O ' ' HB2' ' A' ' 992' ' ' ASN . 23.0 pt20 -62.87 -21.82 66.26 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.375 177.661 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 989' ' ' LYS . . . . . 0.765 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 12.0 ttmt -70.29 -42.36 72.14 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.565 171.34 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 2.6 mp -55.35 -53.9 50.42 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.874 HD22 HD13 ' A' ' 962' ' ' LEU . 2.3 tt -67.88 -25.7 65.65 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 178.5 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 992' ' ' ASN . . . . . 0.765 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 25.3 t-20 -53.17 -56.74 14.0 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.29 178.532 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 3.8 p -79.14 -34.07 43.61 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -177.713 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.07 -41.99 97.13 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.335 -0.546 . . . . 0.0 111.407 178.301 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 0.63 ' N ' HD21 ' A' 1028 ' ' LEU . 2.3 tm? -64.03 -23.88 67.5 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 122.576 0.35 . . . . 0.0 110.184 173.16 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -70.91 -32.74 69.77 Favored 'General case' 0 C--N 1.313 -0.994 0 C-N-CA 119.274 -0.971 . . . . 0.0 110.835 169.722 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.518 ' O ' ' HG2' ' A' 1001 ' ' LYS . 74.1 mm-40 -76.29 -38.09 56.59 Favored 'General case' 0 CA--C 1.512 -0.505 0 O-C-N 121.858 -0.526 . . . . 0.0 110.1 177.279 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.636 HD21 ' SD ' ' A' 1021 ' ' MET . 1.1 tm? -56.24 -47.13 79.09 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.339 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.613 ' O ' ' HB2' ' A' 1003 ' ' LYS . 72.7 mt -65.71 -31.82 55.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.728 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -62.67 -38.82 91.85 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.872 0.368 . . . . 0.0 111.676 176.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.518 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 54.8 mmtt -77.5 -43.02 33.51 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 122.529 1.157 . . . . 0.0 108.46 -177.519 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.992 ' HG3' ' HB3' ' A' ' 951' ' ' TYR . 12.0 tpp -57.8 -29.96 65.32 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 113.482 -1.69 . . . . 0.0 109.2 177.532 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.613 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 15.7 tptt -73.28 -55.11 6.86 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 114.162 -1.381 . . . . 0.0 111.037 -167.155 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.855 ' HB3' HD23 ' A' 1013 ' ' LEU . 3.9 mm? -71.4 -13.66 61.92 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.32 -178.535 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.744 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -69.86 -45.22 68.23 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 119.366 -0.933 . . . . 0.0 109.477 179.705 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.942 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 3.4 pp0? -75.75 -26.73 57.67 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 120.071 -0.652 . . . . 0.0 111.718 172.362 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.691 ' HG3' HD13 ' A' 1004 ' ' LEU . 14.5 mm100 -52.0 -54.61 27.79 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.152 0.501 . . . . 0.0 110.581 174.271 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.806 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 72.1 m-85 -114.98 41.15 2.46 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.229 -0.588 . . . . 0.0 109.96 173.573 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1009 ' ' VAL . . . . . 1.053 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 14.7 p -49.41 -22.16 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.603 172.389 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 20.6 mmt -30.96 -57.13 0.22 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.202 173.096 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 97.9 m -164.98 -72.32 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 O-C-N 123.122 0.263 . . . . 0.0 111.646 173.034 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 32.5 t -50.8 -74.92 0.03 OUTLIER 'General case' 0 C--O 1.24 0.595 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.8 -169.02 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.855 HD23 ' HB3' ' A' 1004 ' ' LEU . 7.6 mp -50.46 -39.08 46.89 Favored 'General case' 0 CA--C 1.504 -0.812 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -178.235 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1014 ' ' GLN . . . . . 1.053 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.2 OUTLIER -54.62 -49.25 70.94 Favored 'General case' 0 N--CA 1.442 -0.838 0 O-C-N 123.505 0.503 . . . . 0.0 111.465 -168.186 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A 1015 ' ' GLN . . . . . 0.429 ' O ' ' HD3' ' A' 1019 ' ' LYS . 12.1 pt20 -74.67 -38.8 62.33 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.607 -176.466 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 53.5 tt0 -66.75 -53.75 30.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.583 0.706 . . . . 0.0 110.592 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.744 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 5.9 m-85 -65.67 -34.32 77.94 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.73 -1.123 . . . . 0.0 113.651 -174.177 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.572 ' HG2' HD13 ' A' ' 943' ' ' ILE . 51.4 tptt -80.32 -29.19 38.06 Favored 'General case' 0 N--CA 1.461 0.102 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.199 -177.7 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1019 ' ' LYS . . . . . 0.429 ' HD3' ' O ' ' A' 1015 ' ' GLN . 3.4 mptp? -72.52 -50.73 23.77 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 173.821 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -54.4 -31.84 55.87 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.086 166.496 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.636 ' SD ' HD21 ' A' ' 998' ' ' LEU . 10.9 tmm? -65.51 -52.32 53.53 Favored 'General case' 0 C--O 1.217 -0.651 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 174.092 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1022 ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' 1022 ' ' LEU . 0.0 OUTLIER -74.08 -12.17 60.53 Favored 'General case' 0 C--O 1.218 -0.591 0 C-N-CA 119.258 -0.977 . . . . 0.0 109.806 -176.762 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 92.5 m -82.21 -41.86 19.74 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.205 175.711 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.548 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.12 -22.04 49.44 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-O 120.972 0.415 . . . . 0.0 109.937 174.134 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.751 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -84.7 -22.05 29.91 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.929 169.704 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.515 ' O ' HG23 ' A' 1030 ' ' VAL . 47.6 t60 -76.55 -25.62 54.26 Favored 'General case' 0 C--O 1.213 -0.854 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 164.587 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1027 ' ' ALA . . . . . 0.452 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -69.52 -41.4 76.07 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 122.746 0.419 . . . . 0.0 110.168 163.59 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.63 HD21 ' N ' ' A' ' 995' ' ' LEU . 21.0 mt -60.33 -46.56 89.46 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 170.921 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1029 ' ' ALA . . . . . 0.426 ' HA ' HG22 ' A' ' 933' ' ' VAL . . . -57.57 -43.04 84.22 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 123.192 0.308 . . . . 0.0 111.456 173.306 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.515 HG23 ' O ' ' A' 1026 ' ' HIS . 4.9 t -66.55 -50.74 64.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-O 120.916 0.389 . . . . 0.0 110.47 -176.663 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.69 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 14.0 m-20 -75.02 -29.1 60.72 Favored 'General case' 0 C--O 1.212 -0.871 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.212 -176.475 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.672 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -58.97 -45.82 89.58 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 168.438 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 56.1 tttm -65.29 -41.98 93.57 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.768 0.794 . . . . 0.0 109.877 175.448 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.69 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 38.9 t30 -70.5 -53.76 14.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.002 -1.454 . . . . 0.0 112.09 -172.823 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1035 ' ' LEU . . . . . 1.053 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 2.5 pp -62.79 -38.57 91.19 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 119.332 -0.366 . . . . 0.0 110.599 -174.878 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.627 HD22 HG23 ' A' ' 925' ' ' VAL . 4.3 pp -71.43 -36.4 71.27 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 116.933 -1.907 . . . . 0.0 109.734 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.61 ' N ' HD12 ' A' 1036 ' ' LEU . 11.5 t70 -57.92 -39.76 78.77 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.749 174.291 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.644 HG13 ' HE1' ' A' 1053 ' ' HIS . 13.1 t -55.86 -33.49 34.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 114.124 -1.398 . . . . 0.0 111.578 173.807 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.592 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 1.9 mp -86.44 -33.94 7.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 117.944 0.338 . . . . 0.0 111.486 175.19 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.687 ' HB3' HD12 ' A' ' 919' ' ' ILE . 1.0 OUTLIER -53.18 -49.45 66.64 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 166.424 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.716 ' HA ' HG22 ' A' ' 919' ' ' ILE . 36.2 mt-30 -69.2 -39.92 78.35 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.371 -0.832 . . . . 0.0 111.205 175.223 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.592 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -54.63 -49.28 70.89 Favored 'General case' 0 CA--C 1.497 -1.081 0 C-N-CA 122.932 0.493 . . . . 0.0 111.782 -175.637 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.823 ' HB3' HD13 ' A' ' 976' ' ' LEU . 0.0 OUTLIER -63.68 -38.52 91.42 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.818 -178.319 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.548 ' N ' ' HD3' ' A' 1043 ' ' ARG . 56.4 tp -70.05 -38.82 75.91 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 121.768 0.794 . . . . 0.0 109.566 178.56 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.699 ' HD2' ' HA ' ' A' 1052 ' ' PRO . 10.4 tttp -59.01 -62.48 1.85 Allowed 'General case' 0 N--CA 1.437 -1.105 0 CA-C-N 114.341 -1.3 . . . . 0.0 110.563 -178.603 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.488 ' HG2' ' OG1' ' A' ' 980' ' ' THR . 0.0 OUTLIER -67.48 -22.99 65.44 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.134 -169.318 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.461 HG12 ' O ' ' A' 1043 ' ' ARG . 17.9 mm -65.05 -54.06 33.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.51 172.658 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 6.2 t -138.91 52.41 1.78 Allowed 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 119.747 -0.781 . . . . 0.0 111.682 -175.238 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1049 ' ' GLN . . . . . 0.539 ' HB2' ' O ' ' A' 1045 ' ' LYS . 73.5 mt-30 -143.08 143.23 31.77 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.916 172.697 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 26.7 t -98.46 1.89 47.18 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 174.331 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1051 ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' 1051 ' ' ARG . 12.3 mmt85 -131.51 152.93 81.32 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.236 -178.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1052 ' ' PRO . . . . . 0.699 ' HA ' ' HD2' ' A' 1045 ' ' LYS . 3.0 Cg_exo -73.93 131.91 16.25 Favored 'Trans proline' 0 N--CA 1.455 -0.791 0 C-N-CA 122.447 2.098 . . . . 0.0 110.702 168.85 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 1053 ' ' HIS . . . . . 0.644 ' HE1' HG13 ' A' 1038 ' ' VAL . 4.3 p80 . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 114.59 -1.186 . . . . 0.0 111.692 -176.335 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.719 0 N-CA-C 112.171 -0.372 . . . . 0.0 112.171 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 909' ' ' SER . . . . . 0.769 ' HB2' ' HD3' ' A' ' 910' ' ' PRO . 45.4 m -85.8 -61.69 0.26 Allowed Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 122.752 -0.264 . . . . 0.0 111.599 179.681 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 910' ' ' PRO . . . . . 0.769 ' HD3' ' HB2' ' A' ' 909' ' ' SER . 21.0 Cg_exo -65.48 -48.5 3.2 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 122.312 2.008 . . . . 0.0 113.177 -173.381 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -72.43 -30.86 63.98 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.722 -0.752 . . . . 0.0 113.125 -173.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 912' ' ' ILE . . . . . 0.406 HG22 ' O ' ' A' ' 912' ' ' ILE . 11.1 mt -105.22 11.7 8.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 121.233 0.539 . . . . 0.0 110.688 -175.799 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 913' ' ' SER . . . . . 0.526 ' HB2' ' O ' ' A' ' 909' ' ' SER . 13.2 t -72.84 -35.63 67.3 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.939 0.399 . . . . 0.0 110.124 178.814 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 175.16 171.41 39.17 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 120.983 -0.627 . . . . 0.0 111.702 179.251 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 915' ' ' GLY . . . . . 0.438 ' HA2' ' HD3' ' A' ' 920' ' ' ARG . . . 84.33 -69.94 3.24 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 121.032 -0.604 . . . . 0.0 112.027 177.405 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . 58.31 -108.57 1.53 Allowed Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.023 -177.518 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 917' ' ' GLY . . . . . 0.633 ' HA3' HG13 ' A' 1047 ' ' ILE . . . -109.41 80.34 0.27 Allowed Glycine 0 N--CA 1.444 -0.833 0 N-CA-C 111.437 -0.665 . . . . 0.0 111.437 177.089 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 918' ' ' GLY . . . . . 0.647 ' HA2' HD13 ' A' 1044 ' ' LEU . . . -172.89 164.27 36.29 Favored Glycine 0 N--CA 1.446 -0.658 0 N-CA-C 111.717 -0.553 . . . . 0.0 111.717 -177.93 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 919' ' ' ILE . . . . . 0.693 HG23 ' CG ' ' A' 1040 ' ' ASP . 73.7 mt -69.93 80.97 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-O 121.824 0.821 . . . . 0.0 109.678 177.066 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 920' ' ' ARG . . . . . 0.438 ' HD3' ' HA2' ' A' ' 915' ' ' GLY . 68.3 ttt180 -158.46 86.74 0.87 Allowed 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.85 -1.068 . . . . 0.0 108.404 178.384 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 26.0 m -141.8 86.04 1.97 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.506 -177.085 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -111.98 43.14 1.62 Allowed 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 106.649 -1.611 . . . . 0.0 106.649 169.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.566 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 12.8 m-20 -84.06 -162.28 0.63 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 113.782 -1.554 . . . . 0.0 111.11 -175.794 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.766 ' HB3' HG21 ' A' ' 968' ' ' THR . 16.8 tppt? -54.98 -26.1 34.42 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -175.615 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.525 ' O ' HG23 ' A' ' 929' ' ' VAL . 29.0 m -61.7 -29.8 46.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-O 121.079 0.466 . . . . 0.0 110.304 177.291 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.566 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -78.2 -26.28 47.46 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 176.356 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -76.02 -25.7 55.95 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.035 174.474 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.571 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 5.1 m120 -77.29 -29.84 53.94 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 121.663 0.744 . . . . 0.0 109.032 173.712 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.593 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 81.8 t -76.68 -29.48 18.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.329 174.642 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 930' ' ' THR . . . . . 0.439 ' O ' ' HB3' ' A' ' 934' ' ' LYS . 36.1 m -60.49 -39.98 89.64 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 170.217 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -72.32 -53.25 9.11 Favored Glycine 0 CA--C 1.524 0.629 0 CA-C-N 115.103 -0.953 . . . . 0.0 113.708 178.547 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.593 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.8 pp -65.05 -47.61 76.76 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -175.667 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 933' ' ' VAL . . . . . 0.433 HG23 HG13 ' A' ' 929' ' ' VAL . 73.6 t -63.25 -42.9 98.12 Favored 'Isoleucine or valine' 0 C--O 1.24 0.582 0 CA-C-O 121.407 0.622 . . . . 0.0 110.52 -177.797 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.759 ' O ' ' HB2' ' A' ' 938' ' ' GLU . 16.0 ttpt -60.51 -40.22 90.62 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.655 178.449 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -58.59 -46.59 86.63 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.499 -0.48 . . . . 0.0 111.083 175.174 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.818 HG22 ' HB1' ' A' 1025 ' ' ALA . 57.8 t -45.05 -83.65 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 123.274 0.63 . . . . 0.0 112.386 -179.075 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 19.4 pt -64.6 -43.41 96.73 Favored 'Isoleucine or valine' 0 C--O 1.248 0.997 0 N-CA-C 112.316 0.488 . . . . 0.0 112.316 -173.41 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.759 ' HB2' ' O ' ' A' ' 934' ' ' LYS . 6.2 mm-40 -67.84 -51.29 50.17 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.855 -169.576 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.531 ' O ' HG22 ' A' ' 943' ' ' ILE . 30.8 ttm -72.78 -27.81 62.22 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 120.093 -0.643 . . . . 0.0 109.686 -175.71 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 940' ' ' SER . . . . . . . . . . . . . 2.8 m -51.34 -53.41 36.43 Favored 'General case' 0 C--N 1.346 0.441 0 O-C-N 123.97 0.793 . . . . 0.0 112.501 -174.057 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 14.6 t -104.31 -23.53 13.21 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.705 -175.83 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.722 ' HB3' ' O ' ' A' ' 938' ' ' GLU . 0.3 OUTLIER -85.05 -56.96 3.29 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.118 -0.633 . . . . 0.0 112.285 -164.935 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.584 HG23 ' HG3' ' A' ' 944' ' ' GLN . 11.5 tt -60.88 -11.26 3.89 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -177.218 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.632 ' HG2' ' HB2' ' A' ' 949' ' ' GLU . 17.6 mt-30 -113.93 97.7 45.61 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.074 -176.325 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 945' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -75.64 -37.28 1.79 Allowed 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.287 1.991 . . . . 0.0 111.765 176.207 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 946' ' ' ALA . . . . . 0.679 ' HB3' ' HD3' ' A' ' 947' ' ' PRO . . . -160.77 -53.0 0.01 OUTLIER Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.03 -178.548 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.679 ' HD3' ' HB3' ' A' ' 946' ' ' ALA . 12.4 Cg_exo -70.52 154.17 64.93 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 121.963 1.775 . . . . 0.0 112.065 178.876 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.859 ' HB3' HG11 ' A' 1009 ' ' VAL . 5.6 Cg_endo -52.45 141.0 52.78 Favored 'Trans proline' 0 CA--C 1.512 -0.592 0 C-N-CA 123.132 2.555 . . . . 0.0 112.699 176.674 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.696 ' HB3' ' CD1' ' A' ' 951' ' ' TYR . 5.3 tt0 -72.11 -18.75 61.88 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.604 172.417 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.585 ' HB2' ' HG2' ' A' ' 953' ' ' PRO . 19.6 mm-40 80.28 -14.87 0.8 Allowed 'General case' 0 C--N 1.347 0.487 0 O-C-N 124.328 1.017 . . . . 0.0 109.679 -165.289 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.904 ' HB3' ' HG3' ' A' 1002 ' ' MET . 20.6 m-30 54.04 -38.19 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 115.789 1.774 . . . . 0.0 115.789 176.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 0.507 ' O ' ' HB ' ' A' ' 955' ' ' VAL . 45.4 t -54.79 -40.6 84.9 Favored Pre-proline 0 C--N 1.32 -0.688 0 O-C-N 122.076 -0.39 . . . . 0.0 111.019 168.842 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 0.745 ' HA ' ' HD2' ' A' ' 956' ' ' LYS . 8.2 Cg_exo -44.57 -51.32 7.25 Favored 'Trans proline' 0 C--N 1.357 0.985 0 C-N-CA 122.468 2.112 . . . . 0.0 112.836 170.927 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.53 ' HE1' ' HB3' ' A' ' 939' ' ' MET . 0.4 OUTLIER -62.66 -41.76 99.24 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.884 172.144 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.507 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 54.9 t -52.4 -36.88 22.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.886 176.342 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 956' ' ' LYS . . . . . 0.745 ' HD2' ' HA ' ' A' ' 953' ' ' PRO . 59.6 mttt -66.12 -41.89 89.92 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 111.599 0.222 . . . . 0.0 111.599 173.15 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -77.32 -44.82 28.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.754 0.311 . . . . 0.0 111.356 -172.061 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.54 ' O ' ' HG ' ' A' ' 962' ' ' LEU . 14.4 p -75.1 -34.47 31.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 176.915 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -64.44 -43.72 96.32 Favored Glycine 0 N--CA 1.448 -0.56 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 177.266 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 960' ' ' LEU . . . . . 0.565 HD12 ' HD2' ' A' ' 963' ' ' ARG . 16.3 tp -63.14 -38.47 91.31 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.925 -0.137 . . . . 0.0 110.678 175.23 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -69.84 -60.02 2.57 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 120.898 0.38 . . . . 0.0 111.012 -177.345 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.857 HD13 HD22 ' A' ' 995' ' ' LEU . 4.1 pp -56.54 -29.66 62.19 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 173.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.565 ' HD2' HD12 ' A' ' 960' ' ' LEU . 9.9 ptp180 -73.77 -36.39 65.08 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 120.195 1.361 . . . . 0.0 110.637 172.027 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 32.2 m -62.72 -33.52 75.29 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 174.136 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.571 ' HA ' ' OD1' ' A' ' 928' ' ' ASN . 25.8 tp -61.65 -54.35 44.0 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.487 174.132 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 0.767 ' HG ' ' NE2' ' A' ' 988' ' ' GLN . 8.0 tt -54.95 -41.04 70.6 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.185 -1.37 . . . . 0.0 109.38 178.826 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -68.8 -35.07 76.57 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.034 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.766 HG21 ' HB3' ' A' ' 924' ' ' LYS . 23.2 m -73.17 -39.21 65.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 118.809 0.731 . . . . 0.0 110.675 177.305 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.773 HG12 HG23 ' A' ' 984' ' ' ILE . 27.1 t -67.31 -36.67 77.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 CA-C-O 120.726 0.298 . . . . 0.0 110.519 173.255 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.422 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 20.4 t70 -68.63 -42.37 78.14 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 179.217 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.664 ' O ' HG23 ' A' ' 975' ' ' VAL . 31.7 tp10 -68.34 -24.8 64.86 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 113.857 -1.52 . . . . 0.0 109.69 179.738 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 58.8 m -73.54 -17.59 61.19 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.366 177.584 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.687 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 35.0 tp -67.72 -52.81 24.25 Favored Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 119.741 -0.783 . . . . 0.0 110.284 172.683 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.687 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 19.2 Cg_exo -70.14 -11.31 30.1 Favored 'Trans proline' 0 C--N 1.358 1.041 0 C-N-CA 121.404 1.403 . . . . 0.0 113.502 172.905 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.664 HG23 ' O ' ' A' ' 971' ' ' GLU . 38.8 t -66.15 -55.36 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 173.228 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.543 HD21 HD11 ' A' 1047 ' ' ILE . 18.0 tp -133.78 87.36 36.07 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 175.558 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -79.91 39.26 0.81 Allowed 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 123.772 2.982 . . . . 0.0 113.119 -171.485 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 978' ' ' ALA . . . . . 0.717 ' HB3' ' SD ' ' A' 1046 ' ' MET . . . -86.26 47.61 1.49 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.951 0.405 . . . . 0.0 110.944 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.484 ' HB2' ' CE1' ' A' 1053 ' ' HIS . 59.4 m 67.77 17.82 9.76 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 177.159 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.83 ' HB ' ' SD ' ' A' 1046 ' ' MET . 6.0 t -76.81 1.61 16.86 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.856 177.457 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.495 ' O ' ' HG2' ' A' ' 985' ' ' GLU . 11.0 p-80 -49.69 -49.14 48.82 Favored 'General case' 0 C--O 1.208 -1.101 0 O-C-N 123.224 0.327 . . . . 0.0 110.984 -177.675 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.65 -21.42 3.95 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 179.426 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.68 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 0.3 OUTLIER -80.08 -49.53 11.63 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 118.747 0.703 . . . . 0.0 111.45 171.071 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.773 HG23 HG12 ' A' ' 969' ' ' VAL . 2.9 mp -63.52 -30.94 51.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 178.174 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 985' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 981' ' ' HIS . 70.4 mm-40 -58.9 -46.17 88.52 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.083 175.718 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 24.6 mmt -73.13 -42.74 62.56 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.205 -176.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 0.814 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -65.65 -49.32 69.09 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 114.713 -1.131 . . . . 0.0 111.971 -176.384 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.784 ' O ' ' HB2' ' A' ' 992' ' ' ASN . 12.8 mm100 -56.02 -40.81 73.98 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.035 177.533 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 989' ' ' LYS . . . . . 0.592 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 0.0 OUTLIER -72.35 -39.2 68.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.297 -178.784 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.605 HD23 ' HB3' ' A' 1035 ' ' LEU . 26.7 tp -55.0 -59.12 5.18 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.921 179.702 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.619 ' HB3' ' CD2' ' A' 1035 ' ' LEU . 3.2 pp -63.08 -31.62 72.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.868 0.842 . . . . 0.0 109.741 179.007 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 992' ' ' ASN . . . . . 0.784 ' HB2' ' O ' ' A' ' 988' ' ' GLN . 20.6 t-20 -53.58 -57.33 11.13 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 113.564 -1.653 . . . . 0.0 112.747 -174.589 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 25.0 m -79.71 -25.34 41.2 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 -177.569 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -72.58 -38.03 68.01 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 119.346 -0.941 . . . . 0.0 111.404 177.714 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 0.857 HD22 HD13 ' A' ' 962' ' ' LEU . 0.5 OUTLIER -66.91 -24.25 66.07 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.132 171.033 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -78.19 -26.3 47.52 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 119.47 -0.892 . . . . 0.0 109.708 172.435 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 997' ' ' GLU . . . . . 0.53 ' O ' ' HG2' ' A' 1001 ' ' LYS . 6.8 tp10 -74.41 -42.69 58.79 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 173.636 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.761 HD22 HD11 ' A' 1028 ' ' LEU . 0.0 OUTLIER -56.99 -47.25 81.27 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.649 -178.89 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.644 ' O ' ' HB2' ' A' 1003 ' ' LYS . 82.6 mt -66.64 -39.26 83.38 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.332 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.246 -174.532 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 21.2 m-80 -62.18 -36.75 82.84 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.072 0.463 . . . . 0.0 111.633 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.53 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 72.3 mmtt -78.28 -40.61 36.41 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 122.133 0.968 . . . . 0.0 109.422 -177.42 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.904 ' HG3' ' HB3' ' A' ' 951' ' ' TYR . 5.0 tpt -63.86 -27.32 69.08 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.28 -1.327 . . . . 0.0 109.049 178.168 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.644 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 12.4 tptp -73.28 -53.09 11.71 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.031 -1.44 . . . . 0.0 110.506 -167.4 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.588 ' O ' HD23 ' A' 1013 ' ' LEU . 7.2 mp -77.4 -12.03 59.91 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.142 179.545 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.748 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -67.56 -40.74 84.93 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 119.526 -0.87 . . . . 0.0 109.526 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.76 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.3 pp0? -75.04 -32.72 61.63 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 119.115 -0.469 . . . . 0.0 111.69 169.56 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.57 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 10.6 mm-40 -46.37 -49.51 17.76 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.04 0.447 . . . . 0.0 110.588 175.925 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.904 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 49.7 m-85 -126.86 48.3 2.2 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 119.844 -0.743 . . . . 0.0 110.542 171.246 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1009 ' ' VAL . . . . . 0.954 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 11.9 p -50.94 -21.54 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.593 167.711 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 87.8 mtp -37.9 -49.35 1.22 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.161 -1.382 . . . . 0.0 111.574 172.509 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -171.76 -81.8 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 177.338 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 2.5 m -49.89 -71.46 0.06 Allowed 'General case' 0 C--O 1.246 0.911 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.829 -168.879 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.904 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 4.8 mp -46.56 -42.82 16.45 Favored 'General case' 0 CA--C 1.498 -1.047 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 179.539 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1014 ' ' GLN . . . . . 0.954 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.82 -58.01 9.26 Favored 'General case' 0 N--CA 1.438 -1.048 0 C-N-CA 119.827 -0.749 . . . . 0.0 110.769 -166.833 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A 1015 ' ' GLN . . . . . 0.622 ' O ' ' HB3' ' A' 1019 ' ' LYS . 40.3 mt-30 -67.83 -34.79 77.42 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.02 -169.452 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1016 ' ' GLU . . . . . 0.468 ' OE2' ' HE3' ' A' 1019 ' ' LYS . 18.4 tp10 -73.96 -41.64 61.68 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.307 -0.557 . . . . 0.0 111.142 177.517 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.748 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 6.1 m-85 -75.14 -34.4 61.64 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.93 0.871 . . . . 0.0 111.834 -173.927 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.517 ' HB2' ' NE2' ' A' 1014 ' ' GLN . 13.7 tptm -79.79 -40.86 27.7 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 113.414 -1.721 . . . . 0.0 110.825 -175.958 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1019 ' ' LYS . . . . . 0.622 ' HB3' ' O ' ' A' 1015 ' ' GLN . 0.0 OUTLIER -71.38 -35.19 71.0 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -179.58 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A 1020 ' ' GLN . . . . . 0.599 ' N ' ' HD3' ' A' 1019 ' ' LYS . 9.4 tt0 -69.99 -30.25 67.53 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.098 -1.41 . . . . 0.0 110.49 167.328 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.759 ' HG3' ' SD ' ' A' 1002 ' ' MET . 14.8 tmm? -69.02 -54.03 17.32 Favored 'General case' 0 CA--C 1.507 -0.702 0 C-N-CA 120.977 -0.289 . . . . 0.0 111.034 -179.616 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1022 ' ' LEU . . . . . 0.676 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.2 OUTLIER -83.63 -2.72 56.72 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 119.485 -0.886 . . . . 0.0 109.462 -172.43 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 46.1 m -86.11 -34.09 20.73 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 168.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.53 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -79.09 -22.6 45.0 Favored 'General case' 0 C--O 1.221 -0.425 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 173.015 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.818 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -85.9 -26.56 25.52 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.005 169.567 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.525 ' O ' HG23 ' A' 1030 ' ' VAL . 12.9 t60 -70.86 -30.7 67.17 Favored 'General case' 0 C--O 1.215 -0.762 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 165.234 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1027 ' ' ALA . . . . . 0.53 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -64.91 -42.46 94.71 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 123.975 0.91 . . . . 0.0 110.755 163.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.761 HD11 HD22 ' A' ' 998' ' ' LEU . 30.2 mt -58.13 -46.69 85.18 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 119.923 -0.711 . . . . 0.0 109.472 171.507 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1029 ' ' ALA . . . . . 0.426 ' CB ' HG22 ' A' ' 933' ' ' VAL . . . -59.09 -43.51 91.83 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 173.565 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.581 ' O ' ' HB3' ' A' 1033 ' ' LYS . 12.2 t -68.01 -51.23 51.4 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.211 0 CA-C-O 121.675 0.75 . . . . 0.0 110.863 -176.54 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.4 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 21.3 m-20 -76.76 -29.5 56.14 Favored 'General case' 0 C--O 1.214 -0.814 0 CA-C-N 115.056 -0.974 . . . . 0.0 112.158 -175.114 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.625 ' HA ' ' CD2' ' A' 1035 ' ' LEU . . . -71.28 -27.67 63.59 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.509 -0.476 . . . . 0.0 109.741 171.413 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.581 ' HB3' ' O ' ' A' 1030 ' ' VAL . 84.9 tttt -65.54 -45.92 81.57 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 122.091 0.948 . . . . 0.0 109.22 168.287 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.609 ' O ' ' HB3' ' A' 1037 ' ' ASP . 56.4 t30 -70.87 -46.61 62.32 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 113.967 -1.469 . . . . 0.0 112.599 -176.026 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1035 ' ' LEU . . . . . 0.814 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 4.0 pp -63.9 -36.38 83.76 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 122.156 -0.34 . . . . 0.0 110.627 -177.128 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.463 HD12 ' N ' ' A' 1037 ' ' ASP . 4.7 pp -72.36 -35.87 68.62 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 117.282 -1.767 . . . . 0.0 109.745 178.173 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.696 ' HA ' ' OD2' ' A' 1040 ' ' ASP . 19.3 t70 -54.88 -30.93 59.18 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 122.999 1.38 . . . . 0.0 110.585 168.716 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.534 ' HB ' ' O ' ' A' 1035 ' ' LEU . 14.3 t -73.57 -36.96 48.94 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.54 177.479 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.708 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 2.0 mp -79.31 -26.05 12.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 C-N-CA 121.123 -0.231 . . . . 0.0 111.573 172.894 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.696 ' OD2' ' HA ' ' A' 1037 ' ' ASP . 0.2 OUTLIER -59.93 -44.69 94.19 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 171.48 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.408 ' N ' ' OD1' ' A' 1040 ' ' ASP . 12.4 mt-30 -76.55 -31.22 57.45 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.718 174.885 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.708 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -56.29 -55.97 26.84 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 120.973 0.416 . . . . 0.0 111.818 -179.275 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.686 ' HA ' ' CE ' ' A' 1046 ' ' MET . 11.8 ptm180 -65.73 -34.52 78.38 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.535 -176.045 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.647 HD13 ' HA2' ' A' ' 918' ' ' GLY . 49.5 tp -63.62 -52.34 61.26 Favored 'General case' 0 C--O 1.216 -0.707 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.772 171.705 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.745 ' O ' ' HB2' ' A' 1049 ' ' GLN . 25.8 mtpt -58.58 -42.98 89.24 Favored 'General case' 0 C--O 1.215 -0.718 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -172.788 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.83 ' SD ' ' HB ' ' A' ' 980' ' ' THR . 0.3 OUTLIER -71.79 -26.38 62.4 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.376 -0.529 . . . . 0.0 111.974 -179.063 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.633 HG13 ' HA3' ' A' ' 917' ' ' GLY . 44.9 mm -87.52 -43.7 15.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 121.347 0.594 . . . . 0.0 111.011 176.872 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 27.6 t -84.0 -15.81 46.34 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.114 -0.948 . . . . 0.0 112.473 -171.097 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1049 ' ' GLN . . . . . 0.745 ' HB2' ' O ' ' A' 1045 ' ' LYS . 14.4 tp60 -51.4 126.0 15.92 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.762 0.791 . . . . 0.0 111.82 -164.854 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 8.2 m -62.89 -23.56 67.4 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.007 -1.451 . . . . 0.0 110.506 178.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1051 ' ' ARG . . . . . 0.412 ' H ' ' HG3' ' A' 1049 ' ' GLN . 32.6 mmt180 -79.64 141.92 56.69 Favored Pre-proline 0 N--CA 1.449 -0.495 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.9 178.789 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -48.83 114.06 1.11 Allowed 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 123.072 2.514 . . . . 0.0 111.798 175.679 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 1053 ' ' HIS . . . . . 0.484 ' CE1' ' HB2' ' A' ' 979' ' ' SER . 36.5 t60 . . . . . 0 C--N 1.321 -0.631 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.42 -173.873 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.724 0 N-CA-C 111.98 -0.448 . . . . 0.0 111.98 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 35.6 m 57.63 81.76 0.25 Allowed Pre-proline 0 CA--C 1.533 0.293 0 CA-C-O 121.001 0.429 . . . . 0.0 111.167 -178.468 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -77.18 55.47 5.06 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 123.394 2.73 . . . . 0.0 112.584 -177.146 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . 123.77 -75.77 0.38 Allowed Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.515 178.268 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 58.8 mt -115.18 -48.91 4.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 120.524 0.202 . . . . 0.0 110.868 -176.767 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 29.1 t 72.26 160.2 0.22 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.624 -178.445 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 125.35 5.08 6.77 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.221 -178.632 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 85.77 -95.81 2.04 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 121.022 -0.609 . . . . 0.0 112.255 179.225 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . -152.98 -156.72 7.7 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 121.108 -0.567 . . . . 0.0 111.966 -178.407 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . -96.84 -49.84 1.88 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.125 178.725 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 918' ' ' GLY . . . . . 0.938 ' HA2' HD22 ' A' 1044 ' ' LEU . . . 79.49 -153.96 37.7 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.955 -0.641 . . . . 0.0 112.977 177.447 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 919' ' ' ILE . . . . . 0.625 ' HA ' ' HB3' ' A' 1040 ' ' ASP . 0.1 OUTLIER -73.8 123.18 28.44 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.697 0 C-N-CA 123.358 0.663 . . . . 0.0 109.582 176.909 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 920' ' ' ARG . . . . . . . . . . . . . 43.6 ttm180 -165.38 -17.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.638 -175.591 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 9.2 m -62.37 94.79 0.06 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.195 0.522 . . . . 0.0 112.301 -171.731 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -86.38 82.48 7.96 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 176.61 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 923' ' ' ASP . . . . . 0.649 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 17.3 m-20 -126.53 -168.49 1.87 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.024 -175.511 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 924' ' ' LYS . . . . . 0.526 ' HB3' HG21 ' A' ' 968' ' ' THR . 31.0 mmtp -54.66 -30.85 56.49 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -168.651 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 925' ' ' VAL . . . . . 0.583 ' O ' HG23 ' A' ' 929' ' ' VAL . 35.0 m -56.94 -34.95 45.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.116 0.484 . . . . 0.0 110.641 177.355 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 926' ' ' TYR . . . . . 0.649 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.1 OUTLIER -74.08 -37.28 64.25 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.405 174.952 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 927' ' ' GLU . . . . . 0.494 ' HG3' ' CZ ' ' A' ' 926' ' ' TYR 0.257 1.9 tt0 -78.38 -23.78 46.65 Favored 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 118.399 -1.32 . . . . 0.0 113.758 -177.334 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 928' ' ' ASN . . . . . 0.445 ' ND2' HG22 ' A' ' 964' ' ' THR . 87.1 m-20 -72.2 -27.77 62.77 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.22 0.533 . . . . 0.0 110.097 169.504 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 929' ' ' VAL . . . . . 0.588 HG22 ' HB1' ' A' 1032 ' ' ALA . 98.7 t -77.0 -29.38 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.953 171.776 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 930' ' ' THR . . . . . . . . . . . . . 25.7 m -61.48 -40.38 94.33 Favored 'General case' 0 C--N 1.311 -1.088 0 C-N-CA 119.507 -0.877 . . . . 0.0 108.898 171.121 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -71.57 -53.05 10.53 Favored Glycine 0 CA--C 1.527 0.786 0 CA-C-N 115.172 -0.922 . . . . 0.0 113.689 176.467 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 932' ' ' LEU . . . . . 0.565 ' CD2' ' HA ' ' A' ' 929' ' ' VAL . 1.8 pp -61.73 -46.67 88.65 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.94 0.718 . . . . 0.0 112.94 -176.19 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 73.5 t -68.99 -39.24 79.49 Favored 'Isoleucine or valine' 0 C--O 1.241 0.605 0 CA-C-O 121.154 0.502 . . . . 0.0 110.906 -176.039 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 934' ' ' LYS . . . . . 0.471 ' HD3' ' HG3' ' A' ' 938' ' ' GLU . 5.2 tppp? -55.63 -44.11 76.8 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.679 -178.939 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -60.13 -45.19 93.86 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.462 177.727 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 936' ' ' VAL . . . . . 0.693 HG22 ' HB1' ' A' 1025 ' ' ALA . 85.4 t -45.17 -74.32 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 123.6 0.76 . . . . 0.0 112.879 -176.928 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 937' ' ' ILE . . . . . 0.511 HG22 HD12 ' A' 1022 ' ' LEU . 14.5 pt -77.32 -42.53 30.76 Favored 'Isoleucine or valine' 0 C--O 1.245 0.849 0 CA-C-N 115.927 -0.579 . . . . 0.0 112.546 -174.171 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 938' ' ' GLU . . . . . 0.608 ' O ' ' HB2' ' A' ' 942' ' ' LYS . 35.4 mm-40 -66.65 -43.41 84.69 Favored 'General case' 0 C--N 1.316 -0.867 0 C-N-CA 120.53 -0.468 . . . . 0.0 111.105 -173.059 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 939' ' ' MET . . . . . 0.431 ' HG2' ' HB ' ' A' ' 943' ' ' ILE . 11.1 ttp -75.59 -27.28 58.48 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 119.225 -0.99 . . . . 0.0 110.615 176.238 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 940' ' ' SER . . . . . 0.655 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 32.5 t -48.81 -53.74 18.0 Favored 'General case' 0 C--O 1.236 0.393 0 O-C-N 123.8 0.687 . . . . 0.0 112.101 -170.452 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 10.9 p -123.18 -19.57 5.97 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.96 -174.007 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 942' ' ' LYS . . . . . 0.608 ' HB2' ' O ' ' A' ' 938' ' ' GLU . 2.1 mptp? -82.41 -40.1 21.72 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 119.5 -0.88 . . . . 0.0 110.472 -174.553 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 943' ' ' ILE . . . . . 0.486 ' O ' HD13 ' A' ' 943' ' ' ILE . 0.1 OUTLIER -34.87 -42.29 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 O-C-N 123.979 0.799 . . . . 0.0 112.729 177.608 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 944' ' ' GLN . . . . . 0.456 ' HG3' ' HD2' ' A' ' 945' ' ' PRO . 53.4 tt0 -174.98 143.65 0.78 Allowed Pre-proline 0 CA--C 1.53 0.194 0 CA-C-N 118.255 0.48 . . . . 0.0 110.419 177.043 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 945' ' ' PRO . . . . . 0.463 ' O ' ' HD3' ' A' ' 947' ' ' PRO . 71.5 Cg_exo -52.14 -48.63 20.68 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.657 2.238 . . . . 0.0 111.496 173.785 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 946' ' ' ALA . . . . . . . . . . . . . . . -107.25 85.54 2.16 Favored Pre-proline 0 C--N 1.329 -0.323 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 168.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 947' ' ' PRO . . . . . 0.475 ' HG2' ' NZ ' ' A' 1018 ' ' LYS . 68.9 Cg_endo -87.37 119.96 1.47 Allowed 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 123.074 2.516 . . . . 0.0 113.733 -168.021 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 948' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 947' ' ' PRO . 17.2 Cg_exo -70.74 -169.05 0.35 Allowed 'Trans proline' 0 CA--C 1.509 -0.757 0 C-N-CA 123.247 2.632 . . . . 0.0 112.231 176.854 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 949' ' ' GLU . . . . . 0.981 ' HB3' ' HB2' ' A' 1006 ' ' GLN . 0.0 OUTLIER -83.34 76.26 9.92 Favored 'General case' 0 CA--C 1.491 -1.323 0 CA-C-O 121.589 0.709 . . . . 0.0 111.138 178.004 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 950' ' ' GLU . . . . . 0.625 ' HA ' ' HG2' ' A' ' 953' ' ' PRO . 21.2 mm-40 -84.16 10.15 10.95 Favored 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 156.051 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 951' ' ' TYR . . . . . 0.552 ' CD1' ' N ' ' A' ' 951' ' ' TYR . 0.4 OUTLIER -71.5 -55.93 6.9 Favored 'General case' 0 C--O 1.216 -0.699 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.577 -178.424 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 952' ' ' VAL . . . . . 1.005 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -59.85 -42.69 92.24 Favored Pre-proline 0 CA--C 1.542 0.665 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.41 172.342 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 953' ' ' PRO . . . . . 1.005 ' HD3' HG13 ' A' ' 952' ' ' VAL . 87.1 Cg_exo -55.21 -38.76 93.43 Favored 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 121.212 1.274 . . . . 0.0 111.735 167.572 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 954' ' ' MET . . . . . 0.46 ' O ' HG22 ' A' ' 958' ' ' VAL . 4.0 ttm -66.38 -30.56 70.97 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.874 176.082 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 955' ' ' VAL . . . . . 0.648 HG23 ' HA ' ' A' ' 952' ' ' VAL . 69.4 t -53.53 -42.99 51.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 174.68 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.41 -36.0 80.4 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.464 175.29 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -78.46 -45.93 20.96 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 111.911 0.338 . . . . 0.0 111.911 -174.226 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 958' ' ' VAL . . . . . 0.685 ' O ' ' HG ' ' A' ' 962' ' ' LEU . 17.7 m -81.63 -34.7 13.15 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.663 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -60.13 -35.59 88.11 Favored Glycine 0 N--CA 1.437 -1.241 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 178.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 960' ' ' LEU . . . . . 0.56 HD12 ' HD3' ' A' ' 963' ' ' ARG . 19.5 tp -76.77 -36.57 56.94 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-O 120.697 0.284 . . . . 0.0 110.682 176.219 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -72.11 -44.21 63.54 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.097 0.475 . . . . 0.0 111.93 -173.11 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 962' ' ' LEU . . . . . 0.89 HD11 ' HG ' ' A' ' 995' ' ' LEU . 4.6 pp -87.16 -18.09 31.21 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.843 -177.853 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 963' ' ' ARG . . . . . 0.56 ' HD3' HD12 ' A' ' 960' ' ' LEU . 12.0 ptm180 -72.79 -38.01 67.38 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 118.834 -1.147 . . . . 0.0 110.119 165.782 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 964' ' ' THR . . . . . 0.498 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 23.9 m -65.62 -31.27 72.2 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.171 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 965' ' ' LEU . . . . . 0.701 HD23 ' HG ' ' A' ' 991' ' ' LEU . 17.7 tp -62.6 -50.16 72.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.089 171.837 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 966' ' ' LEU . . . . . 0.789 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 9.8 tt -64.21 -36.37 83.84 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.08 -0.963 . . . . 0.0 108.489 -174.696 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 967' ' ' ALA . . . . . 0.426 ' HA ' ' HB3' ' A' ' 970' ' ' ASP . . . -71.87 -39.19 69.8 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.925 178.496 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 968' ' ' THR . . . . . 0.526 HG21 ' HB3' ' A' ' 924' ' ' LYS . 2.2 p -61.48 -35.81 78.7 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 118.945 0.793 . . . . 0.0 110.212 174.049 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 969' ' ' VAL . . . . . 0.909 HG12 HG23 ' A' ' 984' ' ' ILE . 49.1 t -74.43 -36.61 42.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.208 174.168 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 970' ' ' ASP . . . . . 0.57 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 17.3 t70 -70.13 -42.04 73.14 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 122.04 0.924 . . . . 0.0 109.201 -178.629 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 971' ' ' GLU . . . . . 0.603 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 7.9 tp10 -67.2 -31.18 71.38 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.258 -1.337 . . . . 0.0 109.904 176.898 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 972' ' ' SER . . . . . 0.479 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 46.9 m -68.38 -18.04 64.37 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.939 174.642 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 973' ' ' LEU . . . . . 0.907 ' HG ' ' HB2' ' A' ' 981' ' ' HIS . 10.4 tt -66.74 -51.67 38.13 Favored Pre-proline 0 CA--C 1.53 0.194 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 -177.89 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 974' ' ' PRO . . . . . 0.745 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 5.0 Cg_exo -79.61 -4.77 13.75 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 121.388 1.392 . . . . 0.0 113.004 172.322 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 975' ' ' VAL . . . . . 0.586 HG23 ' O ' ' A' ' 971' ' ' GLU . 40.1 t -75.98 -54.48 13.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.125 171.608 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 976' ' ' LEU . . . . . 0.623 HD12 HG21 ' A' ' 980' ' ' THR . 97.9 mt -94.86 122.32 60.67 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.451 -178.588 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 977' ' ' PRO . . . . . 0.49 ' HD3' ' HA ' ' A' ' 976' ' ' LEU . 20.0 Cg_exo -65.95 112.65 2.31 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 123.519 2.813 . . . . 0.0 114.564 -170.046 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . 67.37 -82.19 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 165.536 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 979' ' ' SER . . . . . 0.422 ' O ' ' HG2' ' A' ' 982' ' ' ARG . 19.7 m -59.63 -37.14 77.84 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -166.284 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 980' ' ' THR . . . . . 0.623 HG21 HD12 ' A' ' 976' ' ' LEU . 54.4 m -69.21 -24.47 64.03 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 120.299 -0.56 . . . . 0.0 111.144 179.167 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 981' ' ' HIS . . . . . 0.907 ' HB2' ' HG ' ' A' ' 973' ' ' LEU . 0.3 OUTLIER -69.0 -18.4 64.05 Favored 'General case' 0 C--O 1.218 -0.554 0 O-C-N 121.934 -0.479 . . . . 0.0 112.187 -174.653 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 982' ' ' ARG . . . . . 0.422 ' HG2' ' O ' ' A' ' 979' ' ' SER . 13.2 ptm180 -83.2 -21.65 33.39 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 119.849 -0.74 . . . . 0.0 110.87 177.557 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 983' ' ' GLU . . . . . 0.545 ' CB ' ' HB2' ' A' 1042 ' ' ALA . 3.0 mp0 -76.15 -33.51 59.38 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 165.046 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 984' ' ' ILE . . . . . 0.909 HG23 HG12 ' A' ' 969' ' ' VAL . 69.6 mt -68.36 -30.39 47.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.569 178.326 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 985' ' ' GLU . . . . . 0.636 ' HG2' ' O ' ' A' ' 981' ' ' HIS . 72.5 mm-40 -62.45 -53.16 58.88 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.269 176.054 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 20.5 ttt -69.82 -39.98 76.16 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.831 -172.639 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 987' ' ' ALA . . . . . 1.065 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -76.44 -53.41 8.17 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.099 -1.409 . . . . 0.0 112.624 -167.638 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 988' ' ' GLN . . . . . 0.789 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 25.2 pt20 -65.04 -21.77 66.88 Favored 'General case' 0 C--O 1.226 -0.167 0 C-N-CA 120.126 -0.629 . . . . 0.0 109.592 178.464 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 989' ' ' LYS . . . . . 0.59 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 34.0 tttp -73.3 -43.26 61.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.124 -0.944 . . . . 0.0 112.178 173.78 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 990' ' ' LEU . . . . . 0.595 ' O ' ' HB2' ' A' ' 994' ' ' ASP . 16.0 mt -52.54 -53.73 42.22 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.235 174.34 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 991' ' ' LEU . . . . . 0.707 HD11 ' HB2' ' A' ' 962' ' ' LEU . 0.4 OUTLIER -59.82 -39.54 85.41 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 175.946 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 992' ' ' ASN . . . . . 0.59 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 40.9 t-20 -52.88 -57.29 10.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.006 -0.997 . . . . 0.0 111.565 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 26.6 p -80.05 -31.24 39.5 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.211 0.448 . . . . 0.0 112.211 -178.342 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 994' ' ' ASP . . . . . 0.595 ' HB2' ' O ' ' A' ' 990' ' ' LEU . 0.1 OUTLIER -65.91 -42.07 90.62 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 120.272 -0.571 . . . . 0.0 110.87 178.72 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 995' ' ' LEU . . . . . 0.89 ' HG ' HD11 ' A' ' 962' ' ' LEU . 1.8 tm? -59.42 -32.86 70.57 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.486 0.715 . . . . 0.0 110.691 168.108 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -67.77 -28.34 67.53 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 118.8 -1.16 . . . . 0.0 110.28 174.454 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -75.26 -43.11 53.22 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 120.638 0.256 . . . . 0.0 110.337 175.518 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 998' ' ' LEU . . . . . 0.889 HD13 ' HB2' ' A' 1025 ' ' ALA . 8.3 tp -55.8 -47.55 76.94 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.168 0.509 . . . . 0.0 110.998 -179.059 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 999' ' ' ILE . . . . . 0.536 ' O ' ' HB2' ' A' 1003 ' ' LYS . 39.9 mm -68.12 -34.1 64.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 115.296 -0.866 . . . . 0.0 111.738 -172.099 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 3.0 m120 -63.05 -38.62 91.91 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.179 0.514 . . . . 0.0 111.618 179.095 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1001 ' ' LYS . . . . . 0.517 ' HA ' ' HD1' ' A' 1017 ' ' TYR . 14.3 mptt -83.63 -36.74 23.62 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.826 0.822 . . . . 0.0 109.402 -176.121 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1002 ' ' MET . . . . . 0.465 ' HB2' ' HG2' ' A' 1021 ' ' MET . 46.3 ttm -59.87 -30.81 69.24 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 114.349 -1.296 . . . . 0.0 109.684 174.079 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1003 ' ' LYS . . . . . 0.619 ' O ' ' HG3' ' A' 1006 ' ' GLN . 4.6 tptp -74.24 -53.54 9.56 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 114.694 -1.139 . . . . 0.0 111.699 -170.595 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1004 ' ' LEU . . . . . 0.882 HD23 ' HG3' ' A' 1007 ' ' GLN . 86.4 mt -72.48 -13.69 61.49 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.461 -179.459 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1005 ' ' ALA . . . . . 0.661 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -70.36 -42.48 71.75 Favored 'General case' 0 C--O 1.216 -0.692 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 177.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1006 ' ' GLN . . . . . 0.981 ' HB2' ' HB3' ' A' ' 949' ' ' GLU . 5.1 pp0? -75.86 -31.73 59.42 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 119.034 -0.508 . . . . 0.0 111.938 172.699 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1007 ' ' GLN . . . . . 0.882 ' HG3' HD23 ' A' 1004 ' ' LEU . 13.2 mm100 -48.36 -51.43 26.4 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.265 0.555 . . . . 0.0 110.045 175.491 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1008 ' ' TYR . . . . . 0.762 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 69.6 m-85 -120.74 45.85 2.14 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.368 173.178 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1009 ' ' VAL . . . . . 1.099 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 10.8 p -52.2 -20.54 1.91 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 CA-C-N 114.847 -1.069 . . . . 0.0 110.183 170.14 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1010 ' ' MET . . . . . 0.45 ' O ' ' HB ' ' A' 1011 ' ' THR . 24.3 mmt -38.53 -44.09 0.92 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 113.843 -1.526 . . . . 0.0 111.298 172.69 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1011 ' ' THR . . . . . 0.497 HG23 ' N ' ' A' 1012 ' ' SER . 8.1 t -178.76 -65.16 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 171.619 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1012 ' ' SER . . . . . 0.497 ' N ' HG23 ' A' 1011 ' ' THR . 6.9 m -57.65 -73.85 0.07 Allowed 'General case' 0 C--O 1.242 0.676 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -167.857 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1013 ' ' LEU . . . . . 0.762 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 7.8 mp -49.89 -37.1 29.88 Favored 'General case' 0 CA--C 1.504 -0.821 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.226 178.67 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1014 ' ' GLN . . . . . 1.099 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.9 OUTLIER -54.88 -48.73 72.62 Favored 'General case' 0 N--CA 1.443 -0.815 0 O-C-N 123.633 0.583 . . . . 0.0 111.472 -167.088 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A 1015 ' ' GLN . . . . . 0.642 ' O ' ' HB3' ' A' 1019 ' ' LYS . 14.1 pt20 -76.27 -36.83 58.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.967 -176.102 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -74.11 -40.57 62.59 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.765 0.793 . . . . 0.0 110.836 -176.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1017 ' ' TYR . . . . . 0.661 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 5.3 m-85 -78.31 -37.92 43.59 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 115.441 -0.799 . . . . 0.0 112.7 -176.706 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1018 ' ' LYS . . . . . 0.612 ' HA ' ' CB ' ' A' 1021 ' ' MET . 35.7 ttpt -81.96 -25.52 34.75 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.733 -175.425 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1019 ' ' LYS . . . . . 0.642 ' HB3' ' O ' ' A' 1015 ' ' GLN . 0.0 OUTLIER -73.33 -32.47 64.59 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 174.883 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A 1020 ' ' GLN . . . . . 0.475 ' N ' ' HD3' ' A' 1019 ' ' LYS . 49.1 mt-30 -68.32 -32.89 73.33 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.652 162.957 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1021 ' ' MET . . . . . 0.612 ' CB ' ' HA ' ' A' 1018 ' ' LYS . 18.2 tmm? -64.9 -53.55 44.83 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 -179.7 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1022 ' ' LEU . . . . . 0.511 HD12 HG22 ' A' ' 937' ' ' ILE . 0.2 OUTLIER -78.15 -11.83 59.95 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 119.248 -0.981 . . . . 0.0 109.821 -173.069 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 63.0 m -86.57 -33.95 20.06 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.761 175.433 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1024 ' ' ALA . . . . . 0.484 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -79.32 -23.58 43.39 Favored 'General case' 0 C--O 1.221 -0.432 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 172.878 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1025 ' ' ALA . . . . . 0.889 ' HB2' HD13 ' A' ' 998' ' ' LEU . . . -86.28 -24.74 25.83 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.619 170.215 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1026 ' ' HIS . . . . . 0.545 ' O ' HG23 ' A' 1030 ' ' VAL . 47.0 t60 -73.37 -28.5 62.07 Favored 'General case' 0 C--O 1.217 -0.644 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 164.287 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1027 ' ' ALA . . . . . 0.484 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -66.19 -40.9 90.76 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 123.586 0.755 . . . . 0.0 110.418 163.419 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1028 ' ' LEU . . . . . 0.766 HD12 HD22 ' A' ' 998' ' ' LEU . 25.4 mt -61.83 -43.72 98.28 Favored 'General case' 0 C--N 1.313 -0.983 0 C-N-CA 119.919 -0.712 . . . . 0.0 109.89 170.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -58.29 -40.85 83.03 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.645 0.26 . . . . 0.0 110.884 171.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1030 ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' 1026 ' ' HIS . 4.7 t -67.27 -52.05 46.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 121.111 0.482 . . . . 0.0 110.742 -176.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1031 ' ' ASP . . . . . 0.654 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 1.4 m-20 -77.43 -27.85 52.36 Favored 'General case' 0 C--O 1.207 -1.144 0 CA-C-N 115.758 -0.656 . . . . 0.0 112.435 -177.944 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1032 ' ' ALA . . . . . 0.621 ' O ' HD12 ' A' 1036 ' ' LEU . . . -66.76 -32.7 74.16 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 121.769 -0.582 . . . . 0.0 109.438 169.939 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1033 ' ' LYS . . . . . 0.412 ' HB3' ' O ' ' A' 1030 ' ' VAL . 87.7 tttt -68.51 -39.66 81.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.894 0.854 . . . . 0.0 109.523 170.216 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1034 ' ' ASN . . . . . 0.654 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 36.6 t30 -71.21 -52.69 17.65 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 114.787 -1.097 . . . . 0.0 111.444 -177.267 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1035 ' ' LEU . . . . . 1.065 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 3.7 pp -64.14 -42.2 96.88 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 118.911 -0.566 . . . . 0.0 111.671 -171.29 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1036 ' ' LEU . . . . . 0.671 HD13 ' H ' ' A' 1037 ' ' ASP . 0.0 OUTLIER -71.76 -33.05 68.32 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 116.416 -2.114 . . . . 0.0 109.056 -178.573 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A 1037 ' ' ASP . . . . . 0.671 ' H ' HD13 ' A' 1036 ' ' LEU . 22.0 t70 -57.28 -44.93 84.46 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.073 171.034 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1038 ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' 1034 ' ' ASN . 37.4 t -56.15 -38.29 53.32 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.61 0 CA-C-N 114.193 -1.367 . . . . 0.0 111.812 175.705 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1039 ' ' ILE . . . . . 0.69 HD11 ' HA ' ' A' ' 984' ' ' ILE . 1.6 mp -80.61 -32.39 13.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 118.451 0.569 . . . . 0.0 111.814 175.332 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1040 ' ' ASP . . . . . 0.625 ' HB3' ' HA ' ' A' ' 919' ' ' ILE . 0.3 OUTLIER -62.19 -38.57 89.59 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.55 0.691 . . . . 0.0 109.859 170.526 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A 1041 ' ' GLN . . . . . 0.406 ' O ' ' HB2' ' A' 1045 ' ' LYS . 87.6 mt-30 -76.11 -33.13 59.46 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.779 173.372 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1042 ' ' ALA . . . . . 0.555 ' O ' ' HG2' ' A' 1046 ' ' MET . . . -55.89 -55.46 32.36 Favored 'General case' 0 CA--C 1.501 -0.94 0 C-N-CA 123.101 0.56 . . . . 0.0 111.984 178.249 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1043 ' ' ARG . . . . . 0.71 ' HD3' ' N ' ' A' 1044 ' ' LEU . 0.0 OUTLIER -65.03 -34.61 78.84 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 -176.877 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A 1044 ' ' LEU . . . . . 0.938 HD22 ' HA2' ' A' ' 918' ' ' GLY . 30.8 tp -66.07 -58.47 5.41 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 115.05 -0.977 . . . . 0.0 109.054 177.888 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1045 ' ' LYS . . . . . 0.567 ' HA ' ' OG ' ' A' 1048 ' ' SER . 16.6 ttpt -52.21 -42.72 63.78 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.648 1.179 . . . . 0.0 112.562 -178.727 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1046 ' ' MET . . . . . 0.555 ' HG2' ' O ' ' A' 1042 ' ' ALA . 8.6 ptm -67.59 -20.51 65.38 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 119.132 -1.027 . . . . 0.0 111.883 179.148 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1047 ' ' ILE . . . . . 0.411 HG12 ' O ' ' A' 1043 ' ' ARG . 41.3 mm -95.84 -32.06 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-O 120.837 0.351 . . . . 0.0 111.228 174.203 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1048 ' ' SER . . . . . 0.567 ' OG ' ' HA ' ' A' 1045 ' ' LYS . 78.3 p -83.87 -29.45 27.23 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -173.515 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1049 ' ' GLN . . . . . 0.498 ' HA ' ' OE1' ' A' 1049 ' ' GLN . 9.6 mm-40 -59.54 131.27 50.44 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 120.92 0.39 . . . . 0.0 110.664 179.462 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 35.7 p -78.92 -6.18 55.56 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.438 -175.131 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 1051 ' ' ARG . . . . . 0.913 ' HB3' ' HD3' ' A' 1052 ' ' PRO . 52.8 ttp180 -154.75 -75.81 0.01 OUTLIER Pre-proline 0 CA--C 1.54 0.558 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 176.848 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1052 ' ' PRO . . . . . 0.913 ' HD3' ' HB3' ' A' 1051 ' ' ARG . 73.9 Cg_endo -98.17 115.8 0.11 Allowed 'Trans proline' 0 N--CA 1.452 -0.953 0 C-N-CA 121.921 1.747 . . . . 0.0 114.628 -166.36 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 1053 ' ' HIS . . . . . 0.514 ' HD2' ' HB3' ' A' 1046 ' ' MET . 26.1 t60 . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.542 170.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.791 ' HB2' HG21 ' A' ' 968' ' ' THR . 33.4 mmtp . . . . . 0 C--O 1.226 -0.153 0 N-CA-C 111.711 0.263 . . . . 0.0 111.711 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.607 ' O ' HG23 ' A' ' 929' ' ' VAL . 16.6 m -55.38 -31.84 28.15 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.396 0 CA-C-O 121.02 0.438 . . . . 0.0 110.528 175.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . 0.456 ' CB ' HD11 ' A' 1036 ' ' LEU . 0.0 OUTLIER -77.79 -32.76 52.6 Favored 'General case' 0 CA--C 1.501 -0.938 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.585 177.175 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -77.53 -23.94 50.04 Favored 'General case' 0 C--N 1.3 -1.558 0 C-N-CA 118.261 -1.376 . . . . 0.0 112.397 178.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.516 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 2.7 m120 -72.44 -30.19 64.37 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 121.863 0.839 . . . . 0.0 108.848 171.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.651 ' HA ' HD23 ' A' ' 932' ' ' LEU . 90.2 t -79.51 -28.45 13.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 114.666 -1.152 . . . . 0.0 110.362 176.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.602 ' O ' ' HD2' ' A' ' 934' ' ' LYS . 53.2 m -57.47 -49.26 76.84 Favored 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 119.561 -0.856 . . . . 0.0 108.786 170.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -64.11 -51.4 53.33 Favored Glycine 0 CA--C 1.525 0.707 0 CA-C-N 115.355 -0.838 . . . . 0.0 113.459 177.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.651 HD23 ' HA ' ' A' ' 929' ' ' VAL . 0.3 OUTLIER -61.91 -49.02 77.85 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 112.751 0.648 . . . . 0.0 112.751 -175.882 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.47 HG23 HG13 ' A' ' 929' ' ' VAL . 53.0 t -70.17 -38.27 74.26 Favored 'Isoleucine or valine' 0 C--O 1.24 0.576 0 CA-C-O 120.947 0.403 . . . . 0.0 111.446 -174.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.602 ' HD2' ' O ' ' A' ' 930' ' ' THR . 0.2 OUTLIER -58.92 -37.15 76.01 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.492 179.208 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 0.491 ' HA ' ' SD ' ' A' ' 939' ' ' MET . . . -64.03 -42.01 97.22 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.607 -0.269 . . . . 0.0 111.066 177.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.77 HG22 ' HB1' ' A' 1025 ' ' ALA . 99.3 t -47.55 -69.79 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.065 -178.148 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 26.7 pt -71.95 -39.76 67.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 N-CA-C 112.489 0.551 . . . . 0.0 112.489 -176.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -72.52 -52.19 16.76 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 119.722 -0.791 . . . . 0.0 111.37 -173.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.491 ' SD ' ' HA ' ' A' ' 935' ' ' ALA . 1.0 OUTLIER -68.59 -24.78 64.63 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.252 -0.579 . . . . 0.0 109.57 -179.065 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.743 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 8.7 p . . . . . 0 C--O 1.224 -0.289 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.206 -179.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.989 ' HB3' ' HG2' ' A' 1002 ' ' MET . 22.4 m-85 . . . . . 0 CA--C 1.538 0.517 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 0.604 ' O ' ' HB ' ' A' ' 955' ' ' VAL . 45.8 t -50.57 -43.13 79.9 Favored Pre-proline 0 C--N 1.322 -0.63 0 C-N-CA 122.861 0.464 . . . . 0.0 111.703 173.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 0.634 ' O ' ' HB3' ' A' ' 956' ' ' LYS . 24.3 Cg_exo -49.31 -43.05 39.14 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 122.022 1.815 . . . . 0.0 112.831 172.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.421 ' O ' HG12 ' A' ' 958' ' ' VAL . 21.2 ttt -76.26 -31.09 58.11 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.566 176.287 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.604 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 78.9 t -52.96 -35.77 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 167.741 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.634 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 11.1 tmtt? -66.58 -36.43 82.61 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.119 172.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -76.93 -47.0 22.24 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.908 0.385 . . . . 0.0 111.554 -174.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.619 HG22 HD23 ' A' ' 962' ' ' LEU . 14.1 p -85.4 -33.51 7.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.063 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -60.44 -43.11 99.09 Favored Glycine 0 N--CA 1.447 -0.59 0 N-CA-C 110.8 -0.92 . . . . 0.0 110.8 176.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . 0.419 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 14.7 tp -63.57 -36.76 84.87 Favored 'General case' 0 C--O 1.22 -0.468 0 C-N-CA 122.235 0.214 . . . . 0.0 110.716 176.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -75.72 -38.12 58.83 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.266 0.555 . . . . 0.0 111.046 -174.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.881 HD21 HD13 ' A' ' 995' ' ' LEU . 4.3 pp -87.37 -20.26 26.96 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.613 -178.203 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.419 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 15.3 ptm180 -77.01 -35.93 56.67 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 119.574 -0.85 . . . . 0.0 110.668 165.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 85.8 m -61.5 -36.02 79.34 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 173.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.516 ' HA ' ' OD1' ' A' ' 928' ' ' ASN . 18.5 tp -61.77 -47.85 83.34 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.293 -1.321 . . . . 0.0 110.207 173.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.768 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.4 tt -66.04 -37.85 86.89 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.191 -173.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -71.91 -31.15 66.1 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.901 178.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.791 HG21 ' HB2' ' A' ' 924' ' ' LYS . 23.5 m -71.22 -36.91 72.03 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 119.668 -0.813 . . . . 0.0 109.553 173.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.843 HG12 HG23 ' A' ' 984' ' ' ILE . 61.7 t -68.47 -39.78 81.19 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.338 172.458 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.764 ' HB2' HE22 ' A' ' 988' ' ' GLN . 10.3 t70 -67.23 -40.23 86.34 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.85 0.833 . . . . 0.0 108.758 -178.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.655 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 8.1 tp10 -68.28 -29.47 68.26 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 114.561 -1.2 . . . . 0.0 109.726 177.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.686 ' HA ' HG22 ' A' ' 975' ' ' VAL . 70.8 m -69.52 -17.91 63.62 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.879 175.65 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.899 ' HB2' HG21 ' A' ' 984' ' ' ILE . 10.5 tt -68.81 -52.78 16.81 Favored Pre-proline 0 N--CA 1.449 -0.493 0 C-N-CA 120.973 -0.291 . . . . 0.0 110.324 -177.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.655 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 90.4 Cg_endo -90.91 0.75 4.94 Favored 'Trans proline' 0 C--N 1.357 0.991 0 C-N-CA 121.357 1.371 . . . . 0.0 114.72 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.686 HG22 ' HA ' ' A' ' 972' ' ' SER . 27.4 m . . . . . 0 N--CA 1.454 -0.269 0 O-C-N 121.427 -0.795 . . . . 0.0 111.298 172.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.818 HG23 ' HB1' ' A' 1042 ' ' ALA . 25.8 m . . . . . 0 CA--C 1.536 0.42 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.518 ' O ' ' HG2' ' A' ' 985' ' ' GLU . 12.2 m170 -50.56 -40.54 52.39 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -177.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . 0.467 ' HA ' ' CG ' ' A' ' 985' ' ' GLU . 11.1 ptt180 -83.52 -18.75 37.37 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 -171.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.454 ' HG3' HG13 ' A' 1038 ' ' VAL . 0.4 OUTLIER -74.3 -34.6 63.57 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 171.7 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.899 HG21 ' HB2' ' A' ' 973' ' ' LEU . 1.8 mp -70.99 -32.75 49.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 176.058 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . 0.518 ' HG2' ' O ' ' A' ' 981' ' ' HIS . 64.5 mm-40 -57.6 -54.19 49.63 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.325 174.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 48.0 ttm -68.47 -45.59 72.03 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.246 -172.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.681 ' HB1' ' HB3' ' A' 1035 ' ' LEU . . . -68.69 -52.2 33.54 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.299 -0.864 . . . . 0.0 112.737 -171.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.768 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 3.3 pt20 -65.13 -26.98 68.42 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 119.759 -0.776 . . . . 0.0 111.446 -177.156 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . 0.821 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 54.9 mtpt -75.15 -42.31 56.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.282 0.563 . . . . 0.0 111.697 175.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.546 HD23 HD11 ' A' 1035 ' ' LEU . 39.3 tp -54.0 -58.19 8.25 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -178.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.881 HD11 ' HA ' ' A' 1028 ' ' LEU . 11.4 tp -68.3 -23.12 64.7 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 120.336 -0.545 . . . . 0.0 110.169 179.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . 0.821 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 25.2 t-20 -51.77 -54.13 32.05 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.82 174.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 6.8 p -76.49 -26.1 54.95 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.355 177.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -64.19 -52.46 58.79 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.323 0.582 . . . . 0.0 110.198 177.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 0.881 HD13 HD21 ' A' ' 962' ' ' LEU . 0.3 OUTLIER -51.95 -28.36 16.34 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.704 168.598 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -70.29 -35.77 73.93 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 118.789 -1.164 . . . . 0.0 111.291 176.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.546 ' O ' ' HD3' ' A' 1001 ' ' LYS . 3.9 pt-20 -78.06 -29.51 49.25 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 121.134 -0.979 . . . . 0.0 110.912 175.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.842 HD22 HD11 ' A' 1028 ' ' LEU . 0.1 OUTLIER -56.15 -47.08 78.91 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 121.296 0.569 . . . . 0.0 110.062 178.513 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.502 ' O ' ' HB2' ' A' 1003 ' ' LYS . 75.2 mt -70.66 -32.99 51.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 114.927 -1.033 . . . . 0.0 111.522 -174.552 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -65.46 -41.29 93.55 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.995 0.426 . . . . 0.0 111.879 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.546 ' HD3' ' O ' ' A' ' 997' ' ' GLU . 0.6 OUTLIER -78.39 -34.56 48.09 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 122.332 1.063 . . . . 0.0 108.742 -178.964 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.989 ' HG2' ' HB3' ' A' ' 951' ' ' TYR . 12.5 ttt -62.57 -27.74 69.39 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 113.977 -1.465 . . . . 0.0 109.046 176.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.502 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 2.6 tptp -74.84 -53.05 9.81 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 113.753 -1.567 . . . . 0.0 110.623 -167.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.561 ' HA ' ' HG2' ' A' 1007 ' ' GLN . 7.4 mp -75.15 -12.32 60.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.87 -179.024 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.754 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -70.28 -50.03 43.67 Favored 'General case' 0 C--O 1.216 -0.698 0 C-N-CA 119.364 -0.934 . . . . 0.0 109.747 177.316 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.927 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.3 pp0? -71.71 -30.64 65.87 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 174.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.561 ' HG2' ' HA ' ' A' 1004 ' ' LEU . 4.7 pt20 -57.87 -48.15 80.65 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 119.989 -0.684 . . . . 0.0 109.703 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.663 ' HB2' HD12 ' A' 1013 ' ' LEU . 14.0 m-30 -115.22 42.01 2.32 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 173.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 1.033 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 12.4 p -54.0 -24.56 11.14 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.301 0 CA-C-O 122.319 1.057 . . . . 0.0 109.743 173.259 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 49.3 mtt -55.96 -20.72 17.39 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 113.687 -1.597 . . . . 0.0 111.529 174.294 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1011 ' ' THR . . . . . 0.542 ' HB ' ' H ' ' A' 1012 ' ' SER . 16.9 p -142.87 -153.08 0.44 Allowed 'General case' 0 C--O 1.262 1.713 0 CA-C-O 123.596 1.665 . . . . 0.0 115.276 -172.068 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1012 ' ' SER . . . . . 0.542 ' H ' ' HB ' ' A' 1011 ' ' THR . 26.2 p -55.04 -37.99 67.4 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 113.048 -1.887 . . . . 0.0 112.743 -173.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1013 ' ' LEU . . . . . 0.74 ' O ' ' HB2' ' A' 1017 ' ' TYR . 6.6 mt -52.9 -40.32 63.44 Favored 'General case' 0 CA--C 1.494 -1.185 0 C-N-CA 120.196 -0.602 . . . . 0.0 110.507 178.14 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 1.033 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.09 -53.7 49.56 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-O 121.699 0.761 . . . . 0.0 109.398 -173.952 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.508 ' O ' ' HD3' ' A' 1019 ' ' LYS . 0.9 OUTLIER -72.61 -41.14 65.89 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 114.587 -1.188 . . . . 0.0 112.231 -177.273 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -70.64 -55.47 8.69 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 122.818 0.447 . . . . 0.0 112.041 -178.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.754 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 7.3 m-85 -62.11 -33.33 74.25 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -177.205 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.631 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 54.3 tptt -78.93 -27.8 43.74 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.492 -177.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . 0.508 ' HD3' ' O ' ' A' 1015 ' ' GLN . 4.3 mptp? -71.68 -50.23 32.33 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 172.183 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . 0.409 ' HB3' ' HG2' ' A' 1001 ' ' LYS . 48.5 mt-30 -52.23 -31.41 32.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.83 165.241 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.568 ' HG3' ' CB ' ' A' 1002 ' ' MET . 2.3 ttp -67.81 -49.23 63.45 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 178.252 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . 0.769 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -81.92 -8.58 59.69 Favored 'General case' 0 C--O 1.218 -0.586 0 C-N-CA 118.987 -1.085 . . . . 0.0 109.41 -177.16 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 52.4 m -76.8 -45.74 27.64 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.718 171.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.56 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -74.85 -21.46 59.25 Favored 'General case' 0 C--O 1.213 -0.845 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 173.459 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.77 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -84.56 -25.94 28.34 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.223 172.428 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.466 ' O ' HG23 ' A' 1030 ' ' VAL . 42.4 t-80 -78.32 -22.71 47.69 Favored 'General case' 0 C--O 1.214 -0.793 0 O-C-N 121.845 -0.534 . . . . 0.0 109.641 167.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -69.84 -42.55 73.45 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 123.421 0.688 . . . . 0.0 109.82 162.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.881 ' HA ' HD11 ' A' ' 991' ' ' LEU . 49.7 mt -56.12 -50.05 72.17 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 168.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . 0.441 ' HA ' HG22 ' A' ' 933' ' ' VAL . . . -59.6 -43.48 93.7 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 175.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' 1026 ' ' HIS . 3.7 t -66.98 -50.82 60.92 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.305 0 CA-C-O 121.019 0.438 . . . . 0.0 110.564 -176.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.617 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 4.0 m-20 -76.36 -29.1 57.06 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.83 -178.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.531 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -67.22 -27.43 67.23 Favored 'General case' 0 C--N 1.321 -0.645 0 O-C-N 121.426 -0.796 . . . . 0.0 109.749 172.344 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.457 ' C ' ' HD3' ' A' 1033 ' ' LYS . 12.7 tmtt? -70.36 -51.86 26.76 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 167.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.617 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 36.1 t30 -63.37 -56.66 14.55 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 114.838 -1.074 . . . . 0.0 112.569 -174.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.681 ' HB3' ' HB1' ' A' ' 987' ' ' ALA . 0.2 OUTLIER -60.24 -35.85 76.41 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.775 -0.193 . . . . 0.0 110.578 -179.865 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.538 ' C ' HD23 ' A' 1036 ' ' LEU . 0.8 OUTLIER -67.57 -47.27 70.27 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 118.987 -1.085 . . . . 0.0 108.712 179.122 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.5 ' O ' ' HB2' ' A' 1041 ' ' GLN . 13.4 t70 -51.32 -28.35 11.99 Favored 'General case' 0 C--O 1.215 -0.729 0 CA-C-N 113.873 -1.512 . . . . 0.0 109.977 172.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.557 ' HB ' ' O ' ' A' 1035 ' ' LEU . 30.1 t -75.19 -29.95 22.36 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.536 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.778 178.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.545 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 1.8 mp -85.78 -34.75 8.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 CA-C-N 118.221 0.464 . . . . 0.0 111.577 172.094 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.65 -42.86 93.75 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 167.221 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . 0.5 ' HB2' ' O ' ' A' 1037 ' ' ASP . 1.7 mt-30 -58.53 -54.09 51.02 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.894 168.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.818 ' HB1' HG23 ' A' ' 980' ' ' THR . . . -53.19 -47.12 69.14 Favored 'General case' 0 CA--C 1.499 -1.017 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.735 -170.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.466 ' HG2' ' O ' ' A' 1039 ' ' ILE . 13.8 ptp180 -67.56 -46.69 71.96 Favored 'General case' 0 N--CA 1.432 -1.364 0 C-N-CA 119.91 -0.716 . . . . 0.0 110.668 -172.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 36.5 mt . . . . . 0 CA--C 1.531 0.231 0 C-N-CA 120.233 -0.587 . . . . 0.0 112.069 -178.646 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.704 ' HG3' HG21 ' A' ' 968' ' ' THR . 17.9 tppt? . . . . . 0 CA--C 1.535 0.385 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.62 ' O ' HG23 ' A' ' 929' ' ' VAL . 12.3 t -65.7 -28.22 43.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.191 0.52 . . . . 0.0 110.691 177.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -75.94 -26.42 56.87 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.398 0.679 . . . . 0.0 111.66 -177.514 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . 0.515 ' O ' HG22 ' A' ' 930' ' ' THR . 7.8 pt-20 -76.74 -24.13 53.01 Favored 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 118.743 -1.183 . . . . 0.0 109.853 172.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.47 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 1.7 m120 -71.33 -30.72 66.54 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 170.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.62 HG23 ' O ' ' A' ' 925' ' ' VAL . 68.6 t -80.88 -30.53 11.88 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-N 114.811 -1.086 . . . . 0.0 111.68 177.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.515 HG22 ' O ' ' A' ' 927' ' ' GLU . 3.6 t -66.29 -30.8 71.3 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 120.222 1.374 . . . . 0.0 107.759 170.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -72.53 -52.73 9.6 Favored Glycine 0 CA--C 1.526 0.727 0 CA-C-N 115.35 -0.841 . . . . 0.0 113.239 175.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.547 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.1 pp -66.99 -49.35 65.64 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -177.372 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.576 HG22 ' HA ' ' A' 1029 ' ' ALA . 79.0 t -68.42 -37.18 77.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-O 121.038 0.446 . . . . 0.0 111.151 -174.267 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.43 ' O ' ' HB2' ' A' ' 938' ' ' GLU . 30.2 ttpt -58.26 -46.31 86.24 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.159 179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -56.17 -36.68 68.61 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.671 176.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.792 HG22 ' HB1' ' A' 1025 ' ' ALA . 85.0 t -52.85 -75.45 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-O 121.12 0.486 . . . . 0.0 112.086 -178.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 30.7 pt -68.01 -41.68 84.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.328 -176.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.43 ' HB2' ' O ' ' A' ' 934' ' ' LYS . 9.2 mm-40 -64.49 -49.63 70.6 Favored 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.908 -174.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 25.0 mmt -74.53 -24.94 59.03 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.336 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.59 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 24.8 p . . . . . 0 N--CA 1.465 0.291 0 CA-C-O 121.384 0.611 . . . . 0.0 111.078 -174.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.787 ' HB3' ' HB2' ' A' 1002 ' ' MET . 35.3 m-85 . . . . . 0 C--O 1.21 -0.974 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 0.657 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.1 OUTLIER -63.07 -52.88 59.55 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.859 174.097 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 0.657 ' HD3' HG13 ' A' ' 952' ' ' VAL . 0.5 OUTLIER -46.26 -43.68 20.93 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 121.936 1.757 . . . . 0.0 113.309 161.322 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.734 ' HB3' ' HA ' ' A' ' 951' ' ' TYR . 27.3 tpp -60.83 -33.49 73.12 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.794 0.33 . . . . 0.0 110.859 176.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.628 HG23 ' HA ' ' A' ' 952' ' ' VAL . 60.0 t -51.84 -40.1 26.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.249 -0.432 . . . . 0.0 109.946 172.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.599 ' HD3' ' HA ' ' A' ' 953' ' ' PRO . 3.2 mptp? -66.59 -36.73 83.33 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.735 0.302 . . . . 0.0 110.862 175.688 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -79.85 -45.45 18.66 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.186 -0.461 . . . . 0.0 112.125 -172.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.428 HG12 ' O ' ' A' ' 954' ' ' MET . 11.8 p -84.26 -26.34 7.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -65.02 -30.77 78.86 Favored Glycine 0 N--CA 1.442 -0.944 0 N-CA-C 110.03 -1.228 . . . . 0.0 110.03 169.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . 0.614 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 19.5 tp -71.08 -38.59 72.43 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.305 -0.448 . . . . 0.0 110.097 176.029 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.535 ' HB1' ' HB3' ' A' ' 932' ' ' LEU . . . -72.46 -39.7 67.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.905 0.383 . . . . 0.0 111.109 -174.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.454 HD22 HD22 ' A' ' 995' ' ' LEU . 0.0 OUTLIER -70.18 -40.53 74.61 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-O 119.095 -0.478 . . . . 0.0 110.873 173.346 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.614 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 4.6 ptp180 -67.03 -31.38 71.86 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 118.735 -1.186 . . . . 0.0 110.306 178.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . 0.496 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 40.5 m -68.62 -40.96 80.13 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.127 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.624 HD22 HD11 ' A' ' 991' ' ' LEU . 0.1 OUTLIER -63.76 -39.58 94.63 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 114.062 -1.426 . . . . 0.0 110.92 175.535 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.618 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.2 tt -76.17 -35.08 59.32 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 -172.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . 0.413 ' O ' ' HB2' ' A' ' 971' ' ' GLU . . . -72.08 -31.07 65.74 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.393 178.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.704 HG21 ' HG3' ' A' ' 924' ' ' LYS . 13.6 p -70.6 -41.58 72.12 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 118.347 0.521 . . . . 0.0 110.301 174.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 1.026 HG12 HG23 ' A' ' 984' ' ' ILE . 61.2 t -68.52 -38.19 78.82 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.991 172.494 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.58 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 16.5 t70 -68.06 -39.54 82.97 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.965 0.888 . . . . 0.0 108.88 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.625 ' O ' HG23 ' A' ' 975' ' ' VAL . 37.5 tt0 -65.74 -32.92 74.73 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.272 -1.331 . . . . 0.0 109.672 177.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.444 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 71.9 m -66.97 -17.81 65.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.979 175.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.752 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 8.5 tt -68.57 -52.39 19.64 Favored Pre-proline 0 CA--C 1.534 0.33 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 -178.314 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.752 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 5.7 Cg_exo -81.89 0.62 9.74 Favored 'Trans proline' 0 C--N 1.354 0.857 0 C-N-CA 121.478 1.452 . . . . 0.0 112.908 173.033 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.625 HG23 ' O ' ' A' ' 971' ' ' GLU . 17.5 t . . . . . 0 C--N 1.329 -0.291 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 170.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . . . . . . . . . 1.9 m . . . . . 0 N--CA 1.473 0.703 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.712 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 19.2 p80 -50.2 -32.04 15.38 Favored 'General case' 0 C--O 1.214 -0.782 0 C-N-CA 121.135 -0.226 . . . . 0.0 111.54 174.39 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -82.81 -20.51 35.58 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 121.147 -0.221 . . . . 0.0 111.069 -173.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.01 -34.47 57.41 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 169.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 1.026 HG23 HG12 ' A' ' 969' ' ' VAL . 69.0 mt -70.05 -32.82 52.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 114.913 -1.039 . . . . 0.0 109.441 177.339 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . 0.712 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 42.0 mt-10 -66.01 -51.62 56.68 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.312 177.477 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 18.2 mmt -71.58 -41.73 68.64 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.909 -172.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.999 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -75.56 -51.54 12.67 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.357 -0.838 . . . . 0.0 113.25 -171.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.71 ' O ' ' HB2' ' A' ' 992' ' ' ASN . 2.3 pt20 -62.42 -28.35 69.73 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 119.649 -0.82 . . . . 0.0 109.703 179.046 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . 0.71 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 21.0 tttm -69.48 -40.82 76.84 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.323 -0.853 . . . . 0.0 112.204 170.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.451 ' HB3' ' O ' ' A' ' 987' ' ' ALA . 17.2 tp -50.5 -60.36 3.09 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.47 -0.786 . . . . 0.0 113.032 -176.438 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.734 HD22 HD13 ' A' 1035 ' ' LEU . 1.5 pt? -76.55 -20.42 56.88 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-O 121.508 0.671 . . . . 0.0 109.826 -178.305 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . 0.71 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 50.3 t-20 -50.9 -53.97 28.07 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 114.424 -1.262 . . . . 0.0 110.876 175.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 3.7 m -73.75 -34.75 64.86 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 120.792 -0.363 . . . . 0.0 111.741 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . 0.412 ' O ' ' HB2' ' A' ' 997' ' ' GLU . 0.3 OUTLIER -66.91 -32.93 74.51 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 119.829 -0.748 . . . . 0.0 111.904 178.272 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 0.622 ' N ' HD21 ' A' 1028 ' ' LEU . 3.3 tt -69.6 -20.89 63.62 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 122.222 0.209 . . . . 0.0 110.697 170.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -75.76 -26.33 57.31 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 119.671 -0.811 . . . . 0.0 109.665 170.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.606 ' O ' ' HG2' ' A' 1001 ' ' LYS . 56.0 mm-40 -71.33 -46.23 61.09 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 171.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.76 HD22 HD11 ' A' 1028 ' ' LEU . 0.0 OUTLIER -55.38 -45.76 76.57 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.713 -177.404 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.585 ' HA ' ' HG2' ' A' 1002 ' ' MET . 85.6 mt -65.08 -37.74 80.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.356 -175.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 26.6 m-80 -61.33 -40.32 93.8 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.176 0.512 . . . . 0.0 111.457 177.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.606 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 51.1 mmtt -76.38 -45.23 32.76 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.942 0.877 . . . . 0.0 108.998 -171.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.787 ' HB2' ' HB3' ' A' ' 951' ' ' TYR . 14.5 ptp -62.25 -30.5 71.16 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.88 -1.054 . . . . 0.0 109.026 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.564 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 6.0 tptm -64.55 -53.02 54.41 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.35 -167.376 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.724 ' HB3' HD13 ' A' 1013 ' ' LEU . 7.2 mp -75.34 -13.82 60.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.876 -178.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.654 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -67.95 -43.7 78.48 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.099 -178.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.938 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -77.13 -23.82 51.71 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.349 -0.541 . . . . 0.0 111.485 174.373 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -52.89 -47.72 67.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.361 0.601 . . . . 0.0 110.638 174.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.639 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 74.6 m-85 -121.5 38.72 4.02 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.988 174.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 1.06 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 11.9 p -48.61 -23.07 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.665 173.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 1.4 mpt? -37.38 -49.92 1.02 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.108 0.88 . . . . 0.0 111.328 173.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1011 ' ' THR . . . . . . . . . . . . . 71.4 m -163.56 -77.95 0.04 OUTLIER 'General case' 0 C--O 1.243 0.744 0 CA-C-O 121.125 0.488 . . . . 0.0 111.92 175.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1012 ' ' SER . . . . . 0.474 ' O ' ' HG2' ' A' 1015 ' ' GLN . 6.3 m -50.55 -76.43 0.02 OUTLIER 'General case' 0 C--O 1.241 0.624 0 CA-C-N 115.278 -0.874 . . . . 0.0 113.297 -166.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1013 ' ' LEU . . . . . 0.724 HD13 ' HB3' ' A' 1004 ' ' LEU . 2.8 mt -46.91 -42.57 17.84 Favored 'General case' 0 CA--C 1.501 -0.917 0 N-CA-C 113.569 0.951 . . . . 0.0 113.569 -178.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 1.06 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -55.68 -43.85 76.78 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.905 -166.907 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.474 ' HG2' ' O ' ' A' 1012 ' ' SER . 24.3 pt20 -75.73 -40.79 54.99 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.814 -175.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -69.97 -53.63 16.93 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.487 0.66 . . . . 0.0 110.54 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.682 ' CE2' HD22 ' A' 1013 ' ' LEU . 7.8 m-85 -63.86 -35.77 81.73 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.865 -1.061 . . . . 0.0 113.263 -173.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.722 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 21.4 tptm -80.63 -28.0 37.08 Favored 'General case' 0 N--CA 1.458 -0.066 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.292 -177.424 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . 0.416 ' O ' HD23 ' A' 1022 ' ' LEU . 11.9 mptt -73.38 -51.55 16.95 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 175.585 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -50.79 -34.99 29.7 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.265 163.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.622 ' HG3' ' HB3' ' A' 1002 ' ' MET . 1.7 tmt? -65.34 -50.72 64.53 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 110.28 -0.266 . . . . 0.0 110.28 175.551 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . 0.739 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -77.5 -6.58 54.09 Favored 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 119.328 -0.949 . . . . 0.0 109.788 -175.712 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 86.5 m -80.05 -44.44 20.08 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 173.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.49 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.29 -20.76 50.9 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-O 121.309 0.576 . . . . 0.0 109.543 175.281 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.792 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -84.17 -25.19 29.76 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.17 170.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.58 ' O ' HG23 ' A' 1030 ' ' VAL . 16.1 t-80 -76.05 -26.47 56.6 Favored 'General case' 0 C--O 1.215 -0.737 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 165.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . 0.476 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -66.03 -43.34 87.84 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 122.962 0.505 . . . . 0.0 110.297 162.274 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.76 HD11 HD22 ' A' ' 998' ' ' LEU . 17.0 mt -59.37 -46.1 89.6 Favored 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 120.399 -0.52 . . . . 0.0 109.615 171.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . 0.627 ' O ' ' HB2' ' A' 1033 ' ' LYS . . . -57.45 -40.18 77.89 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.128 173.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.58 HG23 ' O ' ' A' 1026 ' ' HIS . 12.2 t -69.77 -51.45 40.71 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 CA-C-O 121.407 0.622 . . . . 0.0 110.644 -177.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.436 ' O ' ' HB3' ' A' 1035 ' ' LEU . 71.4 m-20 -75.11 -30.82 60.97 Favored 'General case' 0 C--O 1.221 -0.444 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.535 -173.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.818 ' HA ' HD22 ' A' 1035 ' ' LEU . . . -72.99 -35.46 66.87 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.841 0.353 . . . . 0.0 110.129 173.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.627 ' HB2' ' O ' ' A' 1029 ' ' ALA . 53.2 tttt -63.68 -46.24 86.44 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.944 0.878 . . . . 0.0 108.988 172.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.429 ' O ' HG23 ' A' 1038 ' ' VAL . 12.6 t30 -68.93 -51.84 35.58 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 113.996 -1.456 . . . . 0.0 112.485 -177.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.999 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 0.2 OUTLIER -59.24 -40.85 87.23 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 117.782 0.265 . . . . 0.0 111.139 -171.713 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.506 ' HG ' ' HB ' ' A' ' 925' ' ' VAL . 1.5 tm? -68.13 -47.56 67.79 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 118.574 -1.251 . . . . 0.0 109.289 -178.04 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 14.8 t70 -47.16 -45.92 23.1 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.363 171.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.47 ' HB ' ' O ' ' A' 1035 ' ' LEU . 22.4 t -56.18 -42.52 73.41 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.633 0 CA-C-N 113.912 -1.495 . . . . 0.0 112.818 177.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.587 HG12 HG12 ' A' ' 984' ' ' ILE . 1.6 mp -81.26 -31.77 11.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 119.304 0.956 . . . . 0.0 111.288 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.416 ' O ' ' HG3' ' A' 1043 ' ' ARG . 3.0 m-20 -59.38 -41.25 88.92 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 167.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -71.94 -37.57 69.97 Favored 'General case' 0 C--O 1.215 -0.737 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.578 173.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.533 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -53.29 -55.56 23.63 Favored 'General case' 0 CA--C 1.499 -0.988 0 C-N-CA 123.468 0.707 . . . . 0.0 111.566 -179.241 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.441 HH11 ' HD2' ' A' 1043 ' ' ARG . 0.0 OUTLIER -63.45 -37.36 86.98 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.34 -175.56 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 2.8 tm? . . . . . 0 N--CA 1.438 -1.047 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.164 178.03 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.586 ' HB2' HG21 ' A' ' 968' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.735 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.777 ' HA ' HD21 ' A' ' 928' ' ' ASN . 4.2 p -59.84 -34.53 56.18 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 CA-C-N 119.708 1.14 . . . . 0.0 110.942 167.019 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 2.4 p90 -77.23 -28.13 53.6 Favored 'General case' 0 CA--C 1.506 -0.737 0 O-C-N 121.601 -0.687 . . . . 0.0 109.394 174.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.85 -24.88 48.45 Favored 'General case' 0 C--N 1.307 -1.282 0 C-N-CA 118.698 -1.201 . . . . 0.0 113.962 178.243 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.777 HD21 ' HA ' ' A' ' 925' ' ' VAL . 13.0 p30 -72.21 -27.66 62.69 Favored 'General case' 0 C--N 1.317 -0.807 0 C-N-CA 118.661 -1.216 . . . . 0.0 108.992 166.06 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.787 HG22 ' HB1' ' A' 1032 ' ' ALA . 71.6 t -76.61 -30.7 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.137 179.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . . . . . . . . . 26.8 m -61.2 -42.9 99.4 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 172.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -67.12 -52.72 30.38 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-N 114.61 -1.177 . . . . 0.0 113.808 176.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.62 ' HB3' ' HB1' ' A' ' 961' ' ' ALA . 2.4 pp -64.67 -49.47 70.85 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -174.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.531 ' O ' ' HB ' ' A' ' 936' ' ' VAL . 54.3 t -64.2 -37.84 80.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-O 121.311 0.576 . . . . 0.0 110.663 -176.146 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.404 ' O ' ' HB3' ' A' ' 938' ' ' GLU . 19.2 ttpp -59.87 -51.42 69.8 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.08 178.064 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -51.81 -39.69 59.17 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 111.672 0.249 . . . . 0.0 111.672 178.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.909 HG22 ' HB1' ' A' 1025 ' ' ALA . 92.0 t -46.73 -76.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 O-C-N 123.747 0.654 . . . . 0.0 111.852 177.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.448 HG13 ' N ' ' A' ' 938' ' ' GLU . 26.9 pt -68.66 -40.7 82.05 Favored 'Isoleucine or valine' 0 C--O 1.244 0.788 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -176.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.448 ' N ' HG13 ' A' ' 937' ' ' ILE . 30.8 tt0 -61.47 -52.86 62.77 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.117 -171.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 85.7 mtp -76.23 -26.93 56.55 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 119.782 -0.767 . . . . 0.0 110.721 -178.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.634 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 28.5 t . . . . . 0 CA--C 1.52 -0.21 0 O-C-N 123.925 0.766 . . . . 0.0 112.502 -170.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.868 ' CD1' ' HB3' ' A' 1006 ' ' GLN . 0.8 OUTLIER . . . . . 0 C--O 1.223 -0.324 0 CA-C-O 120.72 0.295 . . . . 0.0 110.509 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 0.797 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 26.6 t -59.5 -54.13 59.04 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.963 174.16 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 0.797 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 34.7 Cg_exo -49.01 -41.51 40.03 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 122.059 1.839 . . . . 0.0 112.628 171.535 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . . . . . . . . . 27.0 ttt -64.36 -38.25 90.38 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.376 175.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.747 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 35.1 t -52.25 -47.44 45.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.378 169.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -64.21 -29.89 70.98 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.27 177.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -78.26 -46.07 21.23 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 121.151 0.5 . . . . 0.0 111.012 -174.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . . . . . . . . . 14.8 p -81.66 -26.48 9.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.482 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -67.05 -34.49 86.9 Favored Glycine 0 N--CA 1.447 -0.59 0 N-CA-C 110.493 -1.043 . . . . 0.0 110.493 171.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . 0.577 HD12 ' HD2' ' A' ' 963' ' ' ARG . 20.2 tp -63.88 -30.39 71.48 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.288 -0.456 . . . . 0.0 110.213 175.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.62 ' HB1' ' HB3' ' A' ' 932' ' ' LEU . . . -76.41 -56.86 4.25 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.105 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.624 HD22 HD12 ' A' ' 995' ' ' LEU . 0.2 OUTLIER -44.07 -47.35 8.85 Favored 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 169.22 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.577 ' HD2' HD12 ' A' ' 960' ' ' LEU . 9.5 ptp180 -69.79 -27.18 64.68 Favored 'General case' 0 C--N 1.32 -0.699 0 O-C-N 120.848 -1.158 . . . . 0.0 110.831 179.159 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . 0.484 HG22 ' HB3' ' A' ' 928' ' ' ASN . 93.0 m -68.94 -32.78 72.63 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 171.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.743 HD22 HD23 ' A' ' 991' ' ' LEU . 0.2 OUTLIER -65.44 -41.87 92.99 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.073 172.721 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.546 ' HG ' HE21 ' A' ' 988' ' ' GLN . 5.1 tt -69.98 -42.91 72.48 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.415 -0.811 . . . . 0.0 108.95 -174.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -66.99 -44.07 81.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.258 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.586 HG21 ' HB2' ' A' ' 924' ' ' LYS . 19.4 p -62.38 -48.48 79.57 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.77 0.319 . . . . 0.0 111.224 179.455 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 1.073 HG12 HG23 ' A' ' 984' ' ' ILE . 45.7 t -72.68 -31.43 37.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.81 178.393 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.823 ' HB2' HE22 ' A' ' 988' ' ' GLN . 15.1 t70 -69.96 -40.87 75.16 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 178.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.581 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 31.2 tt0 -64.79 -34.23 77.87 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 114.013 -1.449 . . . . 0.0 109.258 178.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.515 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 61.6 m -71.36 -18.81 62.35 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.324 178.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.747 ' HB2' HG21 ' A' ' 984' ' ' ILE . 9.7 tt -65.27 -49.78 63.08 Favored Pre-proline 0 CA--C 1.532 0.254 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.482 -176.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.702 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 4.9 Cg_exo -81.84 -9.68 11.93 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 121.659 1.573 . . . . 0.0 113.058 171.16 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.569 HG23 ' O ' ' A' ' 971' ' ' GLU . 25.4 t . . . . . 0 C--N 1.331 -0.212 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 171.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.524 HG23 ' HB1' ' A' 1042 ' ' ALA . 54.6 m . . . . . 0 CA--C 1.531 0.225 0 CA-C-O 121.936 0.874 . . . . 0.0 109.366 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.634 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 2.8 t60 -56.9 -35.09 68.58 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 114.187 -1.37 . . . . 0.0 111.427 178.486 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 6.0 ptp180 -84.54 -19.46 33.15 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -174.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.633 ' HG3' HG13 ' A' 1038 ' ' VAL . 0.4 OUTLIER -75.55 -33.98 60.71 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 121.903 0.859 . . . . 0.0 108.785 171.542 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 1.073 HG23 HG12 ' A' ' 969' ' ' VAL . 62.1 mt -72.95 -29.24 28.57 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.893 0 CA-C-N 114.219 -1.355 . . . . 0.0 109.596 177.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . 0.634 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 57.6 mt-10 -63.27 -47.87 80.55 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.512 0.672 . . . . 0.0 109.844 172.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . 0.511 ' HG2' HD13 ' A' ' 990' ' ' LEU . 54.0 ttm -71.64 -47.38 54.79 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.88 -172.39 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.861 ' HA ' ' HG ' ' A' 1035 ' ' LEU . . . -61.1 -50.61 72.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.785 -175.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.823 HE22 ' HB2' ' A' ' 970' ' ' ASP . 53.4 mt-30 -56.99 -30.67 64.34 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.0 0.429 . . . . 0.0 110.696 177.056 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . 0.733 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 1.9 ttmt -79.09 -40.33 31.44 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 -178.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.511 HD13 ' HG2' ' A' ' 986' ' ' MET . 3.1 mp -60.33 -54.05 50.29 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 119.552 -0.859 . . . . 0.0 112.867 -178.119 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.743 HD23 HD22 ' A' ' 965' ' ' LEU . 11.7 tp -65.64 -26.44 67.81 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.061 -0.656 . . . . 0.0 109.401 177.225 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . 0.733 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 23.8 t-20 -52.97 -57.74 9.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.632 178.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 13.4 m -80.42 -36.3 33.91 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -175.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.43 -36.7 84.71 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 119.386 -0.926 . . . . 0.0 111.268 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 0.689 ' N ' HD21 ' A' 1028 ' ' LEU . 2.3 tm? -68.16 -24.79 65.02 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.308 171.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -71.61 -28.7 63.98 Favored 'General case' 0 C--N 1.316 -0.86 0 C-N-CA 119.283 -0.967 . . . . 0.0 109.978 170.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -76.26 -37.66 57.3 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 110.415 -0.217 . . . . 0.0 110.415 173.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.889 HD12 ' HB2' ' A' 1025 ' ' ALA . 1.1 tt -56.6 -46.77 80.68 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.293 0.568 . . . . 0.0 110.855 178.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.511 ' N ' HD23 ' A' ' 998' ' ' LEU . 84.7 mt -65.95 -46.76 87.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.722 -172.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -56.38 -40.28 74.32 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.333 0.587 . . . . 0.0 111.552 -177.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.688 ' HD3' ' HG2' ' A' 1020 ' ' GLN . 96.8 mttt -84.88 -33.92 22.7 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.79 -173.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.68 ' SD ' ' HE3' ' A' 1018 ' ' LYS . 5.3 ttp -62.4 -30.31 71.12 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 122.351 1.072 . . . . 0.0 108.574 173.267 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.504 ' O ' ' HG3' ' A' 1006 ' ' GLN . 3.8 tptm -67.38 -53.03 32.94 Favored 'General case' 0 N--CA 1.439 -0.975 0 CA-C-N 113.777 -1.556 . . . . 0.0 110.491 -171.001 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.69 ' HB3' HD23 ' A' 1013 ' ' LEU . 8.4 mp -69.95 -16.65 63.24 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.815 -179.356 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.719 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -70.98 -39.45 72.47 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 119.344 -0.942 . . . . 0.0 110.219 -178.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.887 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.4 pp0? -74.75 -32.95 62.23 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 120.384 -0.526 . . . . 0.0 111.328 167.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.627 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 28.5 mt-30 -50.92 -44.51 60.13 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.258 0.551 . . . . 0.0 110.379 176.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.739 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 49.7 m-85 -122.2 41.1 3.49 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.561 172.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 1.052 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 14.9 p -50.52 -21.18 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.646 171.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1010 ' ' MET . . . . . 0.501 ' O ' HG23 ' A' 1011 ' ' THR . 97.0 mmm -38.7 -50.32 1.63 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.33 -1.304 . . . . 0.0 111.381 172.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1011 ' ' THR . . . . . 0.501 HG23 ' O ' ' A' 1010 ' ' MET . 0.7 OUTLIER -163.68 -86.15 0.02 OUTLIER 'General case' 0 C--O 1.246 0.897 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 179.369 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 42.5 t -54.02 -67.46 0.26 Allowed 'General case' 0 C--O 1.238 0.474 0 CA-C-N 114.786 -1.097 . . . . 0.0 112.605 -166.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1013 ' ' LEU . . . . . 0.739 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 6.8 mp -50.09 -42.39 50.13 Favored 'General case' 0 CA--C 1.5 -0.967 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 -179.189 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 1.052 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -53.47 -48.53 68.79 Favored 'General case' 0 N--CA 1.442 -0.827 0 O-C-N 123.65 0.594 . . . . 0.0 111.222 -166.866 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 27.0 pt20 -74.45 -45.56 45.49 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.262 -176.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -66.53 -53.14 38.16 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.495 0.664 . . . . 0.0 110.751 -178.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.719 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 15.9 m-85 -62.93 -37.63 87.8 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 114.628 -1.169 . . . . 0.0 113.37 -174.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.68 ' HE3' ' SD ' ' A' 1002 ' ' MET . 17.3 tptm -81.54 -29.1 33.62 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.988 -177.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . 0.433 ' O ' HD23 ' A' 1022 ' ' LEU . 4.5 mptp? -74.27 -51.74 14.41 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 174.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . 0.688 ' HG2' ' HD3' ' A' 1001 ' ' LYS . 10.5 tt0 -51.02 -34.47 29.62 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.07 163.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.635 ' HE2' ' HE2' ' A' 1018 ' ' LYS . 9.9 tmm? -62.87 -50.55 70.47 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 174.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . 0.89 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -80.11 -2.83 46.21 Favored 'General case' 0 C--O 1.221 -0.445 0 C-N-CA 119.276 -0.97 . . . . 0.0 109.858 -176.811 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 88.5 m -84.57 -39.56 18.59 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 171.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.514 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.21 -21.16 50.44 Favored 'General case' 0 C--O 1.22 -0.486 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 172.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.909 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -85.03 -25.11 27.86 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.137 170.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.582 ' O ' HG23 ' A' 1030 ' ' VAL . 61.0 t60 -75.78 -23.91 55.95 Favored 'General case' 0 C--O 1.217 -0.61 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 164.365 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -71.01 -39.98 72.09 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 123.057 0.543 . . . . 0.0 109.8 164.118 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.697 HD12 HD13 ' A' ' 998' ' ' LEU . 15.0 mt -62.47 -44.7 95.77 Favored 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.104 170.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -60.01 -36.43 77.19 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 111.286 0.106 . . . . 0.0 111.286 173.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.582 HG23 ' O ' ' A' 1026 ' ' HIS . 8.8 t -70.35 -50.81 43.4 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 CA-C-O 121.506 0.67 . . . . 0.0 109.795 -179.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -71.16 -42.35 69.23 Favored 'General case' 0 C--O 1.208 -1.101 0 CA-C-N 114.784 -1.098 . . . . 0.0 111.483 -175.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.787 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -66.8 -32.64 74.06 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.668 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 65.4 tttp -64.37 -49.82 70.12 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.747 0.784 . . . . 0.0 110.116 170.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.471 ' O ' HG23 ' A' 1038 ' ' VAL . 59.9 t30 -72.28 -38.74 68.72 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 114.826 -1.079 . . . . 0.0 112.018 -173.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.861 ' HG ' ' HA ' ' A' ' 987' ' ' ALA . 0.0 OUTLIER -64.83 -40.5 95.29 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 119.215 -0.421 . . . . 0.0 110.817 -177.498 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.551 ' HB3' HG22 ' A' ' 925' ' ' VAL . 4.2 pp -67.8 -39.57 84.0 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 117.232 -1.787 . . . . 0.0 110.177 174.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.08 -39.26 59.47 Favored 'General case' 0 C--N 1.344 0.328 0 CA-C-O 121.725 0.774 . . . . 0.0 110.207 172.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.633 HG13 ' HG3' ' A' ' 983' ' ' GLU . 12.3 t -57.91 -46.35 87.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 114.321 -1.309 . . . . 0.0 111.841 176.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.602 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 2.4 mp -73.91 -27.62 22.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 118.329 0.513 . . . . 0.0 111.484 174.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -64.45 -46.96 80.87 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.332 170.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -60.47 -46.09 91.34 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 172.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.602 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -55.49 -51.4 67.09 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.58 -175.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.519 ' HG2' ' O ' ' A' 1039 ' ' ILE . 4.8 ptp85 -62.07 -34.73 76.82 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.034 -173.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 12.9 mt . . . . . 0 C--N 1.321 -0.66 0 C-N-CA 119.201 -1.0 . . . . 0.0 111.635 174.731 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.821 ' HB3' HG21 ' A' ' 968' ' ' THR . 14.0 tppt? . . . . . 0 N--CA 1.447 -0.59 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.624 HG12 HD12 ' A' ' 965' ' ' LEU . 3.6 t -64.29 -43.36 97.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-N 118.79 0.723 . . . . 0.0 111.274 -172.726 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -78.69 -19.06 53.36 Favored 'General case' 0 CA--C 1.502 -0.89 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.66 -23.32 53.25 Favored 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 119.64 -0.824 . . . . 0.0 111.147 168.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.451 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 8.2 m120 -74.74 -27.53 60.4 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 168.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.668 HG22 ' HB1' ' A' 1032 ' ' ALA . 60.0 t -77.51 -30.95 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.258 176.224 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . . . . . . . . . 27.9 m -60.32 -41.36 93.35 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 171.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -68.72 -54.05 17.0 Favored Glycine 0 CA--C 1.526 0.761 0 CA-C-N 114.996 -1.002 . . . . 0.0 113.621 176.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.553 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.2 pp -63.44 -49.33 74.12 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -175.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 63.5 t -65.62 -36.84 78.56 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-O 121.112 0.482 . . . . 0.0 110.883 -175.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.651 ' O ' ' HB2' ' A' ' 938' ' ' GLU . 4.3 ttpm? -58.92 -46.58 87.58 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.178 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -55.3 -41.63 72.61 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 111.545 0.202 . . . . 0.0 111.545 176.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.771 HG22 ' HB1' ' A' 1025 ' ' ALA . 61.9 t -49.21 -75.49 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 123.206 0.603 . . . . 0.0 112.448 -177.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.425 HG13 ' N ' ' A' ' 938' ' ' GLU . 35.4 pt -74.3 -42.03 50.6 Favored 'Isoleucine or valine' 0 C--O 1.245 0.836 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -175.123 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.651 ' HB2' ' O ' ' A' ' 934' ' ' LYS . 25.4 mm-40 -60.86 -51.29 69.94 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.907 0.384 . . . . 0.0 110.529 -174.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 65.4 mtt -74.16 -26.52 60.35 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.861 -178.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.629 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 53.3 p . . . . . 0 CA--C 1.52 -0.202 0 O-C-N 123.705 0.628 . . . . 0.0 111.672 -170.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.659 ' CD1' ' HD3' ' A' 1018 ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.219 -0.552 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 0.998 HG23 ' HD3' ' A' ' 953' ' ' PRO . 0.9 OUTLIER -82.62 -39.22 0.83 Allowed Pre-proline 0 N--CA 1.453 -0.281 0 CA-C-O 119.219 -0.42 . . . . 0.0 111.415 176.175 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 0.998 ' HD3' HG23 ' A' ' 952' ' ' VAL . 35.8 Cg_exo -49.84 -42.15 45.05 Favored 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 121.417 1.412 . . . . 0.0 110.729 161.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.607 ' HG3' HG23 ' A' ' 958' ' ' VAL . 2.5 ttm -70.4 -28.96 65.49 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 113.831 -1.531 . . . . 0.0 111.846 177.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.88 HG23 ' HA ' ' A' ' 952' ' ' VAL . 76.0 t -53.39 -40.34 39.91 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 173.037 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.404 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 8.9 tmtt? -68.45 -33.17 73.72 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 114.973 -1.012 . . . . 0.0 111.723 173.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . 0.419 ' HB2' ' HA ' ' A' ' 954' ' ' MET . 6.9 mm-40 -78.35 -47.63 17.3 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -176.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.607 HG23 ' HG3' ' A' ' 954' ' ' MET . 2.7 t -84.54 -34.92 9.9 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.011 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 -178.143 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -59.8 -39.53 95.49 Favored Glycine 0 N--CA 1.434 -1.453 0 N-CA-C 110.636 -0.986 . . . . 0.0 110.636 178.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . 0.547 ' O ' ' HG2' ' A' ' 963' ' ' ARG . 9.1 tt -68.13 -36.17 79.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.348 -0.426 . . . . 0.0 110.626 175.276 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -76.25 -60.23 2.42 Favored 'General case' 0 C--N 1.321 -0.65 0 O-C-N 122.093 -0.379 . . . . 0.0 110.952 -174.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 1.108 HD13 HD22 ' A' ' 995' ' ' LEU . 3.4 pp -53.54 -34.13 57.11 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 112.435 0.531 . . . . 0.0 112.435 173.153 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.547 ' HG2' ' O ' ' A' ' 960' ' ' LEU . 3.7 ptm180 -71.83 -39.98 69.39 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 119.949 1.25 . . . . 0.0 111.166 174.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 38.3 m -61.24 -38.82 88.05 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 174.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.667 HD11 HD21 ' A' 1035 ' ' LEU . 0.3 OUTLIER -55.97 -54.72 41.42 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.66 174.738 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.667 ' HG ' HE21 ' A' ' 988' ' ' GLN . 5.2 tt -69.52 -34.68 74.62 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.164 -172.572 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . 0.418 ' O ' ' HB2' ' A' ' 971' ' ' GLU . . . -71.8 -29.16 64.15 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.807 178.108 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.821 HG21 ' HB3' ' A' ' 924' ' ' LYS . 23.7 m -71.99 -32.9 67.68 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 118.824 0.738 . . . . 0.0 109.79 172.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 1.003 HG12 HG23 ' A' ' 984' ' ' ILE . 24.3 t -70.24 -40.8 78.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.424 171.404 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.916 ' HB2' HE22 ' A' ' 988' ' ' GLN . 16.4 t70 -65.58 -42.1 92.13 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 122.301 1.048 . . . . 0.0 108.864 179.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.525 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 37.6 tt0 -62.16 -37.6 85.85 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 113.54 -1.664 . . . . 0.0 109.867 177.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 63.7 m -67.1 -18.76 65.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.085 176.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.63 ' HG ' ' HB2' ' A' ' 981' ' ' HIS . 9.4 tt -68.69 -51.74 20.56 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.648 -172.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.549 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 95.7 Cg_endo -84.37 -7.35 9.91 Favored 'Trans proline' 0 C--N 1.354 0.821 0 CA-C-N 119.883 0.994 . . . . 0.0 112.878 174.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 971' ' ' GLU . 75.3 t . . . . . 0 C--N 1.331 -0.228 0 C-N-CA 120.226 -0.59 . . . . 0.0 109.419 170.235 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.867 ' HA ' ' HB1' ' A' 1042 ' ' ALA . 89.4 m . . . . . 0 CA--C 1.531 0.229 0 N-CA-C 111.703 0.26 . . . . 0.0 111.703 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.63 ' HB2' ' HG ' ' A' ' 973' ' ' LEU . 0.5 OUTLIER -62.66 -33.81 75.8 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.961 -175.729 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 9.3 ptm180 -85.4 -19.82 30.77 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 121.046 -0.261 . . . . 0.0 111.046 -178.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.67 -34.48 69.75 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 166.256 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 1.003 HG23 HG12 ' A' ' 969' ' ' VAL . 44.9 mt -69.9 -33.01 53.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.637 176.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . 0.53 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 50.5 mt-10 -57.96 -49.81 75.53 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.559 175.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 50.9 ttp -72.83 -42.49 63.74 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 114.9 -1.046 . . . . 0.0 110.755 -175.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.809 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -68.21 -50.27 55.25 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 114.898 -1.046 . . . . 0.0 112.279 -172.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.916 HE22 ' HB2' ' A' ' 970' ' ' ASP . 48.7 mt-30 -54.39 -43.73 71.67 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 176.2 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . 0.708 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 0.0 OUTLIER -63.52 -42.15 98.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.046 177.88 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 26.3 tp -51.86 -59.32 4.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.324 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.452 ' HA ' HD22 ' A' ' 991' ' ' LEU . 0.7 OUTLIER -63.43 -35.5 80.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.709 0.766 . . . . 0.0 108.936 178.143 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . 0.708 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 25.5 t-20 -50.37 -55.39 15.86 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 113.82 -1.536 . . . . 0.0 112.749 -176.661 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 5.5 m -77.86 -30.03 50.69 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.31 -0.556 . . . . 0.0 111.99 -178.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . 0.436 ' O ' ' HB3' ' A' ' 997' ' ' GLU . 0.1 OUTLIER -73.75 -33.79 64.46 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 118.877 -1.129 . . . . 0.0 111.667 179.826 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 1.108 HD22 HD13 ' A' ' 962' ' ' LEU . 1.9 pp -68.02 -19.12 64.88 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 169.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -78.21 -23.93 47.31 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 119.414 -0.914 . . . . 0.0 110.133 169.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.436 ' HB3' ' O ' ' A' ' 994' ' ' ASP . 6.9 tp10 -74.23 -43.96 55.04 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.976 -0.749 . . . . 0.0 108.976 171.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.715 HD13 ' HB2' ' A' 1025 ' ' ALA . 7.5 tp -56.91 -48.06 79.09 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.266 -179.371 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.874 ' HA ' ' SD ' ' A' 1002 ' ' MET . 67.5 mt -68.76 -38.08 78.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.828 -171.278 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 25.8 m-80 -62.76 -35.41 79.72 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.63 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.486 ' HA ' ' HD1' ' A' 1017 ' ' TYR . 0.7 OUTLIER -85.4 -39.84 17.13 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.293 0.568 . . . . 0.0 110.816 -175.469 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.874 ' SD ' ' HA ' ' A' ' 999' ' ' ILE . 8.2 ptm -62.29 -27.08 68.77 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 122.255 1.026 . . . . 0.0 108.653 177.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.671 ' O ' ' HG3' ' A' 1006 ' ' GLN . 19.9 tptt -73.92 -54.04 8.81 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 114.158 -1.383 . . . . 0.0 110.575 -171.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.549 ' HA ' ' HB2' ' A' 1007 ' ' GLN . 6.4 mt -69.54 -12.52 61.72 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.004 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.749 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -75.73 -38.7 58.27 Favored 'General case' 0 C--O 1.213 -0.838 0 C-N-CA 119.296 -0.962 . . . . 0.0 108.594 -178.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.967 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 1.3 pp0? -74.33 -36.7 63.66 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.764 -0.375 . . . . 0.0 111.126 170.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.549 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 33.9 mt-30 -49.26 -43.32 42.86 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.034 0.445 . . . . 0.0 111.289 178.599 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.658 ' HB2' ' HG ' ' A' 1013 ' ' LEU . 49.4 m-85 -126.04 44.74 2.78 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.313 0.578 . . . . 0.0 110.839 169.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 1.013 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 7.9 p -53.17 -20.21 2.57 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.409 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.63 171.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1010 ' ' MET . . . . . 0.462 ' O ' HG23 ' A' 1011 ' ' THR . 60.2 mtm -48.42 -40.59 26.51 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.162 -1.381 . . . . 0.0 111.915 174.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1011 ' ' THR . . . . . 0.462 HG23 ' O ' ' A' 1010 ' ' MET . 1.0 OUTLIER -160.66 -94.18 0.02 OUTLIER 'General case' 0 C--O 1.248 0.998 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 -179.344 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 4.6 m -59.12 -62.65 1.72 Allowed 'General case' 0 C--O 1.24 0.555 0 CA-C-N 114.517 -1.22 . . . . 0.0 113.121 -162.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1013 ' ' LEU . . . . . 0.701 HD22 ' HE2' ' A' 1017 ' ' TYR . 14.6 mt -53.57 -37.38 62.86 Favored 'General case' 0 CA--C 1.498 -1.044 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.735 -178.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 1.013 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -53.78 -54.56 36.46 Favored 'General case' 0 N--CA 1.441 -0.919 0 O-C-N 123.867 0.729 . . . . 0.0 110.817 -166.693 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -70.57 -42.45 71.07 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.82 -175.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -67.0 -53.76 28.26 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.555 0.693 . . . . 0.0 111.149 -179.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.749 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 12.0 m-85 -62.56 -34.34 76.77 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 113.823 1.045 . . . . 0.0 113.823 -176.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.659 ' HD3' ' CD1' ' A' ' 951' ' ' TYR . 54.1 tptt -79.05 -31.38 44.51 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 114.92 -1.036 . . . . 0.0 110.247 -176.122 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -71.81 -42.51 66.96 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 175.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -56.16 -36.25 68.1 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.539 163.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.597 ' HB3' ' HA ' ' A' 1018 ' ' LYS . 0.0 OUTLIER -66.82 -51.74 52.0 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.377 0.132 . . . . 0.0 110.834 -177.032 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . 0.417 ' O ' ' HG ' ' A' 1022 ' ' LEU . 0.0 OUTLIER -78.09 -13.48 59.85 Favored 'General case' 0 C--O 1.218 -0.558 0 C-N-CA 119.595 -0.842 . . . . 0.0 109.955 -176.036 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . 0.499 ' HA ' ' HB3' ' A' 1026 ' ' HIS . 87.5 m -88.44 -32.75 18.14 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.671 177.093 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.499 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.28 -23.36 47.24 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 171.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.771 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -86.21 -21.67 27.34 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.255 169.307 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.636 ' O ' HG23 ' A' 1030 ' ' VAL . 84.9 t60 -76.38 -27.07 56.22 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 165.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -68.98 -41.51 77.78 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 123.806 0.842 . . . . 0.0 109.957 163.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.623 HD21 ' N ' ' A' ' 995' ' ' LEU . 12.3 mt -61.23 -39.95 92.18 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 119.989 -0.684 . . . . 0.0 109.666 170.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -60.96 -37.34 82.05 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.484 0.183 . . . . 0.0 110.973 171.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.636 HG23 ' O ' ' A' 1026 ' ' HIS . 18.1 t -69.28 -50.45 52.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 121.746 0.784 . . . . 0.0 110.109 -178.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -74.18 -32.83 63.25 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-N 114.445 -1.252 . . . . 0.0 111.024 -174.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.874 ' HA ' HD22 ' A' 1035 ' ' LEU . . . -71.39 -32.36 68.35 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 173.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -63.73 -43.89 95.17 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.661 0.743 . . . . 0.0 109.363 171.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.439 ' O ' ' HB3' ' A' 1037 ' ' ASP . 48.3 t30 -79.22 -49.25 12.81 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 114.865 -1.061 . . . . 0.0 112.364 -173.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.874 HD22 ' HA ' ' A' 1032 ' ' ALA . 0.2 OUTLIER -60.33 -39.7 88.01 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 118.012 0.369 . . . . 0.0 110.662 -174.422 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.511 ' H ' HD23 ' A' 1035 ' ' LEU . 2.5 tm? -68.83 -43.19 76.02 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 117.998 -1.481 . . . . 0.0 108.87 178.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.439 ' HB3' ' O ' ' A' 1034 ' ' ASN . 27.8 t70 -52.6 -41.76 63.95 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.457 174.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.474 ' HB ' ' O ' ' A' 1035 ' ' LEU . 24.6 t -56.41 -41.38 71.71 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.694 0 CA-C-N 114.182 -1.372 . . . . 0.0 111.706 174.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.657 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 1.6 mp -81.16 -28.63 10.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 118.215 0.461 . . . . 0.0 111.282 177.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -59.23 -48.6 81.01 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 168.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -70.76 -33.43 70.78 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.53 175.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.867 ' HB1' ' HA ' ' A' ' 980' ' ' THR . . . -55.37 -50.22 70.27 Favored 'General case' 0 CA--C 1.512 -0.511 0 C-N-CA 123.384 0.673 . . . . 0.0 112.422 178.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.591 ' HG2' ' O ' ' A' 1039 ' ' ILE . 4.0 ptp85 -64.58 -34.87 79.28 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.911 -0.404 . . . . 0.0 109.911 -177.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 51.7 tp . . . . . 0 C--N 1.328 -0.334 0 CA-C-O 121.102 0.477 . . . . 0.0 110.61 173.16 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.462 ' HA ' ' HD2' ' A' ' 924' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--O 1.224 -0.27 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.569 HG21 ' HB2' ' A' 1036 ' ' LEU . 20.0 m -60.42 -29.22 43.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.318 0.58 . . . . 0.0 110.744 175.221 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -73.79 -35.16 64.9 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.004 -0.544 . . . . 0.0 112.205 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . 0.843 ' HA ' ' HB ' ' A' ' 930' ' ' THR . 12.1 pt-20 -76.26 -22.71 54.79 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 119.566 1.075 . . . . 0.0 110.736 179.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.416 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 1.4 m120 -71.81 -30.3 65.35 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 174.306 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.661 HG22 ' HB1' ' A' 1032 ' ' ALA . 75.6 t -80.53 -32.5 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.297 0 CA-C-N 114.593 -1.185 . . . . 0.0 109.556 172.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.843 ' HB ' ' HA ' ' A' ' 927' ' ' GLU . 1.2 m -54.4 -44.72 72.59 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 167.137 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -68.35 -53.2 22.59 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-N 115.006 -0.997 . . . . 0.0 114.008 175.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.574 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.0 pp -64.68 -48.32 75.18 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 117.518 0.659 . . . . 0.0 112.772 -175.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 49.7 t -66.64 -36.69 77.88 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.394 0 CA-C-O 121.04 0.448 . . . . 0.0 110.925 -174.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.41 ' HE2' ' HB3' ' A' ' 934' ' ' LYS . 22.0 ttpt -60.09 -41.98 93.65 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.303 179.046 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -62.46 -32.1 72.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.554 0.216 . . . . 0.0 111.543 176.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.814 HG22 ' HB1' ' A' 1025 ' ' ALA . 98.6 t -58.6 -75.83 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -177.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 27.4 pt -73.35 -39.45 55.38 Favored 'Isoleucine or valine' 0 C--O 1.239 0.516 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -173.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -63.09 -51.9 64.79 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.686 0.755 . . . . 0.0 109.809 -174.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.706 ' HG3' ' SD ' ' A' ' 954' ' ' MET . 21.6 mmt -73.32 -26.59 61.11 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.877 -177.383 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.662 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 25.7 p . . . . . 0 CA--C 1.519 -0.247 0 O-C-N 123.746 0.654 . . . . 0.0 111.458 -173.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.833 ' CE1' ' HD3' ' A' 1018 ' ' LYS . 23.6 m-85 . . . . . 0 N--CA 1.466 0.355 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 0.881 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -54.69 -51.78 75.83 Favored Pre-proline 0 CA--C 1.542 0.643 0 CA-C-O 119.077 -0.487 . . . . 0.0 111.877 178.76 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 0.881 ' HD3' HG13 ' A' ' 952' ' ' VAL . 5.7 Cg_exo -46.4 -49.18 12.15 Favored 'Trans proline' 0 C--N 1.354 0.827 0 C-N-CA 122.522 2.148 . . . . 0.0 113.73 169.492 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.706 ' SD ' ' HG3' ' A' ' 939' ' ' MET . 2.3 tpt -58.47 -49.03 78.8 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.546 0.688 . . . . 0.0 110.233 176.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.884 HG21 ' HG2' ' A' 1002 ' ' MET . 56.8 t -53.37 -33.57 21.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 114.56 -1.2 . . . . 0.0 112.414 171.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 5.7 mptp? -63.36 -31.68 72.9 Favored 'General case' 0 C--N 1.315 -0.901 0 C-N-CA 119.737 -0.785 . . . . 0.0 111.149 173.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . 0.432 ' O ' ' HB3' ' A' ' 960' ' ' LEU . 45.0 mm-40 -79.76 -42.76 23.85 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.545 0.212 . . . . 0.0 111.506 176.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' ' 954' ' ' MET . 2.0 t -69.42 -33.46 57.55 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 177.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -66.1 -37.4 93.03 Favored Glycine 0 N--CA 1.435 -1.401 0 N-CA-C 110.352 -1.099 . . . . 0.0 110.352 173.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . 0.565 HD12 ' HD3' ' A' ' 963' ' ' ARG . 16.3 tp -62.81 -31.98 73.08 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 115.034 -0.583 . . . . 0.0 110.045 172.538 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.51 ' HB1' ' HB3' ' A' ' 932' ' ' LEU . . . -73.76 -58.54 3.23 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.763 -0.198 . . . . 0.0 110.588 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.535 ' HG ' ' N ' ' A' ' 963' ' ' ARG . 0.1 OUTLIER -39.22 -53.65 1.88 Allowed 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 166.682 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.565 ' HD3' HD12 ' A' ' 960' ' ' LEU . 6.5 ptm180 -67.7 -31.96 72.27 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 119.318 0.963 . . . . 0.0 111.516 -178.111 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 83.5 m -65.96 -35.6 81.04 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 175.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.941 HD21 HD11 ' A' 1035 ' ' LEU . 52.9 tp -70.88 -37.76 73.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.52 -1.218 . . . . 0.0 109.63 176.569 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 9.7 tt -68.21 -40.37 82.12 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 114.628 -1.169 . . . . 0.0 108.36 -175.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -70.63 -37.18 73.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.531 -0.759 . . . . 0.0 112.262 178.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 7.6 p -66.07 -41.42 90.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 118.802 0.728 . . . . 0.0 110.169 176.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.973 HG12 HG23 ' A' ' 984' ' ' ILE . 77.0 t -71.1 -38.58 71.87 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.324 174.619 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.648 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 7.1 t70 -68.01 -41.49 82.16 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.647 0.736 . . . . 0.0 109.045 -178.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.469 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 45.5 tt0 -62.93 -33.37 75.19 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.519 176.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.42 ' HB2' ' O ' ' A' ' 969' ' ' VAL . 62.2 m -67.06 -20.03 65.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.184 176.396 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.713 ' HB2' HG21 ' A' ' 984' ' ' ILE . 9.1 tt -68.64 -53.18 16.88 Favored Pre-proline 0 CA--C 1.534 0.352 0 CA-C-O 119.513 -0.28 . . . . 0.0 110.907 -174.192 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.693 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 4.1 Cg_endo -89.29 -2.69 6.06 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 121.766 1.644 . . . . 0.0 113.143 176.647 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . . . . . . . . . 20.9 t . . . . . 0 C--N 1.328 -0.363 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.616 175.137 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.891 HG23 ' HB1' ' A' 1042 ' ' ALA . 23.7 m . . . . . 0 CA--C 1.54 0.563 0 CA-C-O 120.923 0.392 . . . . 0.0 111.625 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.455 ' HA ' ' HG ' ' A' ' 973' ' ' LEU . 7.9 p80 -52.98 -32.62 47.29 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -179.525 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . 0.546 ' HA ' ' HG2' ' A' ' 985' ' ' GLU . 4.4 ptm180 -83.46 -21.57 32.84 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 120.268 -0.573 . . . . 0.0 111.714 -174.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.436 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 0.4 OUTLIER -79.33 -39.88 31.67 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 121.882 0.849 . . . . 0.0 109.232 171.63 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.973 HG23 HG12 ' A' ' 969' ' ' VAL . 75.0 mt -69.02 -33.22 57.75 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 CA-C-N 114.254 -1.339 . . . . 0.0 110.0 -178.334 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . 0.546 ' HG2' ' HA ' ' A' ' 982' ' ' ARG . 12.8 pt-20 -71.2 -43.54 67.17 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 119.553 -0.859 . . . . 0.0 109.525 -179.499 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 54.3 tpp -71.3 -43.52 66.94 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 114.583 -1.189 . . . . 0.0 111.344 -172.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.987 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -74.83 -50.09 18.33 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.879 -1.055 . . . . 0.0 112.687 -170.327 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.629 HE22 ' HB2' ' A' ' 970' ' ' ASP . 3.6 pt20 -60.02 -29.1 68.27 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.972 176.472 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . 0.722 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 20.8 tttm -70.03 -39.64 75.66 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.19 172.479 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.463 ' HB3' ' O ' ' A' ' 987' ' ' ALA . 16.7 tp -50.37 -60.54 2.89 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.412 -0.813 . . . . 0.0 112.651 -179.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.718 HD22 ' HG ' ' A' 1035 ' ' LEU . 1.6 pt? -73.46 -22.25 60.23 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.584 0.707 . . . . 0.0 110.036 -177.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . 0.722 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 48.8 t-20 -51.94 -55.43 20.37 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 114.317 -1.311 . . . . 0.0 110.965 175.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 14.6 m -73.16 -31.87 64.51 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.854 -179.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.5 -31.73 68.94 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 119.58 -0.848 . . . . 0.0 112.059 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 0.592 ' N ' HD21 ' A' 1028 ' ' LEU . 8.3 tt -71.05 -16.65 62.61 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 122.168 -0.333 . . . . 0.0 110.227 171.187 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -76.81 -24.41 52.79 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 119.854 -0.738 . . . . 0.0 109.901 168.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -74.1 -42.93 59.34 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 109.144 -0.688 . . . . 0.0 109.144 171.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.645 HD22 HD11 ' A' 1028 ' ' LEU . 0.4 OUTLIER -55.69 -43.48 76.47 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.34 -0.846 . . . . 0.0 111.024 -179.597 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.795 HG12 HG11 ' A' ' 955' ' ' VAL . 75.5 mt -64.45 -43.94 96.98 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.957 -177.016 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 29.1 m-80 -63.8 -33.75 76.38 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.321 0.582 . . . . 0.0 111.856 -178.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.977 ' HD3' ' HG2' ' A' 1020 ' ' GLN . 89.7 mttt -82.55 -42.48 18.29 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.539 -174.055 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.884 ' HG2' HG21 ' A' ' 955' ' ' VAL . 0.0 OUTLIER -62.88 -25.48 68.32 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.919 0.866 . . . . 0.0 108.893 176.341 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.615 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 10.4 tptp -71.04 -54.97 9.3 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.432 -168.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.773 ' HB3' HD23 ' A' 1013 ' ' LEU . 80.3 mt -70.69 -14.11 62.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.343 179.242 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.76 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -70.5 -50.95 32.46 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 119.704 -0.798 . . . . 0.0 110.002 178.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.68 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.2 pp0? -74.11 -30.4 62.31 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.319 -0.553 . . . . 0.0 112.049 173.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.618 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 12.1 mt-30 -50.78 -45.42 59.11 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.524 0.678 . . . . 0.0 110.175 173.165 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.637 ' CD1' HD22 ' A' 1013 ' ' LEU . 73.3 m-85 -121.93 43.58 2.82 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.267 175.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 1.087 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 7.7 p -51.92 -29.44 11.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-O 121.79 0.805 . . . . 0.0 110.65 173.256 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1010 ' ' MET . . . . . 0.429 ' HG3' ' OG1' ' A' 1011 ' ' THR . 24.1 ptp -69.04 -5.69 23.46 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.003 -0.999 . . . . 0.0 111.897 176.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1011 ' ' THR . . . . . 0.911 HG22 ' H ' ' A' 1012 ' ' SER . 1.2 m -141.55 -168.45 2.66 Favored 'General case' 0 C--O 1.258 1.544 0 CA-C-O 122.952 1.358 . . . . 0.0 113.98 -172.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1012 ' ' SER . . . . . 0.911 ' H ' HG22 ' A' 1011 ' ' THR . 15.5 m -57.72 -32.57 67.53 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 114.2 -1.364 . . . . 0.0 111.899 -175.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1013 ' ' LEU . . . . . 0.773 HD23 ' HB3' ' A' 1004 ' ' LEU . 7.5 mp -49.72 -43.32 47.63 Favored 'General case' 0 CA--C 1.499 -1.006 0 C-N-CA 120.425 -0.51 . . . . 0.0 112.206 172.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 1.087 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -56.63 -50.16 72.85 Favored 'General case' 0 N--CA 1.439 -1.016 0 C-N-CA 119.871 -0.731 . . . . 0.0 109.437 -173.533 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.481 ' N ' HE21 ' A' 1014 ' ' GLN . 3.7 pt20 -71.31 -42.15 69.0 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 114.869 -1.059 . . . . 0.0 111.965 -175.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -67.12 -56.31 10.53 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.352 0.596 . . . . 0.0 111.623 179.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.76 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 13.8 m-85 -63.93 -33.1 74.95 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 -173.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.833 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 42.2 tptt -79.68 -30.8 41.24 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.453 -178.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . 0.511 ' O ' HD23 ' A' 1022 ' ' LEU . 1.1 mptm? -70.68 -51.21 29.19 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 173.152 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . 0.977 ' HG2' ' HD3' ' A' 1001 ' ' LYS . 8.0 tt0 -50.69 -33.56 23.24 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.761 -1.109 . . . . 0.0 111.206 165.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.655 ' HG3' ' HB3' ' A' 1002 ' ' MET . 1.9 tmt? -68.32 -46.82 69.21 Favored 'General case' 0 CA--C 1.512 -0.508 0 O-C-N 122.168 -0.333 . . . . 0.0 110.355 176.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . 0.682 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -80.47 -7.29 59.11 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 118.857 -1.137 . . . . 0.0 109.595 -179.28 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 84.8 m -83.93 -40.4 18.58 Favored 'General case' 0 C--N 1.333 -0.133 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 174.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.555 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -77.27 -21.13 54.13 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 172.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.814 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -85.09 -23.01 28.69 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.401 169.437 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.564 ' O ' HG23 ' A' 1030 ' ' VAL . 16.3 t60 -76.96 -24.84 52.3 Favored 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 166.26 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -73.74 -39.01 64.58 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 123.489 0.716 . . . . 0.0 109.67 165.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.645 HD11 HD22 ' A' ' 998' ' ' LEU . 22.7 mt -60.63 -44.34 96.48 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 168.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -59.99 -38.45 82.62 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 111.445 0.165 . . . . 0.0 111.445 173.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' 1026 ' ' HIS . 7.8 t -69.93 -50.31 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.166 0 CA-C-O 121.488 0.661 . . . . 0.0 110.071 -178.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.469 ' O ' HD12 ' A' 1035 ' ' LEU . 23.8 m-20 -66.63 -38.05 86.11 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 114.687 -1.142 . . . . 0.0 110.496 -178.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.661 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -59.76 -42.57 93.57 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.349 173.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 50.9 mttp -64.03 -53.14 54.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.665 0.745 . . . . 0.0 110.054 173.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.433 ' O ' HG23 ' A' 1038 ' ' VAL . 9.0 t30 -63.18 -52.18 63.4 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.175 -1.375 . . . . 0.0 111.813 -171.207 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.987 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 0.0 OUTLIER -65.31 -38.0 88.85 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 119.307 -0.378 . . . . 0.0 110.825 -173.204 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.721 ' N ' HD13 ' A' 1035 ' ' LEU . 4.0 pp -72.98 -35.1 66.83 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 116.951 -1.899 . . . . 0.0 109.718 -179.326 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.424 ' N ' HD12 ' A' 1036 ' ' LEU . 38.3 t70 -59.12 -42.86 91.56 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 114.988 -1.006 . . . . 0.0 109.823 174.494 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' 1034 ' ' ASN . 19.6 t -53.9 -42.3 52.77 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.706 0 CA-C-N 113.847 -1.524 . . . . 0.0 111.522 173.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.647 ' O ' ' HG2' ' A' 1043 ' ' ARG . 1.7 mp -79.11 -31.11 14.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 118.35 0.523 . . . . 0.0 111.387 177.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.435 ' HA ' ' HE ' ' A' 1043 ' ' ARG . 0.4 OUTLIER -56.83 -50.39 72.53 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.655 0.74 . . . . 0.0 109.511 169.907 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -65.61 -42.93 91.04 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.222 174.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.891 ' HB1' HG23 ' A' ' 980' ' ' THR . . . -52.33 -48.46 65.44 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 122.973 0.509 . . . . 0.0 112.37 -175.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.647 ' HG2' ' O ' ' A' 1039 ' ' ILE . 13.4 ptt180 -64.27 -47.76 78.31 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.905 -178.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 47.5 tp . . . . . 0 N--CA 1.469 0.498 0 C-N-CA 120.461 -0.496 . . . . 0.0 111.221 178.766 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.807 ' HB3' HG21 ' A' ' 968' ' ' THR . 11.2 tptm . . . . . 0 N--CA 1.447 -0.595 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.577 HG12 ' HB ' ' A' ' 968' ' ' THR . 14.0 m -65.86 -31.74 55.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 CA-C-O 121.045 0.45 . . . . 0.0 110.421 177.173 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.14 -23.52 51.7 Favored 'General case' 0 CA--C 1.504 -0.797 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 174.525 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.78 -25.27 48.91 Favored 'General case' 0 C--N 1.301 -1.529 0 C-N-CA 120.067 -0.653 . . . . 0.0 111.542 173.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.586 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 3.2 m120 -77.16 -30.34 54.96 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 174.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.603 HG22 HD21 ' A' ' 932' ' ' LEU . 62.6 t -79.74 -29.52 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.766 175.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.488 ' O ' ' HB3' ' A' ' 934' ' ' LYS . 84.8 m -57.8 -39.97 78.81 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 119.127 0.876 . . . . 0.0 108.642 169.043 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -72.7 -52.52 9.63 Favored Glycine 0 CA--C 1.527 0.812 0 CA-C-N 114.978 -1.01 . . . . 0.0 113.775 177.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.603 HD21 HG22 ' A' ' 929' ' ' VAL . 2.1 pp -63.2 -45.43 91.76 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 117.745 0.772 . . . . 0.0 112.706 -176.062 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 61.5 t -65.56 -39.44 85.06 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 CA-C-O 121.253 0.549 . . . . 0.0 110.366 -178.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.488 ' HB3' ' O ' ' A' ' 930' ' ' THR . 1.4 tmtt? -61.08 -35.94 78.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.942 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 0.457 ' HB1' ' SD ' ' A' ' 954' ' ' MET . . . -64.61 -41.98 95.83 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 118.129 0.422 . . . . 0.0 110.801 177.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.86 HG22 ' HB1' ' A' 1025 ' ' ALA . 58.0 t -47.63 -73.84 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.974 -179.485 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.416 HG13 ' N ' ' A' ' 938' ' ' GLU . 25.6 pt -65.64 -41.38 90.46 Favored 'Isoleucine or valine' 0 C--O 1.244 0.813 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -177.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.416 ' N ' HG13 ' A' ' 937' ' ' ILE . 36.2 tt0 -69.6 -51.89 31.01 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.588 -170.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 23.8 mmt -73.71 -27.18 61.08 Favored 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 119.757 -0.777 . . . . 0.0 109.371 -174.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.577 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 59.9 p . . . . . 0 C--N 1.343 0.288 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.429 -174.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.8 ' HB3' ' HG3' ' A' 1002 ' ' MET . 1.0 OUTLIER . . . . . 0 CA--C 1.536 0.43 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 0.615 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 23.8 t -53.41 -45.4 98.51 Favored Pre-proline 0 C--N 1.323 -0.563 0 C-N-CA 123.151 0.58 . . . . 0.0 111.608 171.047 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 0.615 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 38.4 Cg_exo -51.58 -39.42 65.52 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.186 1.924 . . . . 0.0 112.53 174.029 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.457 ' SD ' ' HB1' ' A' ' 935' ' ' ALA . 5.3 tpt -73.96 -36.41 64.59 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.762 175.073 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.605 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 71.2 t -52.67 -40.74 35.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.794 168.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.4 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 3.1 tmtm? -66.59 -33.02 74.73 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.597 175.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . 0.434 ' HB3' ' HA ' ' A' ' 954' ' ' MET . 7.0 tp10 -77.55 -45.81 24.24 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 121.002 0.429 . . . . 0.0 111.01 -174.278 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.498 HG11 HD21 ' A' ' 998' ' ' LEU . 14.6 p -87.05 -27.53 5.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.618 -178.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -63.82 -38.91 96.84 Favored Glycine 0 N--CA 1.447 -0.567 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 173.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . 0.467 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 17.0 tp -63.11 -38.26 90.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.279 -0.46 . . . . 0.0 109.893 174.264 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.463 ' HB1' ' HB3' ' A' ' 932' ' ' LEU . . . -70.3 -40.76 74.06 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.706 -176.154 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.596 HD13 HD12 ' A' ' 991' ' ' LEU . 0.2 OUTLIER -67.74 -44.16 78.23 Favored 'General case' 0 C--O 1.217 -0.644 0 CA-C-O 118.782 -0.627 . . . . 0.0 111.437 173.423 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.467 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 6.1 ptp180 -64.85 -31.68 73.03 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 120.187 1.358 . . . . 0.0 110.457 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . 0.483 HG22 ' ND2' ' A' ' 928' ' ' ASN . 30.4 m -69.33 -39.11 78.39 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 176.602 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 1.0 HD11 HD21 ' A' 1036 ' ' LEU . 37.5 tp -62.79 -44.11 97.04 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.559 -1.2 . . . . 0.0 109.949 175.179 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.745 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.5 tt -68.2 -35.22 77.66 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.318 -0.856 . . . . 0.0 109.119 -172.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -69.81 -43.48 71.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.815 178.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.807 HG21 ' HB3' ' A' ' 924' ' ' LYS . 4.6 m -64.41 -41.11 96.8 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 119.843 -0.743 . . . . 0.0 110.134 178.321 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.736 HG12 HG23 ' A' ' 984' ' ' ILE . 43.6 t -67.65 -38.09 79.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.178 173.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.675 ' HB2' HE22 ' A' ' 988' ' ' GLN . 19.2 t70 -66.73 -38.61 87.01 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 122.21 1.005 . . . . 0.0 108.696 -178.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.448 ' C ' ' HD2' ' A' ' 974' ' ' PRO . 28.1 tt0 -76.01 -21.94 56.34 Favored 'General case' 0 N--CA 1.437 -1.106 0 CA-C-N 113.964 -1.471 . . . . 0.0 110.128 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.588 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 52.7 m -72.08 -17.67 61.98 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.708 171.651 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.828 ' HA ' HD13 ' A' ' 984' ' ' ILE . 9.4 tt -66.04 -51.0 48.95 Favored Pre-proline 0 CA--C 1.53 0.176 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 179.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.536 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 95.0 Cg_endo -81.97 -2.44 11.3 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 120.964 1.109 . . . . 0.0 113.546 171.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.588 ' HB ' ' HA ' ' A' ' 972' ' ' SER . 0.3 OUTLIER . . . . . 0 CA--C 1.537 0.464 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.691 178.351 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.498 HG23 ' CB ' ' A' 1042 ' ' ALA . 15.8 m . . . . . 0 CA--C 1.542 0.668 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.656 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 0.3 OUTLIER -51.82 -34.85 42.12 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -175.542 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -82.22 -21.03 36.56 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.116 0.871 . . . . 0.0 111.94 -171.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.586 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 0.4 OUTLIER -77.77 -33.81 52.55 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.386 0.612 . . . . 0.0 109.723 169.615 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.838 HG12 HG12 ' A' 1039 ' ' ILE . 69.3 mt -70.8 -30.28 41.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 CA-C-N 114.889 -1.05 . . . . 0.0 108.469 179.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . 0.656 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 45.9 mt-10 -63.97 -54.47 34.01 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.302 174.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . 0.577 ' HA ' ' HD2' ' A' ' 989' ' ' LYS . 75.2 mtp -70.61 -41.52 72.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.789 -170.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.953 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -65.24 -50.81 64.38 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.19 -0.914 . . . . 0.0 112.167 -173.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.745 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 3.7 pt20 -61.83 -28.2 69.31 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 120.452 -0.499 . . . . 0.0 111.074 178.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . 0.662 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 55.9 mttm -70.0 -43.42 71.45 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.449 0.643 . . . . 0.0 111.182 173.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.708 HD23 ' HB3' ' A' 1035 ' ' LEU . 7.7 tp -50.52 -60.08 3.38 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 114.694 -1.139 . . . . 0.0 112.539 -176.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.625 ' HB2' ' CD2' ' A' 1035 ' ' LEU . 0.4 OUTLIER -63.9 -33.49 75.83 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 121.398 0.618 . . . . 0.0 109.401 179.643 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . 0.662 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 44.7 t-20 -52.44 -51.89 56.88 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.584 -1.189 . . . . 0.0 110.546 177.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . 0.489 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 32.7 t -75.01 -42.44 57.4 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.464 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.54 -36.31 80.23 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.971 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 0.639 ' HG ' HD23 ' A' ' 998' ' ' LEU . 8.1 tt -73.18 -19.75 61.04 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 122.198 -0.314 . . . . 0.0 110.617 172.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -75.0 -25.55 58.9 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 119.841 -0.744 . . . . 0.0 109.788 168.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.56 ' O ' ' HG2' ' A' 1001 ' ' LYS . 4.6 mm-40 -75.43 -40.16 57.98 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 172.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.826 HD13 ' HB2' ' A' 1025 ' ' ALA . 0.2 OUTLIER -56.18 -47.01 79.13 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.325 177.917 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.525 HG13 ' O ' ' A' ' 995' ' ' LEU . 95.8 mt -64.73 -42.12 94.1 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.575 -174.545 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 14.5 m-80 -59.49 -39.41 83.69 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.345 0.593 . . . . 0.0 111.856 -178.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.56 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 69.5 mmtt -77.96 -37.61 47.12 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 122.097 0.951 . . . . 0.0 108.739 -177.028 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.878 ' HB2' ' HG3' ' A' 1021 ' ' MET . 1.7 ttp -61.64 -28.71 69.57 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 114.061 -1.427 . . . . 0.0 109.179 175.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.47 ' O ' ' HG3' ' A' 1006 ' ' GLN . 2.9 tptm -73.76 -47.03 42.03 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.948 -167.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.872 HD13 ' HG3' ' A' 1007 ' ' GLN . 3.8 mm? -77.5 -13.56 59.89 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.102 179.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.834 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -75.38 -32.21 60.72 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 119.443 -0.903 . . . . 0.0 110.61 -177.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.719 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 5.2 pp0? -75.13 -33.27 61.54 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 118.867 -0.587 . . . . 0.0 110.961 165.406 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.872 ' HG3' HD13 ' A' 1004 ' ' LEU . 13.7 mm100 -48.33 -44.12 33.88 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.126 0.488 . . . . 0.0 110.497 176.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.884 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 28.6 m-85 -130.01 47.4 2.51 Favored 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 120.014 -0.674 . . . . 0.0 111.074 170.027 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 1.029 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 7.2 p -50.95 -24.47 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 CA-C-O 121.945 0.878 . . . . 0.0 109.599 167.293 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 16.4 mmt -48.68 -44.6 38.05 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 113.838 -1.528 . . . . 0.0 110.922 175.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1011 ' ' THR . . . . . . . . . . . . . 2.6 p -154.98 -101.9 0.04 OUTLIER 'General case' 0 C--O 1.251 1.182 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 -177.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 16.4 p -57.67 -64.02 1.04 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-N 114.552 -1.204 . . . . 0.0 112.881 -164.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1013 ' ' LEU . . . . . 0.884 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 4.6 mp -45.99 -42.94 13.75 Favored 'General case' 0 CA--C 1.5 -0.98 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 1.029 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -55.03 -47.77 74.29 Favored 'General case' 0 N--CA 1.438 -1.042 0 O-C-N 123.866 0.729 . . . . 0.0 110.345 -168.499 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.614 ' O ' ' HD3' ' A' 1019 ' ' LYS . 97.8 mt-30 -69.37 -51.57 35.42 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.08 -177.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -64.35 -48.0 77.19 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.36 0.6 . . . . 0.0 111.188 -176.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.834 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 7.2 m-85 -68.24 -37.52 80.87 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.258 -0.883 . . . . 0.0 113.139 -173.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.6 ' HD3' ' CE2' ' A' ' 951' ' ' TYR . 47.1 tptt -80.96 -28.42 35.68 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.3 -176.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . 0.614 ' HD3' ' O ' ' A' 1015 ' ' GLN . 5.6 mptp? -73.32 -53.27 11.21 Favored 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 174.091 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . 0.478 ' HG2' ' HG3' ' A' 1001 ' ' LYS . 9.2 tt0 -50.56 -32.01 17.35 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.809 164.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.878 ' HG3' ' HB2' ' A' 1002 ' ' MET . 2.4 ttp -68.69 -50.66 49.18 Favored 'General case' 0 CA--C 1.514 -0.417 0 O-C-N 122.333 -0.23 . . . . 0.0 110.621 176.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . 0.762 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -84.9 -9.41 58.13 Favored 'General case' 0 C--O 1.219 -0.553 0 C-N-CA 119.629 -0.829 . . . . 0.0 110.317 -174.035 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 52.4 m -83.34 -34.8 25.57 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 171.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.53 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -78.28 -21.85 49.14 Favored 'General case' 0 C--O 1.223 -0.319 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 171.018 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.86 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -85.64 -23.38 27.52 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.176 170.187 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.582 ' O ' HG23 ' A' 1030 ' ' VAL . 46.9 t-80 -75.77 -24.58 56.03 Favored 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 165.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . 0.53 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -70.68 -38.88 73.78 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 123.53 0.732 . . . . 0.0 109.654 164.236 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.635 HD11 HD22 ' A' ' 998' ' ' LEU . 21.6 mt -60.95 -47.21 87.49 Favored 'General case' 0 C--N 1.314 -0.939 0 C-N-CA 120.191 -0.604 . . . . 0.0 109.495 169.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -57.74 -40.92 80.79 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 111.366 0.135 . . . . 0.0 111.366 173.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.582 HG23 ' O ' ' A' 1026 ' ' HIS . 16.1 t -70.18 -52.17 32.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-O 121.232 0.539 . . . . 0.0 110.711 -177.093 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.74 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 5.7 m-20 -77.27 -29.14 53.75 Favored 'General case' 0 C--O 1.214 -0.783 0 CA-C-N 115.441 -0.8 . . . . 0.0 112.746 -174.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.594 ' O ' ' HG ' ' A' 1036 ' ' LEU . . . -66.51 -32.68 74.18 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 170.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.503 ' HB3' ' O ' ' A' 1030 ' ' VAL . 22.9 tttm -64.96 -51.24 62.88 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 122.078 0.942 . . . . 0.0 109.098 168.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.74 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 32.4 t30 -61.58 -52.11 65.75 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 113.396 -1.729 . . . . 0.0 112.572 -173.399 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.953 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 1.5 pp -62.45 -37.95 87.89 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 118.941 -0.552 . . . . 0.0 110.23 -176.187 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 1.0 HD21 HD11 ' A' ' 965' ' ' LEU . 19.9 mt -66.95 -45.86 76.48 Favored 'General case' 0 C--O 1.224 -0.279 0 C-N-CA 116.809 -1.956 . . . . 0.0 108.785 176.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.484 ' HB3' ' O ' ' A' 1034 ' ' ASN . 28.3 t70 -50.19 -40.79 48.07 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 114.46 -1.245 . . . . 0.0 111.038 175.273 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.522 ' HB ' ' O ' ' A' 1035 ' ' LEU . 24.2 t -53.33 -51.09 43.84 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.692 0 CA-C-N 114.267 -1.333 . . . . 0.0 111.66 173.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.838 HG12 HG12 ' A' ' 984' ' ' ILE . 3.0 mp -72.4 -33.08 44.58 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.428 0 CA-C-N 118.917 0.78 . . . . 0.0 110.738 176.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.469 ' O ' ' HG3' ' A' 1043 ' ' ARG . 90.1 m-20 -52.88 -52.59 56.92 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 122.317 1.056 . . . . 0.0 109.343 173.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -75.61 -35.72 60.45 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.524 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.654 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -53.96 -50.05 67.37 Favored 'General case' 0 CA--C 1.499 -0.994 0 C-N-CA 123.465 0.706 . . . . 0.0 111.998 -178.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.703 ' HD3' ' N ' ' A' 1044 ' ' LEU . 0.1 OUTLIER -62.2 -41.09 98.04 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -177.394 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . 0.703 ' N ' ' HD3' ' A' 1043 ' ' ARG . 50.7 tp . . . . . 0 CA--C 1.534 0.353 0 CA-C-O 121.52 0.676 . . . . 0.0 110.319 -177.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.571 ' HB2' HG21 ' A' ' 968' ' ' THR . 68.2 mmtt . . . . . 0 N--CA 1.456 -0.128 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.61 ' O ' HG23 ' A' ' 929' ' ' VAL . 34.0 m -57.51 -32.52 41.99 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.36 0 CA-C-O 121.164 0.507 . . . . 0.0 110.494 175.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.56 -41.72 60.04 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.337 -179.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . 0.475 ' HG2' ' HA ' ' A' ' 924' ' ' LYS . 10.8 pt-20 -76.59 -25.6 54.12 Favored 'General case' 0 C--N 1.317 -0.807 0 C-N-CA 119.175 -1.01 . . . . 0.0 111.342 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -66.17 -28.59 68.89 Favored 'General case' 0 C--N 1.319 -0.754 0 O-C-N 121.651 -0.655 . . . . 0.0 110.346 167.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.616 HG22 ' HB1' ' A' 1032 ' ' ALA . 69.2 t -79.23 -34.9 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.312 172.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.466 HG22 ' O ' ' A' ' 927' ' ' GLU . 1.3 t -67.99 -30.43 69.69 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 120.369 1.44 . . . . 0.0 108.275 173.151 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -73.17 -53.11 8.02 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-N 115.398 -0.819 . . . . 0.0 113.084 174.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.456 ' CD2' ' HA ' ' A' ' 929' ' ' VAL . 0.9 OUTLIER -65.79 -49.69 67.4 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -178.414 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.421 ' O ' ' HB ' ' A' ' 936' ' ' VAL . 72.6 t -68.59 -32.39 54.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 CA-C-O 121.185 0.517 . . . . 0.0 110.733 -174.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . . . . . . . . . 24.7 ttpt -61.99 -45.96 91.33 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.084 176.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 0.462 ' O ' ' HB2' ' A' ' 939' ' ' MET . . . -56.38 -35.33 67.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.464 0.173 . . . . 0.0 111.366 176.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.856 HG22 ' HB1' ' A' 1025 ' ' ALA . 57.8 t -52.79 -74.95 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.696 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 23.5 pt -74.74 -42.64 47.55 Favored 'Isoleucine or valine' 0 C--O 1.245 0.851 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -175.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -64.9 -51.41 62.06 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.383 0.611 . . . . 0.0 109.99 -171.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.462 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 65.4 mtt -73.55 -25.49 60.41 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.254 -178.211 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.748 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 32.6 p . . . . . 0 C--N 1.347 0.468 0 O-C-N 123.797 0.686 . . . . 0.0 111.346 -173.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.959 ' HB3' ' HG3' ' A' 1002 ' ' MET . 20.2 m-85 . . . . . 0 N--CA 1.469 0.504 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 0.802 ' O ' ' HB ' ' A' ' 955' ' ' VAL . 25.3 t -63.49 -48.4 81.51 Favored Pre-proline 0 C--N 1.324 -0.511 0 O-C-N 122.49 -0.131 . . . . 0.0 110.863 178.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 0.679 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 25.7 Cg_exo -50.6 -40.0 55.47 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 121.928 1.752 . . . . 0.0 112.806 166.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.402 ' O ' HG12 ' A' ' 958' ' ' VAL . 36.9 ttm -67.33 -31.92 72.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.034 0.445 . . . . 0.0 110.235 175.752 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.802 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 49.7 t -52.59 -39.12 28.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.087 168.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.632 ' HD3' ' HA ' ' A' ' 953' ' ' PRO . 12.8 mptt -64.82 -36.4 84.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.592 0.234 . . . . 0.0 111.293 172.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -78.87 -46.93 17.53 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.768 0.318 . . . . 0.0 111.773 -172.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.6 HG22 HD23 ' A' ' 962' ' ' LEU . 14.5 p -80.75 -32.01 12.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 179.214 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -59.72 -42.84 98.13 Favored Glycine 0 N--CA 1.446 -0.674 0 N-CA-C 110.719 -0.953 . . . . 0.0 110.719 174.134 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . 0.569 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 7.7 tt -67.39 -41.35 85.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.822 0.344 . . . . 0.0 110.305 177.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -66.97 -43.45 83.05 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.063 0.459 . . . . 0.0 111.689 -174.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.774 HD13 HD22 ' A' ' 995' ' ' LEU . 4.0 pp -84.94 -26.47 27.18 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.01 -178.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.613 ' HG3' ' N ' ' A' ' 964' ' ' THR . 8.6 ptt180 -66.82 -39.08 87.56 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 118.656 -1.218 . . . . 0.0 109.606 171.149 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . 0.613 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 12.5 m -64.67 -31.51 72.76 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.724 HD23 HD22 ' A' ' 991' ' ' LEU . 54.2 tp -63.44 -51.43 65.75 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 121.561 0.695 . . . . 0.0 109.541 173.436 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.758 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.3 tt -63.36 -37.81 88.73 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 114.52 -1.218 . . . . 0.0 109.081 -175.114 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . 0.493 ' HA ' ' HB3' ' A' ' 970' ' ' ASP . . . -74.37 -28.66 61.22 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.667 179.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.571 HG21 ' HB2' ' A' ' 924' ' ' LYS . 31.4 m -72.0 -32.53 67.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 119.19 0.905 . . . . 0.0 109.214 171.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.667 HG12 HG23 ' A' ' 984' ' ' ILE . 71.3 t -71.35 -40.1 72.79 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.166 171.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.654 ' HB2' HE22 ' A' ' 988' ' ' GLN . 24.8 t70 -69.23 -38.65 78.63 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 122.033 0.921 . . . . 0.0 108.572 -179.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.645 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 6.8 tp10 -63.78 -35.34 80.26 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.583 174.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.443 ' HB2' ' O ' ' A' ' 969' ' ' VAL . 64.8 m -64.9 -17.93 64.75 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.12 174.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.76 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 2.4 tm? -66.18 -53.07 34.78 Favored Pre-proline 0 CA--C 1.537 0.456 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -176.51 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.76 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 94.0 Cg_endo -91.31 -19.31 0.88 Allowed 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 121.236 1.291 . . . . 0.0 114.23 174.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . . . . . . . . . 3.4 t . . . . . 0 N--CA 1.466 0.356 0 CA-C-N 118.019 0.372 . . . . 0.0 110.666 177.947 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.84 HG23 ' HB1' ' A' 1042 ' ' ALA . 55.1 m . . . . . 0 CA--C 1.532 0.25 0 CA-C-O 121.366 0.603 . . . . 0.0 110.1 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.499 ' HA ' HD12 ' A' ' 984' ' ' ILE . 0.3 OUTLIER -52.56 -25.7 11.23 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 114.816 -1.083 . . . . 0.0 113.825 -176.73 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . 0.669 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 0.0 OUTLIER -84.37 -20.16 32.42 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.396 -0.815 . . . . 0.0 111.6 -177.409 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.558 ' CB ' ' HB2' ' A' 1042 ' ' ALA . 0.3 OUTLIER -78.5 -34.96 47.04 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.808 0.813 . . . . 0.0 109.157 168.912 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.667 HG23 HG12 ' A' ' 969' ' ' VAL . 70.4 mt -69.58 -30.13 44.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 114.459 -1.246 . . . . 0.0 109.31 179.459 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . 0.669 ' HG3' ' O ' ' A' ' 982' ' ' ARG . 2.4 pp20? -70.37 -44.01 68.95 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 121.494 0.664 . . . . 0.0 109.923 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 24.9 ttt -72.09 -42.78 65.76 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.474 -173.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.95 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -74.44 -51.77 13.94 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.984 -1.007 . . . . 0.0 112.488 -170.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.758 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 4.2 pt20 -61.87 -23.15 66.11 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.277 177.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . 0.8 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 15.1 tttt -73.07 -37.24 66.87 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.887 171.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.632 HD23 ' OD1' ' A' 1031 ' ' ASP . 15.7 tp -60.37 -57.73 11.5 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 119.616 -0.833 . . . . 0.0 111.89 179.128 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.724 HD22 HD23 ' A' ' 965' ' ' LEU . 11.6 tp -53.42 -33.95 55.93 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.475 0.655 . . . . 0.0 110.162 175.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . 0.8 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 24.6 t-20 -50.04 -53.84 24.22 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.065 -1.425 . . . . 0.0 111.426 -179.417 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 20.0 m -79.57 -26.79 41.27 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 179.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.64 -44.03 75.02 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.569 -0.852 . . . . 0.0 111.011 178.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 0.774 HD22 HD13 ' A' ' 962' ' ' LEU . 0.8 OUTLIER -66.02 -21.93 66.42 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 123.179 0.591 . . . . 0.0 110.478 172.405 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -75.91 -26.16 56.7 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 119.171 -1.012 . . . . 0.0 110.009 171.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -75.38 -43.38 50.59 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 171.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.887 HD22 HD11 ' A' 1028 ' ' LEU . 0.1 OUTLIER -56.37 -48.1 77.54 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.316 -0.857 . . . . 0.0 111.742 -177.683 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.74 HD12 HG13 ' A' ' 955' ' ' VAL . 47.5 mm -69.65 -37.76 74.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.455 -175.018 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 11.7 m-80 -63.66 -36.1 82.73 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 121.126 0.489 . . . . 0.0 111.83 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.586 ' HD3' ' HB3' ' A' 1020 ' ' GLN . 35.2 mttp -82.47 -35.34 27.56 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.477 0.656 . . . . 0.0 110.453 -176.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.959 ' HG3' ' HB3' ' A' ' 951' ' ' TYR . 15.2 tpp -60.42 -29.45 69.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 122.423 1.106 . . . . 0.0 108.514 173.406 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . . . . . . . . . 2.7 tptm -73.69 -52.66 12.54 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 113.865 -1.516 . . . . 0.0 111.04 -167.02 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.733 ' HA ' ' HB2' ' A' 1007 ' ' GLN . 7.8 mp -76.8 -13.43 60.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.731 -178.393 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.737 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -69.12 -44.58 72.08 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 119.317 -0.953 . . . . 0.0 109.434 179.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.78 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 2.9 pp0? -71.86 -34.03 68.89 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 120.127 -0.629 . . . . 0.0 111.435 170.134 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.733 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 51.8 mt-30 -47.14 -48.95 23.19 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.993 0.425 . . . . 0.0 110.901 176.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.832 ' HB2' HD13 ' A' 1013 ' ' LEU . 89.0 m-85 -125.15 47.75 2.12 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.191 -0.603 . . . . 0.0 110.529 171.465 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 1.038 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 12.5 p -51.76 -22.04 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 115.087 -0.961 . . . . 0.0 110.434 171.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1010 ' ' MET . . . . . 0.469 ' O ' HG23 ' A' 1011 ' ' THR . 22.7 mmt -41.67 -36.61 1.0 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.402 -1.272 . . . . 0.0 111.961 176.117 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1011 ' ' THR . . . . . 0.469 HG23 ' O ' ' A' 1010 ' ' MET . 0.2 OUTLIER -167.7 -92.42 0.01 OUTLIER 'General case' 0 C--O 1.246 0.911 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 176.522 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 12.2 m -53.1 -64.62 0.76 Allowed 'General case' 0 C--O 1.237 0.408 0 CA-C-N 114.571 -1.195 . . . . 0.0 113.311 -164.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1013 ' ' LEU . . . . . 0.832 HD13 ' HB2' ' A' 1008 ' ' TYR . 4.1 mp -52.7 -40.28 62.81 Favored 'General case' 0 CA--C 1.496 -1.099 0 O-C-N 123.25 0.343 . . . . 0.0 111.365 -177.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 1.038 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.09 -48.33 70.8 Favored 'General case' 0 N--CA 1.44 -0.93 0 O-C-N 123.639 0.587 . . . . 0.0 110.506 -168.206 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.539 ' O ' ' HD3' ' A' 1019 ' ' LYS . 25.1 mt-30 -71.39 -47.92 53.18 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 120.343 -0.543 . . . . 0.0 111.605 -179.076 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -67.5 -56.33 9.98 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.148 0.499 . . . . 0.0 111.25 -176.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.737 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 10.3 m-85 -56.46 -38.6 71.89 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.283 -177.148 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.915 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 22.9 tptm -80.01 -30.89 39.68 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 114.865 -1.061 . . . . 0.0 110.808 -177.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . 0.539 ' HD3' ' O ' ' A' 1015 ' ' GLN . 1.6 mptm? -70.87 -52.88 17.52 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 174.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . 0.586 ' HB3' ' HD3' ' A' 1001 ' ' LYS . 25.3 mt-30 -50.79 -32.86 21.21 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.107 164.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.49 ' SD ' HD12 ' A' ' 998' ' ' LEU . 10.7 tmm? -65.73 -50.73 63.74 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 177.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . 0.77 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -81.08 -5.01 57.14 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 119.301 -0.96 . . . . 0.0 109.707 -177.023 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 87.4 m -88.21 -35.9 17.08 Favored 'General case' 0 C--O 1.223 -0.306 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 173.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.555 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -77.76 -21.73 51.31 Favored 'General case' 0 C--O 1.22 -0.478 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 170.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.856 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -85.34 -24.09 27.77 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.368 169.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.614 ' O ' HG23 ' A' 1030 ' ' VAL . 28.4 t60 -76.97 -24.14 52.3 Favored 'General case' 0 C--O 1.215 -0.743 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 166.095 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . 0.459 ' HA ' ' HB ' ' A' 1030 ' ' VAL . . . -73.23 -39.81 65.18 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 123.88 0.872 . . . . 0.0 109.875 165.068 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.887 HD11 HD22 ' A' ' 998' ' ' LEU . 39.7 mt -59.68 -45.11 93.07 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 168.237 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -61.45 -34.88 76.17 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.592 0.234 . . . . 0.0 111.41 173.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.614 HG23 ' O ' ' A' 1026 ' ' HIS . 4.3 t -66.85 -50.33 66.16 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -179.49 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.773 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 34.2 t70 -74.55 -28.4 60.94 Favored 'General case' 0 C--O 1.206 -1.212 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.424 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.616 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -55.16 -45.59 75.71 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 171.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.426 ' O ' ' HB2' ' A' 1037 ' ' ASP . 78.0 tttt -67.82 -40.7 83.76 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.421 174.003 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.773 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 7.0 t30 -77.96 -56.1 4.76 Favored 'General case' 0 C--O 1.221 -0.444 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.176 -170.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.95 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 0.2 OUTLIER -61.37 -39.99 92.69 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 118.978 -0.534 . . . . 0.0 110.654 -175.025 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.653 HD13 ' N ' ' A' 1037 ' ' ASP . 0.0 OUTLIER -72.94 -29.57 63.2 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 116.029 -2.268 . . . . 0.0 109.644 -179.372 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.653 ' N ' HD13 ' A' 1036 ' ' LEU . 15.2 t70 -63.03 -41.92 99.65 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-O 122.116 0.96 . . . . 0.0 109.314 174.349 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' 1034 ' ' ASN . 36.3 t -59.95 -45.48 95.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 113.764 -1.562 . . . . 0.0 111.591 177.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.658 HD11 ' HA ' ' A' ' 984' ' ' ILE . 2.0 mp -72.79 -31.63 37.28 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 C-N-CA 119.972 -0.691 . . . . 0.0 110.917 174.064 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 1.7 t0 -58.54 -46.34 87.03 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.317 0.579 . . . . 0.0 109.746 170.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . 0.486 ' HG3' ' O ' ' A' 1037 ' ' ASP . 78.2 mt-30 -60.36 -49.43 77.61 Favored 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 173.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.84 ' HB1' HG23 ' A' ' 980' ' ' THR . . . -54.2 -52.27 61.77 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 114.279 -1.328 . . . . 0.0 113.353 -173.146 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.607 ' HD3' ' N ' ' A' 1044 ' ' LEU . 0.0 OUTLIER -64.07 -41.24 97.4 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 -176.2 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . 0.607 ' N ' ' HD3' ' A' 1043 ' ' ARG . 3.0 tm? . . . . . 0 N--CA 1.44 -0.94 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 -177.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.488 ' HB2' HG21 ' A' ' 968' ' ' THR . 27.8 mmtp . . . . . 0 CA--C 1.531 0.231 0 N-CA-C 112.605 0.595 . . . . 0.0 112.605 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.885 ' HA ' HD21 ' A' ' 928' ' ' ASN . 16.3 m -65.87 -28.76 44.86 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.394 0 CA-C-O 120.96 0.41 . . . . 0.0 110.575 178.237 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -78.71 -31.76 46.64 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.814 172.326 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -77.08 -24.14 51.89 Favored 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 118.837 -1.145 . . . . 0.0 113.528 -177.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.885 HD21 ' HA ' ' A' ' 925' ' ' VAL . 8.8 p30 -70.75 -45.8 64.14 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 118.388 -1.325 . . . . 0.0 109.106 166.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.626 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 98.3 t -53.04 -33.84 20.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 N-CA-C 113.809 1.041 . . . . 0.0 113.809 171.031 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . . . . . . . . . 33.1 m -62.05 -43.42 98.88 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 119.884 1.22 . . . . 0.0 108.836 174.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -67.8 -51.73 33.49 Favored Glycine 0 CA--C 1.53 1.025 0 CA-C-N 114.65 -1.159 . . . . 0.0 113.574 175.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.626 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.8 pp -65.66 -49.13 69.76 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -174.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.455 HG23 HG13 ' A' ' 929' ' ' VAL . 53.3 t -65.89 -37.97 81.07 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.417 0 CA-C-O 121.101 0.477 . . . . 0.0 110.466 -176.007 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.55 ' HD2' ' C ' ' A' ' 934' ' ' LYS . 4.1 tmmm? -58.51 -41.01 84.44 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.99 178.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -67.45 -31.69 72.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.804 0.335 . . . . 0.0 111.498 -179.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.762 HG22 ' HB1' ' A' 1025 ' ' ALA . 80.2 t -54.45 -65.92 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.052 178.502 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 25.6 pt -70.24 -39.33 76.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.414 -178.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -65.51 -52.21 54.34 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 120.194 -0.602 . . . . 0.0 110.451 -173.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -70.52 -24.97 62.92 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.462 -176.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.548 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 28.7 p . . . . . 0 N--CA 1.454 -0.253 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.737 -171.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.799 ' CE1' ' HD3' ' A' 1018 ' ' LYS . 30.9 m-85 . . . . . 0 C--O 1.217 -0.617 0 N-CA-C 114.544 1.312 . . . . 0.0 114.544 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 0.601 ' HA ' ' CG2' ' A' ' 955' ' ' VAL . 46.9 t -53.15 -45.38 98.3 Favored Pre-proline 0 C--N 1.319 -0.737 0 C-N-CA 122.944 0.497 . . . . 0.0 111.256 170.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 0.599 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 48.8 Cg_exo -51.53 -38.31 64.32 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 122.071 1.847 . . . . 0.0 112.078 172.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.436 ' O ' HG12 ' A' ' 958' ' ' VAL . 7.0 tpt -77.45 -32.48 54.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.076 -0.966 . . . . 0.0 110.644 175.624 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.65 HG22 ' SD ' ' A' 1002 ' ' MET . 88.9 t -52.92 -38.71 29.42 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 167.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.546 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 12.4 tmtt? -66.87 -35.48 80.11 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.451 175.346 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -78.66 -46.79 18.36 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -177.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.527 ' O ' ' HG ' ' A' ' 962' ' ' LEU . 11.2 p -83.58 -30.36 7.92 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.365 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.299 -178.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -61.09 -38.89 96.31 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 110.617 -0.993 . . . . 0.0 110.617 174.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . 0.581 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 9.4 tt -70.15 -36.41 74.72 Favored 'General case' 0 C--O 1.223 -0.296 0 CA-C-O 120.935 0.397 . . . . 0.0 110.146 177.297 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.577 ' O ' ' HB2' ' A' ' 928' ' ' ASN . . . -72.68 -42.56 64.12 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.152 0.501 . . . . 0.0 111.523 -176.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 1.05 HD13 HD22 ' A' ' 995' ' ' LEU . 4.1 pp -81.5 -24.63 36.57 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.466 -179.167 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.581 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 4.9 ptp180 -73.73 -31.04 63.18 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 119.159 -1.017 . . . . 0.0 109.934 168.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . 0.402 HG22 ' HB3' ' A' ' 928' ' ' ASN . 93.1 m -62.86 -32.52 73.77 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 174.025 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.996 HD23 HD22 ' A' ' 991' ' ' LEU . 63.5 tp -65.46 -55.66 16.7 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.235 174.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.534 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 9.5 tt -55.54 -41.18 72.86 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 114.199 -1.364 . . . . 0.0 109.901 -175.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -72.43 -36.74 68.65 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.289 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.488 HG21 ' HB2' ' A' ' 924' ' ' LYS . 22.2 m -66.29 -42.04 88.95 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.446 176.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.733 HG12 HG23 ' A' ' 984' ' ' ILE . 18.0 t -73.22 -33.55 41.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.929 178.412 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.891 ' HB2' HE22 ' A' ' 988' ' ' GLN . 7.6 t70 -68.16 -42.46 80.02 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 122.087 0.946 . . . . 0.0 108.815 178.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.658 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 31.9 tt0 -69.82 -29.86 67.23 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-N 114.082 -1.417 . . . . 0.0 109.874 178.114 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 73.2 m -67.21 -17.66 64.91 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.664 174.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.701 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 10.2 tt -68.64 -51.69 21.14 Favored Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 121.064 -0.254 . . . . 0.0 110.39 -178.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.701 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 2.6 Cg_endo -84.95 -27.62 1.16 Allowed 'Trans proline' 0 C--N 1.359 1.08 0 C-N-CA 121.771 1.647 . . . . 0.0 114.206 174.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . . . . . . . . . 52.3 t . . . . . 0 N--CA 1.468 0.44 0 O-C-N 122.155 -0.341 . . . . 0.0 111.376 -177.041 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.7 HG23 ' HB1' ' A' 1042 ' ' ALA . 74.7 m . . . . . 0 CA--C 1.536 0.43 0 CA-C-O 121.595 0.712 . . . . 0.0 109.184 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.574 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 1.7 p80 -48.88 -35.28 14.4 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 114.214 -1.357 . . . . 0.0 114.563 -174.367 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . 0.402 ' HA ' ' OE2' ' A' ' 985' ' ' GLU . 3.8 ptp180 -78.96 -19.33 51.96 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 118.867 0.758 . . . . 0.0 111.062 -169.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.57 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 0.0 OUTLIER -76.52 -37.94 55.93 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 120.401 -0.52 . . . . 0.0 109.865 171.928 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.803 HG13 HG12 ' A' 1039 ' ' ILE . 3.6 mp -66.51 -35.75 75.63 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.486 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 175.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . 0.574 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 40.5 mt-10 -56.99 -52.88 63.51 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.598 178.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 89.9 mtp -70.57 -39.88 73.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.478 -174.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.997 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -76.9 -52.41 9.5 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.868 -1.06 . . . . 0.0 112.792 -169.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.891 HE22 ' HB2' ' A' ' 970' ' ' ASP . 3.7 pt20 -64.32 -24.88 67.8 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 121.6 0.714 . . . . 0.0 109.498 179.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . 0.798 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 31.7 tttm -73.39 -38.87 65.49 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.748 -1.115 . . . . 0.0 111.742 172.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.5 ' HG ' ' OD2' ' A' 1031 ' ' ASP . 17.1 tp -57.39 -58.27 9.02 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.423 -0.511 . . . . 0.0 112.275 178.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.996 HD22 HD23 ' A' ' 965' ' ' LEU . 13.6 tp -55.03 -34.45 63.52 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-O 121.365 0.602 . . . . 0.0 110.085 175.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . 0.798 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 24.7 t-20 -48.47 -53.21 18.8 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.197 -1.365 . . . . 0.0 111.606 -178.163 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 6.5 p -77.6 -29.95 52.2 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 120.591 -0.443 . . . . 0.0 112.131 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . 0.438 ' O ' ' HB2' ' A' ' 997' ' ' GLU . 0.9 OUTLIER -69.76 -39.04 76.95 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 119.646 -0.822 . . . . 0.0 110.741 -179.866 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 1.05 HD22 HD13 ' A' ' 962' ' ' LEU . 2.2 pp -68.41 -17.44 64.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.7 171.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -78.43 -24.38 46.18 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 119.523 -0.871 . . . . 0.0 110.259 168.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.654 ' O ' ' HG2' ' A' 1001 ' ' LYS . 71.6 mm-40 -72.08 -45.99 58.55 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 172.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.726 HD22 HD11 ' A' 1028 ' ' LEU . 0.2 OUTLIER -56.03 -46.76 78.74 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.752 -178.147 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.761 ' HA ' ' SD ' ' A' 1002 ' ' MET . 84.1 mt -66.99 -36.8 78.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.428 -173.392 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 19.9 m-80 -64.05 -35.36 80.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.124 0.488 . . . . 0.0 111.5 177.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.654 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 44.7 mmtm -77.4 -45.28 26.38 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.78 0.8 . . . . 0.0 109.792 -174.258 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 1.01 ' HB3' ' HG3' ' A' 1021 ' ' MET . 7.1 ptm -63.76 -25.92 68.41 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 122.165 0.983 . . . . 0.0 108.973 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.619 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 9.4 tptm -69.55 -52.66 24.26 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.439 -167.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.804 HD13 ' HG3' ' A' 1007 ' ' GLN . 4.0 mm? -75.33 -12.59 60.3 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.483 -0.781 . . . . 0.0 111.592 179.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.754 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -71.96 -37.78 69.87 Favored 'General case' 0 C--O 1.213 -0.828 0 C-N-CA 119.389 -0.924 . . . . 0.0 110.52 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.695 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.4 pp0? -76.3 -30.69 57.85 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 119.105 -0.474 . . . . 0.0 110.984 173.132 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.804 ' HG3' HD13 ' A' 1004 ' ' LEU . 17.2 mm-40 -48.3 -49.28 34.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.393 0.616 . . . . 0.0 109.989 175.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.504 ' HB2' HD12 ' A' 1013 ' ' LEU . 68.7 m-85 -129.09 55.04 1.76 Allowed 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 121.483 0.659 . . . . 0.0 110.419 170.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 0.995 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 4.7 p -56.51 -25.54 21.15 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.527 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.786 168.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 59.8 mtt -74.01 1.32 11.21 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 114.818 -1.083 . . . . 0.0 111.081 176.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1011 ' ' THR . . . . . 0.593 HG22 ' H ' ' A' 1012 ' ' SER . 0.2 OUTLIER -151.63 -154.77 0.56 Allowed 'General case' 0 C--O 1.26 1.606 0 CA-C-O 122.9 1.333 . . . . 0.0 114.043 -176.357 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A 1012 ' ' SER . . . . . 0.593 ' H ' HG22 ' A' 1011 ' ' THR . 15.1 m -59.06 -43.84 91.77 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 113.902 -1.499 . . . . 0.0 112.376 -170.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1013 ' ' LEU . . . . . 0.669 ' O ' ' HB2' ' A' 1017 ' ' TYR . 13.2 mt -48.6 -43.23 35.94 Favored 'General case' 0 CA--C 1.494 -1.183 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.888 178.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 0.995 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.72 -54.08 46.56 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-O 121.521 0.677 . . . . 0.0 109.798 -171.374 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -67.01 -44.94 79.02 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 114.283 -1.326 . . . . 0.0 110.825 -174.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -65.67 -56.21 13.37 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.296 0.569 . . . . 0.0 111.799 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.754 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 6.7 m-85 -62.02 -34.52 76.37 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.988 -1.005 . . . . 0.0 113.149 -172.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.799 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 55.6 tptt -80.61 -30.72 36.77 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.74 -176.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -73.0 -49.79 26.88 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 174.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -54.65 -30.54 55.5 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 114.999 -1.001 . . . . 0.0 110.782 165.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 1.01 ' HG3' ' HB3' ' A' 1002 ' ' MET . 2.5 ttp -68.95 -48.16 63.89 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 175.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' 1022 ' ' LEU . 0.0 OUTLIER -79.13 -12.28 59.99 Favored 'General case' 0 C--O 1.216 -0.702 0 C-N-CA 119.835 -0.746 . . . . 0.0 109.977 -177.016 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 97.8 m -84.45 -36.07 22.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.111 175.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.52 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.73 -22.08 47.09 Favored 'General case' 0 C--O 1.222 -0.369 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 171.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.762 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -84.92 -21.98 29.45 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.877 -0.602 . . . . 0.0 109.887 169.069 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.509 ' O ' HG23 ' A' 1030 ' ' VAL . 8.5 t60 -76.0 -27.18 57.32 Favored 'General case' 0 C--O 1.217 -0.624 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 165.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . 0.448 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -69.27 -39.94 78.09 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 123.355 0.662 . . . . 0.0 110.09 164.045 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.726 HD11 HD22 ' A' ' 998' ' ' LEU . 26.0 mt -61.3 -44.61 96.92 Favored 'General case' 0 C--N 1.315 -0.921 0 C-N-CA 120.353 -0.539 . . . . 0.0 109.615 170.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -59.09 -40.28 84.81 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.529 0.204 . . . . 0.0 111.476 173.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.509 HG23 ' O ' ' A' 1026 ' ' HIS . 9.5 t -69.11 -46.31 78.41 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 CA-C-O 121.7 0.762 . . . . 0.0 110.179 -178.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.5 ' OD2' ' HG ' ' A' ' 990' ' ' LEU . 5.5 t70 -71.84 -42.54 66.81 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 114.339 -1.301 . . . . 0.0 110.187 -174.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.601 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -59.98 -36.27 76.8 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 174.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 36.4 tttm -66.14 -55.01 18.52 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.631 0.729 . . . . 0.0 110.001 173.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.47 ' O ' ' HB3' ' A' 1037 ' ' ASP . 9.6 t30 -64.91 -48.66 73.38 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 114.587 -1.188 . . . . 0.0 112.552 -172.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.997 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 2.0 pp -63.99 -40.67 96.89 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 119.401 -0.333 . . . . 0.0 110.108 -176.382 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.638 HD22 HG23 ' A' ' 925' ' ' VAL . 4.0 pp -70.59 -33.68 71.33 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 117.232 -1.787 . . . . 0.0 109.618 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.47 ' HB3' ' O ' ' A' 1034 ' ' ASN . 18.3 t70 -58.25 -44.36 88.27 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.654 173.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.46 ' HB ' ' O ' ' A' 1035 ' ' LEU . 24.8 t -55.09 -39.38 50.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 113.708 -1.587 . . . . 0.0 111.269 174.284 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.803 HG12 HG13 ' A' ' 984' ' ' ILE . 1.7 mp -80.45 -33.13 13.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.374 176.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.61 -44.26 76.85 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 121.536 0.684 . . . . 0.0 109.482 170.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -70.06 -39.22 75.81 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.058 174.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.7 ' HB1' HG23 ' A' ' 980' ' ' THR . . . -55.62 -52.51 63.55 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -177.414 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.648 ' HG2' ' O ' ' A' 1039 ' ' ILE . 5.7 ptm180 -66.1 -41.14 91.02 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 -176.379 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 44.5 tp . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 115.987 -0.552 . . . . 0.0 109.895 174.225 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.717 ' HB2' HG21 ' A' ' 968' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.539 0 N-CA-C 114.444 1.276 . . . . 0.0 114.444 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.683 ' H ' ' HD2' ' A' ' 924' ' ' LYS . 4.1 t -53.62 -40.57 42.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 CA-C-N 119.148 0.886 . . . . 0.0 111.895 -169.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -80.03 -20.94 44.17 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.084 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . 0.587 ' HG2' ' O ' ' A' ' 924' ' ' LYS . 9.3 pt-20 -76.71 -24.17 53.11 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 120.173 1.351 . . . . 0.0 109.542 169.286 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.55 ' OD1' ' HA ' ' A' ' 925' ' ' VAL . 1.1 m120 -68.57 -29.7 68.31 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 170.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.578 ' HA ' ' CD2' ' A' ' 932' ' ' LEU . 44.3 t -80.5 -30.24 12.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 114.726 -1.125 . . . . 0.0 109.841 175.258 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.457 ' OG1' ' HA ' ' A' ' 927' ' ' GLU . 31.1 m -57.36 -43.4 83.47 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 168.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -66.55 -52.35 35.43 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-N 114.518 -1.219 . . . . 0.0 114.106 176.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.578 ' CD2' ' HA ' ' A' ' 929' ' ' VAL . 2.2 pp -65.29 -49.32 69.96 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -175.269 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.456 HG22 ' CB ' ' A' 1029 ' ' ALA . 76.7 t -62.1 -42.17 94.0 Favored 'Isoleucine or valine' 0 C--O 1.242 0.68 0 CA-C-O 121.399 0.619 . . . . 0.0 110.312 -176.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.472 ' O ' ' HB2' ' A' ' 938' ' ' GLU . 4.7 tmmm? -58.52 -39.04 79.02 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.612 -1.176 . . . . 0.0 109.906 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 0.56 ' HA ' ' SD ' ' A' ' 939' ' ' MET . . . -66.75 -35.41 80.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.569 0.223 . . . . 0.0 111.169 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.673 HG22 ' HB1' ' A' 1025 ' ' ALA . 59.8 t -53.24 -77.12 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.687 -179.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.511 ' O ' ' HB2' ' A' ' 940' ' ' SER . 27.1 pt -67.43 -42.57 87.4 Favored 'Isoleucine or valine' 0 C--O 1.249 1.062 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -174.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.472 ' HB2' ' O ' ' A' ' 934' ' ' LYS . 7.5 mm-40 -66.49 -46.5 76.1 Favored 'General case' 0 C--N 1.315 -0.929 0 C-N-CA 120.932 -0.307 . . . . 0.0 110.928 -170.149 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.56 ' SD ' ' HA ' ' A' ' 935' ' ' ALA . 1.0 OUTLIER -69.84 -28.33 65.6 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.174 178.032 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.751 ' HA ' ' NZ ' ' A' 1018 ' ' LYS . 4.6 m . . . . . 0 CA--C 1.514 -0.434 0 O-C-N 123.542 0.526 . . . . 0.0 112.355 -171.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 1.029 ' HB3' ' HG3' ' A' 1002 ' ' MET . 16.5 m-85 . . . . . 0 C--O 1.214 -0.79 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 0.784 ' O ' HG12 ' A' ' 955' ' ' VAL . 66.6 t -53.82 -54.06 50.81 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 117.949 0.34 . . . . 0.0 111.142 174.079 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 0.721 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 12.8 Cg_exo -48.3 -43.82 30.88 Favored 'Trans proline' 0 CA--C 1.545 1.071 0 C-N-CA 121.703 1.602 . . . . 0.0 113.413 170.588 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . . . . . . . . . 5.2 tpt -71.12 -48.21 53.56 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.547 0.739 . . . . 0.0 112.023 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.784 HG12 ' O ' ' A' ' 952' ' ' VAL . 0.3 OUTLIER -54.27 -29.65 19.8 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.772 169.059 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.531 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 9.5 tmtt? -68.64 -31.61 70.87 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.585 0.231 . . . . 0.0 111.296 169.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . 0.673 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 18.6 mm-40 -77.76 -44.69 26.84 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.395 0.617 . . . . 0.0 110.247 -176.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.458 HG12 ' HA ' ' A' ' 955' ' ' VAL . 7.3 p -77.01 -27.38 16.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.283 178.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . 0.508 ' HA2' HD11 ' A' ' 995' ' ' LEU . . . -65.44 -34.96 90.69 Favored Glycine 0 N--CA 1.448 -0.529 0 N-CA-C 110.293 -1.123 . . . . 0.0 110.293 170.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . 0.593 HD12 ' HD3' ' A' ' 963' ' ' ARG . 25.8 tp -63.67 -32.66 74.21 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.022 -0.589 . . . . 0.0 110.526 174.405 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.472 ' HB1' ' HB3' ' A' ' 932' ' ' LEU . . . -75.58 -58.19 3.43 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 121.137 -0.225 . . . . 0.0 110.612 -178.324 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.608 HD13 HD12 ' A' ' 991' ' ' LEU . 0.4 OUTLIER -42.82 -50.7 5.64 Favored 'General case' 0 C--O 1.212 -0.918 0 N-CA-C 112.748 0.648 . . . . 0.0 112.748 168.827 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.593 ' HD3' HD12 ' A' ' 960' ' ' LEU . 3.5 ptm180 -65.82 -28.51 69.04 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 119.654 1.116 . . . . 0.0 110.745 -177.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 38.8 m -68.78 -39.26 80.28 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 173.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.521 HD21 HD21 ' A' 1035 ' ' LEU . 0.1 OUTLIER -66.36 -38.96 88.79 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.389 -1.278 . . . . 0.0 110.66 177.287 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.837 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 9.9 tt -76.48 -38.79 54.76 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 115.415 -0.811 . . . . 0.0 108.92 -172.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -71.13 -31.66 68.0 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.304 177.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.717 HG21 ' HB2' ' A' ' 924' ' ' LYS . 11.8 p -68.77 -39.98 79.94 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 118.654 0.661 . . . . 0.0 110.29 175.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.893 HG12 HG23 ' A' ' 984' ' ' ILE . 97.7 t -71.14 -40.73 75.38 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.045 173.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.855 ' HB2' HE22 ' A' ' 988' ' ' GLN . 19.4 t70 -64.79 -42.98 94.62 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 122.003 0.906 . . . . 0.0 108.691 -179.103 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.687 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 11.2 tp10 -61.48 -38.13 86.16 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 114.032 -1.44 . . . . 0.0 109.415 177.123 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.716 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 58.8 m -64.42 -18.94 65.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.772 179.053 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.841 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 8.8 tt -66.89 -53.24 27.77 Favored Pre-proline 0 CA--C 1.536 0.434 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 -179.618 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.841 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 4.8 Cg_exo -80.83 -17.61 9.54 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 121.71 1.606 . . . . 0.0 113.78 172.063 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.716 ' HB ' ' HA ' ' A' ' 972' ' ' SER . 3.5 t . . . . . 0 N--CA 1.467 0.386 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -178.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.759 HG23 ' HB1' ' A' 1042 ' ' ALA . 67.4 m . . . . . 0 N--CA 1.448 -0.562 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.557 ' HA ' HD12 ' A' ' 984' ' ' ILE . 2.0 p-80 -52.04 -23.33 5.07 Favored 'General case' 0 C--O 1.216 -0.669 0 CA-C-N 113.971 -1.468 . . . . 0.0 113.403 179.03 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -82.56 -21.42 35.3 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 119.081 0.855 . . . . 0.0 110.755 178.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.73 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 0.2 OUTLIER -78.63 -33.98 46.87 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 168.454 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.893 HG23 HG12 ' A' ' 969' ' ' VAL . 53.5 mt -70.15 -30.65 44.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 114.766 -1.106 . . . . 0.0 108.055 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . 0.518 ' O ' ' HG3' ' A' ' 989' ' ' LYS . 9.6 mm-40 -64.1 -55.35 22.67 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.783 174.417 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 65.3 mtt -71.11 -44.78 64.95 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.131 -0.94 . . . . 0.0 111.619 -168.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 1.021 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -66.6 -49.38 66.49 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.069 -0.968 . . . . 0.0 112.288 -173.352 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.855 HE22 ' HB2' ' A' ' 970' ' ' ASP . 3.2 pt20 -61.76 -29.92 70.45 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 119.817 -0.753 . . . . 0.0 111.26 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . 0.743 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 50.9 mttm -70.5 -39.16 74.31 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.616 0.722 . . . . 0.0 111.396 174.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.622 HD23 ' HB3' ' A' 1035 ' ' LEU . 15.8 tp -49.94 -60.49 2.87 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.447 -178.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.724 HD21 ' HA ' ' A' 1028 ' ' LEU . 0.3 OUTLIER -67.99 -28.55 67.53 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.522 0.677 . . . . 0.0 109.788 -179.885 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . 0.743 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 22.7 t-20 -52.27 -55.44 21.31 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.346 -1.297 . . . . 0.0 111.023 178.278 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 30.8 t -76.41 -34.75 58.82 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.383 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . 0.464 ' O ' ' HB3' ' A' ' 997' ' ' GLU . 0.7 OUTLIER -65.27 -37.04 85.97 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.6 -0.44 . . . . 0.0 112.162 179.306 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 1.035 ' HG ' HD23 ' A' ' 998' ' ' LEU . 6.8 tt -72.0 -17.49 62.04 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 122.32 -0.238 . . . . 0.0 110.546 172.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -72.8 -25.73 61.25 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 119.446 -0.901 . . . . 0.0 110.032 166.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.464 ' HB3' ' O ' ' A' ' 994' ' ' ASP . 12.1 tp10 -74.97 -38.4 61.68 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 173.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 1.035 HD23 ' HG ' ' A' ' 995' ' ' LEU . 0.1 OUTLIER -56.38 -46.39 80.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.039 178.629 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.589 ' O ' ' HB2' ' A' 1003 ' ' LYS . 76.2 mt -60.7 -46.11 96.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.679 -175.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -58.04 -39.87 79.49 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -175.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.554 ' O ' ' HB3' ' A' 1017 ' ' TYR . 32.7 mmtp -84.15 -37.05 22.42 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.721 0.772 . . . . 0.0 110.119 -175.551 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 1.029 ' HG3' ' HB3' ' A' ' 951' ' ' TYR . 34.3 tpp -57.97 -32.54 67.96 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.731 -1.122 . . . . 0.0 108.821 172.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.589 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 13.4 tptp -70.39 -53.7 15.46 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 113.808 -1.542 . . . . 0.0 111.369 -167.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.65 HD13 ' HG3' ' A' 1007 ' ' GLN . 4.1 mm? -76.9 -13.16 60.02 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.681 -177.383 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.629 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -68.45 -47.98 65.73 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 119.664 -0.814 . . . . 0.0 109.762 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.906 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 8.4 pt20 -70.87 -36.16 72.69 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 119.941 -0.704 . . . . 0.0 111.898 171.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.65 ' HG3' HD13 ' A' 1004 ' ' LEU . 12.4 mm100 -43.13 -51.55 5.86 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.108 0.48 . . . . 0.0 110.734 177.086 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.688 ' HB2' ' HG ' ' A' 1013 ' ' LEU . 66.4 m-85 -123.71 52.3 1.45 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.52 0.676 . . . . 0.0 110.088 169.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 0.983 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 13.0 p -53.73 -18.05 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.423 0 CA-C-N 114.576 -1.193 . . . . 0.0 110.288 169.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1010 ' ' MET . . . . . 0.418 ' C ' ' HG1' ' A' 1011 ' ' THR . 16.4 ptp -62.31 81.17 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.078 166.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1011 ' ' THR . . . . . 0.418 ' HG1' ' C ' ' A' 1010 ' ' MET . 45.8 p 68.0 -89.08 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 126.231 1.812 . . . . 0.0 114.589 175.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 37.6 m -45.98 -79.38 0.01 OUTLIER 'General case' 0 C--O 1.241 0.638 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 -165.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1013 ' ' LEU . . . . . 0.688 ' HG ' ' HB2' ' A' 1008 ' ' TYR . 13.3 mt -54.57 -35.17 63.02 Favored 'General case' 0 CA--C 1.501 -0.92 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 -174.784 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 0.983 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.39 -48.61 71.36 Favored 'General case' 0 N--CA 1.445 -0.718 0 O-C-N 123.646 0.591 . . . . 0.0 110.912 -167.78 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.403 ' O ' ' HD3' ' A' 1019 ' ' LYS . 3.2 pt20 -75.17 -41.06 58.88 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.565 -176.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -72.64 -46.74 52.5 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.203 0.525 . . . . 0.0 111.042 -176.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.629 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 6.9 m-85 -67.87 -36.5 80.39 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.48 -176.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.789 ' HE2' ' CE ' ' A' 1021 ' ' MET . 9.5 tptm -79.86 -26.61 40.3 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.587 -175.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . 0.403 ' HD3' ' O ' ' A' 1015 ' ' GLN . 1.1 mptm? -74.18 -42.16 60.3 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 174.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -57.34 -35.04 69.41 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.191 163.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.789 ' CE ' ' HE2' ' A' 1018 ' ' LYS . 6.6 tmm? -66.41 -53.6 33.94 Favored 'General case' 0 C--O 1.219 -0.505 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 -179.039 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . 0.522 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -78.98 -8.53 58.99 Favored 'General case' 0 C--O 1.22 -0.46 0 C-N-CA 119.367 -0.933 . . . . 0.0 109.852 -171.472 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 82.6 m -88.15 -35.27 17.51 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.944 174.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.488 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -79.0 -22.72 45.12 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-O 121.222 0.534 . . . . 0.0 109.582 171.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.673 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -86.18 -23.92 26.33 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.927 170.213 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.525 ' O ' HG23 ' A' 1030 ' ' VAL . 63.8 t60 -75.96 -22.58 55.76 Favored 'General case' 0 C--O 1.214 -0.777 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 164.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . 0.488 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -73.2 -39.11 65.83 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 123.282 0.633 . . . . 0.0 109.386 165.231 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.724 ' HA ' HD21 ' A' ' 991' ' ' LEU . 14.4 mt -59.87 -48.15 82.85 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 168.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . 0.456 ' CB ' HG22 ' A' ' 933' ' ' VAL . . . -57.73 -42.72 84.44 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.867 -0.151 . . . . 0.0 111.358 175.234 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.525 HG23 ' O ' ' A' 1026 ' ' HIS . 8.0 t -69.19 -51.79 39.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.318 0.58 . . . . 0.0 110.877 -176.623 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.537 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 12.4 m-20 -77.15 -29.38 54.56 Favored 'General case' 0 C--O 1.214 -0.779 0 CA-C-N 115.338 -0.847 . . . . 0.0 112.661 -174.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.426 ' HA ' ' CD2' ' A' 1035 ' ' LEU . . . -70.32 -31.24 68.46 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 172.224 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.55 ' HE2' ' O ' ' A' 1033 ' ' LYS . 1.0 OUTLIER -63.83 -49.95 70.81 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 168.892 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.537 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 42.2 t30 -64.13 -53.94 41.66 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-N 113.921 -1.49 . . . . 0.0 112.474 -175.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 1.021 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 2.3 pp -60.47 -41.27 93.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 119.638 -0.22 . . . . 0.0 110.551 -172.242 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.536 ' HG ' ' HB ' ' A' ' 925' ' ' VAL . 1.0 OUTLIER -68.77 -43.95 74.69 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 117.974 -1.491 . . . . 0.0 109.142 179.12 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.524 ' HB3' ' O ' ' A' 1034 ' ' ASN . 12.1 t70 -49.28 -42.91 42.54 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 114.801 -1.091 . . . . 0.0 110.22 173.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.611 ' CG1' ' HG3' ' A' ' 983' ' ' GLU . 21.2 t -56.82 -48.7 80.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 113.488 -1.687 . . . . 0.0 111.966 176.064 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.731 ' O ' ' HG2' ' A' 1043 ' ' ARG . 2.0 mp -70.68 -31.48 46.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 118.761 0.709 . . . . 0.0 111.435 177.039 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.405 ' HA ' ' HD2' ' A' 1043 ' ' ARG . 0.2 OUTLIER -63.38 -47.41 82.18 Favored 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.559 174.204 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -61.58 -43.87 98.06 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.006 0.432 . . . . 0.0 109.863 172.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.759 ' HB1' HG23 ' A' ' 980' ' ' THR . . . -54.1 -50.99 65.58 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -176.399 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.731 ' HG2' ' O ' ' A' 1039 ' ' ILE . 1.3 ptp180 -63.7 -46.94 83.2 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.477 -174.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . 0.532 HD22 ' HG3' ' A' 1043 ' ' ARG . 3.7 mm? . . . . . 0 C--N 1.332 -0.191 0 CA-C-O 120.764 0.316 . . . . 0.0 111.016 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.48 ' O ' ' HG2' ' A' ' 927' ' ' GLU . 4.9 tptp . . . . . 0 N--CA 1.47 0.56 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.825 HG13 ' HB2' ' A' 1036 ' ' LEU . 1.5 p -62.45 -28.81 45.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 CA-C-O 121.291 0.567 . . . . 0.0 110.83 177.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . 0.619 ' HA ' HD22 ' A' 1036 ' ' LEU . 0.0 OUTLIER -68.09 -30.02 69.1 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.498 0.719 . . . . 0.0 111.555 174.986 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 924' ' ' LYS . 3.6 pt-20 -74.97 -23.22 58.25 Favored 'General case' 0 C--N 1.315 -0.935 0 C-N-CA 118.661 -1.215 . . . . 0.0 109.636 -179.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.419 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 1.6 m120 -75.48 -30.98 60.07 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 172.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.656 HG22 HD21 ' A' ' 932' ' ' LEU . 83.3 t -81.68 -30.41 10.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.745 178.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.466 HG22 ' O ' ' A' ' 927' ' ' GLU . 3.1 t -65.37 -26.69 68.12 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 170.139 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -72.03 -52.87 10.21 Favored Glycine 0 CA--C 1.531 1.044 0 CA-C-N 115.047 -0.978 . . . . 0.0 113.379 172.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.656 HD21 HG22 ' A' ' 929' ' ' VAL . 3.2 pp -65.8 -47.43 75.15 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -177.617 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 95.6 t -64.37 -34.39 69.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 CA-C-O 121.375 0.607 . . . . 0.0 110.237 -177.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.494 ' O ' ' HB3' ' A' ' 938' ' ' GLU . 37.9 tptt -62.48 -34.03 76.03 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.516 176.131 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -68.62 -40.31 80.4 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.316 -0.554 . . . . 0.0 110.644 174.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.834 HG22 ' HB1' ' A' 1025 ' ' ALA . 88.3 t -47.38 -78.92 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 123.417 0.687 . . . . 0.0 112.511 -178.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 19.2 pt -70.49 -41.94 78.22 Favored 'Isoleucine or valine' 0 C--O 1.249 1.028 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -175.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.494 ' HB3' ' O ' ' A' ' 934' ' ' LYS . 5.2 tp10 -70.46 -48.08 57.54 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.426 -168.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.54 ' SD ' ' HB2' ' A' ' 954' ' ' MET . 16.2 ttt -74.49 -27.27 60.49 Favored 'General case' 0 C--N 1.308 -1.219 0 C-N-CA 119.276 -0.97 . . . . 0.0 110.05 -178.395 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.699 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 26.3 t . . . . . 0 CA--C 1.519 -0.247 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.512 -171.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 1.004 ' HB3' ' HG2' ' A' 1002 ' ' MET . 20.5 m-30 . . . . . 0 CA--C 1.539 0.55 0 N-CA-C 114.255 1.206 . . . . 0.0 114.255 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 0.549 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 45.6 t -48.1 -44.69 62.07 Favored Pre-proline 0 CA--C 1.541 0.597 0 C-N-CA 122.849 0.46 . . . . 0.0 112.058 172.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 0.549 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 19.0 Cg_exo -47.62 -44.13 26.6 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 122.572 2.181 . . . . 0.0 113.185 173.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.779 ' HB3' ' HE1' ' A' 1002 ' ' MET . 14.1 ttt -71.76 -37.55 70.5 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 120.897 0.379 . . . . 0.0 110.227 175.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.519 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 86.2 t -52.96 -40.62 37.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.809 170.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.509 ' HE2' ' OE2' ' A' ' 957' ' ' GLU . 0.8 OUTLIER -62.7 -34.03 76.3 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.788 174.376 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . 0.509 ' OE2' ' HE2' ' A' ' 956' ' ' LYS . 69.7 mm-40 -77.87 -44.83 26.0 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.195 0.522 . . . . 0.0 111.111 -179.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.451 HG23 ' HB2' ' A' ' 932' ' ' LEU . 14.6 p -78.79 -29.37 14.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.928 -177.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -69.62 -35.52 74.6 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 110.549 -1.02 . . . . 0.0 110.549 172.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . 0.455 ' O ' ' HG2' ' A' ' 963' ' ' ARG . 8.6 tt -62.77 -41.22 99.13 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 174.121 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.422 ' CB ' ' HB3' ' A' ' 932' ' ' LEU . . . -69.32 -57.99 4.6 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 121.132 -0.227 . . . . 0.0 110.966 -179.593 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.597 ' HB2' HD22 ' A' ' 991' ' ' LEU . 0.1 OUTLIER -42.86 -49.22 5.85 Favored 'General case' 0 C--O 1.217 -0.642 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 169.763 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.466 ' N ' ' HG ' ' A' ' 962' ' ' LEU . 11.2 ptm180 -67.89 -28.77 67.8 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 120.108 1.322 . . . . 0.0 111.064 -179.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 28.0 m -68.3 -35.53 77.97 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 173.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.719 HD22 HD13 ' A' ' 991' ' ' LEU . 0.0 OUTLIER -66.57 -38.64 87.48 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 114.523 -1.217 . . . . 0.0 109.467 174.686 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 10.3 tt -65.92 -40.36 91.36 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-N 114.314 -1.312 . . . . 0.0 108.271 -177.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -65.29 -44.69 87.16 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.397 -0.82 . . . . 0.0 112.249 178.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 13.8 p -64.81 -41.02 96.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 118.858 0.753 . . . . 0.0 110.412 179.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.724 HG12 HG23 ' A' ' 984' ' ' ILE . 87.3 t -72.96 -41.85 60.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.021 176.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.76 ' HB2' HE22 ' A' ' 988' ' ' GLN . 14.0 t70 -67.03 -38.83 86.62 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 -177.57 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.625 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 14.2 tt0 -60.83 -33.85 73.66 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.012 -0.995 . . . . 0.0 109.773 174.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.506 ' HB2' ' O ' ' A' ' 969' ' ' VAL . 64.2 m -65.57 -18.29 65.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.085 177.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.727 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 10.5 tt -70.61 -52.02 11.45 Favored Pre-proline 0 CA--C 1.537 0.48 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.256 -178.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.727 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 2.2 Cg_endo -88.01 -4.7 6.95 Favored 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 121.758 1.639 . . . . 0.0 113.94 173.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 971' ' ' GLU . 15.9 t . . . . . 0 C--N 1.329 -0.287 0 C-N-CA 120.157 -0.617 . . . . 0.0 109.766 171.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.603 HG22 ' CD1' ' A' ' 984' ' ' ILE . 32.5 m . . . . . 0 CA--C 1.542 0.662 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.689 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 2.5 p80 -50.13 -34.52 22.45 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -175.352 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -82.66 -20.79 35.55 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -168.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.59 -37.65 41.93 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.316 0.579 . . . . 0.0 109.684 172.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.779 HG13 HG12 ' A' 1039 ' ' ILE . 2.5 mp -65.68 -29.74 47.94 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.524 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 176.005 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . 0.689 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 42.3 mt-10 -63.79 -52.45 60.2 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-O 121.36 0.6 . . . . 0.0 110.579 176.164 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 58.7 mtt -70.06 -46.34 65.17 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 114.978 -1.01 . . . . 0.0 111.424 -169.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.466 ' HA ' HD12 ' A' ' 990' ' ' LEU . . . -75.09 -51.11 14.29 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.719 -1.128 . . . . 0.0 112.776 -169.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.76 HE22 ' HB2' ' A' ' 970' ' ' ASP . 2.2 pt20 -63.29 -20.95 65.93 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 119.406 -0.918 . . . . 0.0 109.209 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . 0.62 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 9.1 ttmm -73.94 -42.43 60.58 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.042 -0.981 . . . . 0.0 112.591 170.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.498 HD13 HD11 ' A' 1035 ' ' LEU . 1.2 mt -56.29 -54.05 49.96 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -178.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.719 HD13 HD22 ' A' ' 965' ' ' LEU . 1.2 tt -65.22 -32.21 73.77 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 175.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . 0.677 ' HB2' ' O ' ' A' ' 988' ' ' GLN . 47.3 t-20 -53.95 -56.88 13.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.932 179.003 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 20.7 t -79.32 -33.88 42.77 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -177.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . 0.502 ' O ' ' HB3' ' A' ' 997' ' ' GLU . 0.2 OUTLIER -69.0 -33.41 73.63 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.17 -0.612 . . . . 0.0 111.705 178.946 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 0.611 ' N ' HD21 ' A' 1028 ' ' LEU . 2.9 tm? -69.33 -19.63 63.87 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 169.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -76.08 -21.76 56.36 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 119.434 -0.906 . . . . 0.0 110.415 167.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.594 ' HA ' ' ND2' ' A' 1000 ' ' ASN . 7.7 tp10 -75.25 -42.41 55.19 Favored 'General case' 0 C--O 1.239 0.528 0 C-N-CA 122.367 0.267 . . . . 0.0 110.532 173.228 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.961 HD12 ' HB2' ' A' 1025 ' ' ALA . 1.6 tt -56.53 -44.21 80.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.725 0.298 . . . . 0.0 110.366 177.518 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.546 HG13 ' O ' ' A' ' 995' ' ' LEU . 88.5 mt -66.46 -46.87 85.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 CA-C-N 115.868 -0.605 . . . . 0.0 112.274 -172.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . 0.594 ' ND2' ' HA ' ' A' ' 997' ' ' GLU . 10.2 p30 -63.21 -37.51 87.54 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.438 0.637 . . . . 0.0 111.374 -172.147 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.599 ' HD3' ' HB3' ' A' 1020 ' ' GLN . 49.9 mttp -83.96 -34.15 24.48 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.086 -178.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 1.004 ' HG2' ' HB3' ' A' ' 951' ' ' TYR . 12.7 ttt -62.48 -27.23 68.99 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 122.054 0.93 . . . . 0.0 109.013 175.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.55 ' O ' ' HG3' ' A' 1007 ' ' GLN . 10.3 tptp -72.91 -55.28 6.84 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-N 113.724 -1.58 . . . . 0.0 110.224 -170.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.417 HD23 ' CD ' ' A' 1007 ' ' GLN . 90.5 mt -66.24 -13.53 60.52 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.615 179.435 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.726 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -72.88 -51.76 17.4 Favored 'General case' 0 C--O 1.212 -0.898 0 C-N-CA 119.634 -0.827 . . . . 0.0 110.147 178.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.971 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -68.86 -32.39 72.02 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 118.332 0.515 . . . . 0.0 111.94 174.272 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.55 ' HG3' ' O ' ' A' 1003 ' ' LYS . 19.4 mt-30 -51.79 -40.86 61.11 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.18 0.514 . . . . 0.0 111.282 175.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.514 ' HB2' ' HG ' ' A' 1013 ' ' LEU . 54.9 m-85 -126.49 39.06 4.01 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.333 173.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 1.008 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 12.9 p -54.28 -22.14 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 CA-C-O 121.692 0.758 . . . . 0.0 110.332 177.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1010 ' ' MET . . . . . 0.497 ' O ' HG23 ' A' 1011 ' ' THR . 59.1 mtt -50.03 -29.32 8.47 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.355 -1.293 . . . . 0.0 111.831 177.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1011 ' ' THR . . . . . 0.497 HG23 ' O ' ' A' 1010 ' ' MET . 0.6 OUTLIER -163.79 -99.51 0.02 OUTLIER 'General case' 0 C--O 1.253 1.275 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 177.311 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 4.7 p -56.92 -65.24 0.65 Allowed 'General case' 0 C--O 1.237 0.438 0 CA-C-N 114.267 -1.333 . . . . 0.0 113.57 -163.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1013 ' ' LEU . . . . . 0.609 ' HB3' ' CD2' ' A' 1017 ' ' TYR . 8.9 mt -52.1 -37.01 52.64 Favored 'General case' 0 CA--C 1.501 -0.913 0 N-CA-C 111.558 0.207 . . . . 0.0 111.558 -177.395 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 1.008 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.35 -52.72 60.69 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-O 121.202 0.525 . . . . 0.0 110.974 -168.998 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.691 ' O ' ' HB3' ' A' 1019 ' ' LYS . 4.6 pp0? -71.42 -36.83 71.44 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.261 -174.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . 0.472 ' HA ' ' HD2' ' A' 1019 ' ' LYS . 17.3 tt0 -73.2 -51.64 17.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.8 0.809 . . . . 0.0 111.015 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.726 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 12.2 m-85 -66.85 -37.79 85.14 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -174.587 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.544 ' HE3' ' HA ' ' A' ' 940' ' ' SER . 45.7 tptt -79.99 -29.31 39.49 Favored 'General case' 0 N--CA 1.461 0.094 0 CA-C-N 115.056 -0.974 . . . . 0.0 109.967 -177.574 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . 0.691 ' HB3' ' O ' ' A' 1015 ' ' GLN . 0.0 OUTLIER -74.29 -40.41 62.29 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.778 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . 0.599 ' HB3' ' HD3' ' A' 1001 ' ' LYS . 48.0 mt-30 -60.86 -33.28 72.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.526 162.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.553 ' HG3' ' CG ' ' A' 1002 ' ' MET . 11.5 tmm? -65.19 -51.27 62.07 Favored 'General case' 0 CA--C 1.506 -0.723 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 -178.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . 0.862 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.1 OUTLIER -84.39 -2.67 57.52 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 119.231 -0.988 . . . . 0.0 109.76 -174.485 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 53.1 m -89.0 -34.07 16.96 Favored 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 171.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.529 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.76 -21.31 48.11 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 169.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.961 ' HB2' HD12 ' A' ' 998' ' ' LEU . . . -85.55 -24.4 27.26 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.785 169.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.583 ' O ' HG23 ' A' 1030 ' ' VAL . 53.6 t-80 -75.84 -23.09 55.71 Favored 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 164.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -73.04 -40.47 65.08 Favored 'General case' 0 C--N 1.318 -0.8 0 C-N-CA 123.345 0.658 . . . . 0.0 109.419 165.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.611 HD21 ' N ' ' A' ' 995' ' ' LEU . 26.3 mt -61.3 -43.92 98.08 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 170.288 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -59.5 -42.78 92.95 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 111.429 0.159 . . . . 0.0 111.429 173.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' 1026 ' ' HIS . 10.5 t -66.42 -50.58 66.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.237 0 CA-C-O 121.61 0.719 . . . . 0.0 110.346 -178.276 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -72.24 -39.54 68.4 Favored 'General case' 0 C--O 1.204 -1.308 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.113 -176.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.508 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -63.83 -35.44 80.63 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.917 -0.313 . . . . 0.0 110.235 176.429 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 8.0 tmtm? -61.57 -44.23 97.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.607 0.718 . . . . 0.0 109.624 172.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.511 ' O ' HG23 ' A' 1038 ' ' VAL . 40.5 t30 -70.8 -53.57 14.88 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 114.868 -1.06 . . . . 0.0 111.165 -177.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.634 HD23 ' HB2' ' A' ' 991' ' ' LEU . 0.0 OUTLIER -59.0 -42.17 89.43 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.192 -173.375 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.825 ' HB2' HG13 ' A' ' 925' ' ' VAL . 3.9 pp -62.9 -48.59 78.29 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 118.372 -1.331 . . . . 0.0 109.762 178.411 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.44 ' N ' HD12 ' A' 1036 ' ' LEU . 24.0 t70 -52.21 -38.61 58.45 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 114.165 -1.38 . . . . 0.0 110.784 175.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' 1034 ' ' ASN . 25.3 t -62.46 -50.62 79.14 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.916 0 CA-C-N 113.96 -1.473 . . . . 0.0 112.827 -179.383 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.779 HG12 HG13 ' A' ' 984' ' ' ILE . 1.5 mp -76.36 -29.33 18.79 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 CA-C-N 119.881 1.219 . . . . 0.0 111.666 -177.185 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.581 ' O ' ' HG3' ' A' 1043 ' ' ARG . 1.2 m-20 -55.87 -51.16 68.53 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.278 167.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . 0.619 ' O ' ' HB3' ' A' 1044 ' ' LEU . 36.2 mt-30 -77.1 -23.29 51.85 Favored 'General case' 0 C--N 1.312 -1.036 0 O-C-N 121.911 -0.493 . . . . 0.0 111.552 177.028 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.627 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -55.53 -52.94 62.01 Favored 'General case' 0 CA--C 1.495 -1.161 0 CA-C-O 121.577 0.703 . . . . 0.0 111.011 176.372 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.581 ' HG3' ' O ' ' A' 1040 ' ' ASP . 0.0 OUTLIER -63.55 -35.53 80.79 Favored 'General case' 0 N--CA 1.432 -1.365 0 CA-C-N 114.775 -1.102 . . . . 0.0 108.401 -179.536 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . 0.619 ' HB3' ' O ' ' A' 1041 ' ' GLN . 6.7 tt . . . . . 0 C--N 1.332 -0.168 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.407 175.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.416 ' HB3' HG21 ' A' ' 968' ' ' THR . 65.3 mmtt . . . . . 0 CA--C 1.531 0.216 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.782 HG11 HD13 ' A' 1036 ' ' LEU . 0.2 OUTLIER -70.72 -29.88 39.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 172.899 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . 0.506 ' HA ' ' HB ' ' A' ' 929' ' ' VAL . 0.1 OUTLIER -79.02 -21.0 47.58 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 178.566 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -73.15 -43.43 61.56 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 114.602 -1.181 . . . . 0.0 109.893 171.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.697 ' OD1' ' HB ' ' A' ' 964' ' ' THR . 69.7 m-80 -74.95 -27.32 60.14 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 119.159 0.89 . . . . 0.0 111.581 174.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.604 HG13 HG21 ' A' ' 933' ' ' VAL . 42.8 t -65.78 -33.31 62.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.194 167.245 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.679 ' O ' ' HB2' ' A' ' 934' ' ' LYS . 98.8 m -65.58 -42.68 91.46 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 119.372 0.987 . . . . 0.0 109.778 174.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -73.41 -53.9 7.21 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 120.603 -0.808 . . . . 0.0 113.621 179.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.503 ' O ' HG23 ' A' ' 936' ' ' VAL . 1.5 pp -64.47 -47.62 78.33 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -176.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.604 HG21 HG13 ' A' ' 929' ' ' VAL . 72.8 t -67.49 -36.61 76.87 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 CA-C-O 121.073 0.463 . . . . 0.0 111.028 -175.208 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.679 ' HB2' ' O ' ' A' ' 930' ' ' THR . 4.1 mmtp -62.75 -42.81 99.85 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.149 -179.642 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 0.511 ' HA ' ' SD ' ' A' ' 939' ' ' MET . . . -59.31 -35.47 73.86 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.717 0.294 . . . . 0.0 111.36 177.204 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.77 ' O ' ' HB2' ' A' ' 940' ' ' SER . 66.8 t -54.55 -74.87 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.729 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 21.1 pt -71.61 -42.5 71.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -174.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -64.42 -53.31 50.36 Favored 'General case' 0 C--O 1.243 0.738 0 CA-C-O 121.521 0.676 . . . . 0.0 110.634 -172.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.511 ' SD ' ' HA ' ' A' ' 935' ' ' ALA . 1.8 mpt? -71.21 -24.67 62.25 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 119.439 -0.904 . . . . 0.0 109.131 -178.545 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.77 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 5.0 t . . . . . 0 N--CA 1.454 -0.265 0 CA-C-O 121.824 0.821 . . . . 0.0 110.867 -175.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.59 ' CE1' ' HD3' ' A' 1018 ' ' LYS . 23.1 m-85 . . . . . 0 C--O 1.216 -0.69 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 0.754 ' HA ' ' CG2' ' A' ' 955' ' ' VAL . 43.4 t -56.13 -44.71 99.83 Favored Pre-proline 0 C--N 1.323 -0.57 0 C-N-CA 123.005 0.522 . . . . 0.0 111.322 171.014 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 0.593 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 47.0 Cg_exo -52.34 -36.36 68.31 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 121.843 1.696 . . . . 0.0 111.915 170.169 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.406 ' O ' HG12 ' A' ' 958' ' ' VAL . 32.3 ttm -76.69 -31.01 56.95 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.123 176.001 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.754 ' CG2' ' HA ' ' A' ' 952' ' ' VAL . 85.4 t -53.26 -39.36 34.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 168.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.58 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 0.7 OUTLIER -63.8 -39.64 94.74 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.124 175.104 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -76.18 -46.7 27.23 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.442 -171.277 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.662 HG22 HD23 ' A' ' 962' ' ' LEU . 11.7 p -87.8 -28.45 5.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.347 -178.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . 0.505 ' O ' ' HG2' ' A' ' 963' ' ' ARG . . . -61.99 -46.93 93.05 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.471 -0.871 . . . . 0.0 111.2 176.379 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . 0.467 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 9.5 tt -64.62 -34.27 77.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.039 0.447 . . . . 0.0 110.206 177.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.413 ' O ' ' HB3' ' A' ' 928' ' ' ASN . . . -72.5 -46.78 53.12 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -178.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.881 HD13 HD22 ' A' ' 995' ' ' LEU . 4.0 pp -84.55 -18.07 36.86 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 119.345 -0.36 . . . . 0.0 111.482 -176.37 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.506 ' HG3' ' N ' ' A' ' 964' ' ' THR . 8.5 ptp180 -70.31 -37.9 74.84 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 118.829 -1.148 . . . . 0.0 110.091 166.673 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . 0.697 ' HB ' ' OD1' ' A' ' 928' ' ' ASN . 10.5 m -71.13 -26.46 63.02 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.491 ' CD1' HG23 ' A' ' 925' ' ' VAL . 9.7 tp -63.27 -46.36 87.19 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.618 169.145 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.796 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 9.7 tt -66.62 -33.25 75.24 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -177.437 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . 0.55 ' HA ' ' HB3' ' A' ' 970' ' ' ASP . . . -75.24 -32.95 61.26 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 115.342 -0.845 . . . . 0.0 112.224 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.416 HG21 ' HB3' ' A' ' 924' ' ' LYS . 2.4 p -71.53 -35.26 70.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.173 0.511 . . . . 0.0 110.157 176.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.76 HG12 HG23 ' A' ' 984' ' ' ILE . 48.6 t -74.45 -34.92 37.41 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.731 170.345 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.648 ' HB2' HE22 ' A' ' 988' ' ' GLN . 12.8 t70 -66.66 -41.57 87.97 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 122.422 1.106 . . . . 0.0 108.77 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.681 ' O ' HG23 ' A' ' 975' ' ' VAL . 36.0 tt0 -66.23 -29.11 69.29 Favored 'General case' 0 N--CA 1.436 -1.171 0 CA-C-N 113.818 -1.537 . . . . 0.0 110.308 178.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 69.0 m -69.62 -19.09 63.64 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.643 175.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.93 ' HA ' HD13 ' A' ' 984' ' ' ILE . 5.8 tt -66.09 -51.14 47.58 Favored Pre-proline 0 N--CA 1.454 -0.272 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.333 -177.747 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.677 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 1.1 Cg_endo -85.7 0.18 8.53 Favored 'Trans proline' 0 C--N 1.357 1.01 0 C-N-CA 121.85 1.7 . . . . 0.0 113.416 173.191 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.681 HG23 ' O ' ' A' ' 971' ' ' GLU . 11.6 t . . . . . 0 N--CA 1.465 0.291 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.045 171.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.698 HG23 ' HB1' ' A' 1042 ' ' ALA . 14.4 m . . . . . 0 CA--C 1.532 0.278 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.656 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 16.1 m-70 -50.25 -39.1 43.95 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.013 -177.714 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 14.9 ptm180 -82.1 -18.56 42.59 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.675 -0.239 . . . . 0.0 111.121 -170.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.889 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 1.3 tp10 -75.19 -43.02 54.38 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 172.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.93 HD13 ' HA ' ' A' ' 973' ' ' LEU . 3.2 mp -65.54 -32.63 59.06 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 177.227 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . 0.656 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 34.6 mt-10 -55.25 -52.4 63.51 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.305 0.574 . . . . 0.0 110.262 174.417 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 45.8 ttm -72.71 -40.39 66.21 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 114.979 -1.01 . . . . 0.0 111.261 -173.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.867 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -75.02 -50.93 14.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.524 -1.216 . . . . 0.0 112.71 -172.189 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.796 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 3.1 pt20 -62.88 -21.99 66.39 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 120.074 -0.651 . . . . 0.0 109.803 175.443 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . 0.722 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 59.2 tttt -74.91 -39.97 61.14 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.491 170.625 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.432 ' HB3' ' O ' ' A' ' 987' ' ' ALA . 18.0 tp -52.54 -59.22 4.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.665 177.576 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.56 ' HB3' ' CD1' ' A' 1035 ' ' LEU . 2.4 pp -59.8 -34.84 73.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.771 0.796 . . . . 0.0 109.481 177.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . 0.722 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 24.6 t-20 -52.85 -54.03 40.27 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 113.747 -1.569 . . . . 0.0 112.08 -178.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 6.0 m -78.83 -30.32 45.22 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 112.054 0.391 . . . . 0.0 112.054 -179.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.12 -42.76 88.74 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 119.488 -0.885 . . . . 0.0 111.488 176.33 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 0.881 HD22 HD13 ' A' ' 962' ' ' LEU . 1.2 pp -62.62 -23.26 66.97 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 122.717 0.407 . . . . 0.0 110.223 170.549 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -78.45 -27.23 46.39 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 119.456 -0.898 . . . . 0.0 110.406 174.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -73.99 -45.71 48.29 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 170.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.853 HD21 ' HE2' ' A' 1021 ' ' MET . 0.7 OUTLIER -56.7 -42.97 80.05 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.559 -1.2 . . . . 0.0 111.184 -178.508 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.606 ' HA ' ' CE ' ' A' 1002 ' ' MET . 69.0 mt -65.37 -43.99 94.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 O-C-N 122.458 -0.151 . . . . 0.0 111.255 -179.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 23.6 m-80 -60.4 -36.02 77.12 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.233 0.54 . . . . 0.0 111.446 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.465 ' O ' ' HB3' ' A' 1017 ' ' TYR . 13.5 mptt -73.56 -47.18 42.63 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.729 -174.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 1.044 ' HB3' ' HG3' ' A' 1021 ' ' MET . 16.1 ptt? -65.1 -23.79 67.25 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.841 0.829 . . . . 0.0 109.577 179.139 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.528 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 8.7 tptm -70.99 -44.99 64.8 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.162 -165.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.566 ' HB2' ' CD1' ' A' 1017 ' ' TYR . 6.7 mp -83.02 -13.09 56.57 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.913 178.62 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.641 ' HB2' ' CB ' ' A' 1017 ' ' TYR . . . -70.47 -37.41 74.25 Favored 'General case' 0 C--O 1.211 -0.951 0 C-N-CA 118.904 -1.118 . . . . 0.0 109.532 178.202 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.799 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 3.9 pp0? -75.47 -40.12 57.81 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 119.151 -0.452 . . . . 0.0 111.874 171.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.585 ' HG3' ' CD2' ' A' 1008 ' ' TYR . 5.6 pt20 -53.68 -37.97 63.73 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 121.32 0.581 . . . . 0.0 110.349 -175.747 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.8 ' HB2' HD22 ' A' 1013 ' ' LEU . 73.4 m-85 -128.99 43.18 3.19 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.364 169.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 1.071 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 14.7 p -48.99 -21.91 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.702 169.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1010 ' ' MET . . . . . 0.427 ' O ' HG23 ' A' 1011 ' ' THR . 65.3 mtt -31.8 -55.97 0.29 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.111 -1.404 . . . . 0.0 111.548 172.062 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1011 ' ' THR . . . . . 0.427 HG23 ' O ' ' A' 1010 ' ' MET . 1.7 p -159.25 -91.04 0.03 OUTLIER 'General case' 0 C--O 1.249 1.062 0 N-CA-C 113.332 0.864 . . . . 0.0 113.332 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 32.4 t -51.27 -65.57 0.53 Allowed 'General case' 0 C--O 1.237 0.41 0 CA-C-N 114.411 -1.268 . . . . 0.0 112.399 -166.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1013 ' ' LEU . . . . . 0.8 HD22 ' HB2' ' A' 1008 ' ' TYR . 8.0 mp -47.88 -43.26 28.46 Favored 'General case' 0 CA--C 1.507 -0.674 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -179.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 1.071 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -57.08 -47.79 80.17 Favored 'General case' 0 C--N 1.319 -0.753 0 O-C-N 123.299 0.374 . . . . 0.0 111.509 -167.724 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.737 ' O ' ' HB3' ' A' 1019 ' ' LYS . 15.0 mm100 -72.46 -37.98 68.37 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-O 120.93 0.395 . . . . 0.0 111.13 -176.651 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -69.33 -55.28 10.91 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.631 0.729 . . . . 0.0 110.828 -179.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.708 ' CE2' ' HG ' ' A' 1013 ' ' LEU . 13.6 m-85 -65.49 -39.57 92.07 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.758 -1.11 . . . . 0.0 113.779 -174.489 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.59 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 25.5 tptp -79.9 -28.91 39.8 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.501 -176.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . 0.737 ' HB3' ' O ' ' A' 1015 ' ' GLN . 0.0 OUTLIER -73.23 -45.32 56.77 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 175.072 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . 0.42 ' HB3' ' HG2' ' A' 1001 ' ' LYS . 46.6 mt-30 -54.91 -35.34 64.05 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.822 162.437 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 1.044 ' HG3' ' HB3' ' A' 1002 ' ' MET . 1.9 tmt? -64.71 -51.92 59.85 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 110.275 -0.268 . . . . 0.0 110.275 -179.021 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' 1022 ' ' LEU . 0.0 OUTLIER -78.69 -8.61 58.86 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 119.511 -0.876 . . . . 0.0 109.778 -175.613 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 91.8 m -86.09 -36.88 19.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.08 174.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.553 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -79.28 -22.76 44.22 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-O 121.412 0.625 . . . . 0.0 109.415 173.743 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.728 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -86.27 -24.83 25.81 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.193 169.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.556 ' O ' HG23 ' A' 1030 ' ' VAL . 53.3 t60 -69.21 -36.28 77.09 Favored 'General case' 0 C--O 1.211 -0.947 0 N-CA-C 108.569 -0.901 . . . . 0.0 108.569 164.104 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . 0.553 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -58.4 -45.43 88.37 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 123.453 0.701 . . . . 0.0 111.204 162.043 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.637 HD21 ' N ' ' A' ' 995' ' ' LEU . 31.4 mt -56.96 -46.57 82.07 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 118.706 0.684 . . . . 0.0 109.64 173.642 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -59.33 -43.64 92.69 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 173.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' 1026 ' ' HIS . 17.0 t -66.15 -50.68 67.01 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 CA-C-O 121.854 0.835 . . . . 0.0 110.721 -177.104 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.78 ' O ' HD13 ' A' 1035 ' ' LEU . 17.3 m-20 -75.96 -31.05 58.85 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.139 -175.137 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.6 ' HA ' ' CD1' ' A' 1035 ' ' LEU . . . -69.13 -34.02 74.36 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 171.684 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.556 ' HB3' ' O ' ' A' 1030 ' ' VAL . 0.0 OUTLIER -58.63 -37.4 75.85 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 167.63 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.454 ' O ' ' HB3' ' A' 1037 ' ' ASP . 53.2 t30 -79.35 -51.41 9.44 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 114.334 -1.303 . . . . 0.0 112.702 -173.057 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.867 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 0.0 OUTLIER -59.8 -31.39 69.66 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 119.142 0.883 . . . . 0.0 111.485 -174.137 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.782 HD13 HG11 ' A' ' 925' ' ' VAL . 9.9 tp -68.82 -51.24 42.8 Favored 'General case' 0 C--N 1.344 0.338 0 C-N-CA 117.262 -1.775 . . . . 0.0 109.41 175.148 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.454 ' HB3' ' O ' ' A' 1034 ' ' ASN . 25.3 t70 -45.03 -42.32 8.3 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 114.856 -1.066 . . . . 0.0 111.251 173.181 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.491 ' CG1' ' HG3' ' A' ' 983' ' ' GLU . 45.6 t -61.7 -40.6 87.34 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.489 0 CA-C-N 114.559 -1.201 . . . . 0.0 112.476 177.635 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.789 HG12 HG13 ' A' ' 984' ' ' ILE . 1.9 mp -83.31 -25.0 7.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 118.589 0.632 . . . . 0.0 110.522 177.327 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.761 ' O ' ' HG3' ' A' 1043 ' ' ARG . 68.9 m-20 -61.2 -45.1 95.97 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 164.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -62.04 -48.89 78.25 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.653 173.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.889 ' HB2' ' HG2' ' A' ' 983' ' ' GLU . . . -54.98 -45.86 75.03 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.61 -176.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.761 ' HG3' ' O ' ' A' 1040 ' ' ASP . 0.0 OUTLIER -59.9 -42.76 94.54 Favored 'General case' 0 N--CA 1.441 -0.875 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.906 -174.799 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . 0.408 ' N ' ' HD3' ' A' 1043 ' ' ARG . 43.0 tp . . . . . 0 N--CA 1.451 -0.391 0 CA-C-O 121.13 0.49 . . . . 0.0 110.582 -178.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.434 ' HA ' ' HG2' ' A' ' 927' ' ' GLU . 35.0 mmtp . . . . . 0 CA--C 1.53 0.195 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.656 HG23 HD22 ' A' 1036 ' ' LEU . 32.2 m -62.93 -30.95 50.82 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-O 121.365 0.602 . . . . 0.0 110.322 178.325 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.38 -30.69 53.84 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.696 178.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . 0.61 ' O ' HG22 ' A' ' 930' ' ' THR . 7.7 pt-20 -76.4 -24.0 54.06 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 119.096 -1.042 . . . . 0.0 110.785 176.582 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -71.41 -29.94 65.49 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 171.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.539 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 86.9 t -80.35 -30.07 12.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.236 175.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.61 HG22 ' O ' ' A' ' 927' ' ' GLU . 2.8 t -65.81 -33.73 76.54 Favored 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 118.215 -1.394 . . . . 0.0 108.257 171.24 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -74.01 -53.51 7.02 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-N 115.366 -0.834 . . . . 0.0 113.572 176.341 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.539 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.2 pp -64.38 -48.37 75.75 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -177.16 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.464 HG23 HG13 ' A' ' 929' ' ' VAL . 54.6 t -69.35 -31.78 50.86 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.319 0 CA-C-O 120.755 0.312 . . . . 0.0 110.852 -175.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.561 ' HD2' ' C ' ' A' ' 934' ' ' LYS . 2.1 tmmm? -56.26 -50.3 71.73 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 175.44 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -57.88 -36.26 72.12 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.154 0.284 . . . . 0.0 111.29 -178.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.821 HG22 ' HB1' ' A' 1025 ' ' ALA . 86.1 t -50.82 -73.9 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.583 178.083 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 28.4 pt -67.25 -35.83 75.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -177.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -67.49 -55.73 12.38 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.733 0.778 . . . . 0.0 110.77 -174.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -73.47 -23.9 60.13 Favored 'General case' 0 N--CA 1.438 -1.067 0 C-N-CA 119.776 -0.77 . . . . 0.0 108.969 -176.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.608 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 44.5 t . . . . . 0 N--CA 1.443 -0.817 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.617 -178.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.739 ' HB3' ' HG3' ' A' 1002 ' ' MET . 21.0 m-85 . . . . . 0 C--O 1.221 -0.396 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 0.889 HG13 ' HD3' ' A' ' 953' ' ' PRO . 3.4 p -52.22 -36.81 36.05 Favored Pre-proline 0 CA--C 1.55 0.959 0 CA-C-N 118.506 0.594 . . . . 0.0 112.557 175.045 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 0.889 ' HD3' HG13 ' A' ' 952' ' ' VAL . 37.3 Cg_exo -53.47 -40.01 80.11 Favored 'Trans proline' 0 C--N 1.358 1.045 0 C-N-CA 121.699 1.599 . . . . 0.0 112.208 169.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.658 ' O ' HG23 ' A' ' 958' ' ' VAL . 8.5 ttt -76.33 -48.86 18.56 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.005 177.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.695 HG12 ' HA ' ' A' ' 952' ' ' VAL . 0.4 OUTLIER -54.05 -31.42 21.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.545 173.736 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 5.5 tttm -65.52 -40.97 93.61 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.064 170.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . 0.573 ' HG2' ' O ' ' A' ' 954' ' ' MET . 14.5 pt-20 -79.38 -42.95 24.4 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 120.393 -0.523 . . . . 0.0 111.023 -176.2 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.658 HG23 ' O ' ' A' ' 954' ' ' MET . 2.2 t -66.26 -38.26 81.49 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.821 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 173.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . 0.429 ' O ' ' HG2' ' A' ' 963' ' ' ARG . . . -58.49 -38.88 92.16 Favored Glycine 0 N--CA 1.434 -1.462 0 N-CA-C 110.813 -0.915 . . . . 0.0 110.813 176.15 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . 0.636 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 25.3 tp -69.14 -35.82 76.77 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 120.766 0.317 . . . . 0.0 110.818 174.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -72.29 -43.31 64.43 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.135 0.493 . . . . 0.0 111.643 -176.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.88 HD11 ' HG ' ' A' ' 995' ' ' LEU . 4.4 pp -86.33 -16.7 36.61 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.968 -176.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.636 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 0.5 OUTLIER -75.42 -32.79 60.83 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 119.064 -1.054 . . . . 0.0 109.939 164.239 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . 0.562 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 59.1 m -64.55 -34.44 78.25 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 175.169 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.516 HD21 HD21 ' A' 1035 ' ' LEU . 26.9 tp -62.78 -41.51 99.28 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.776 173.328 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.744 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.0 tt -70.06 -36.68 75.16 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.049 -175.327 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -72.45 -38.13 68.37 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.306 178.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 7.9 p -66.07 -41.01 91.33 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 118.644 0.656 . . . . 0.0 110.005 175.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.564 HG12 HG23 ' A' ' 984' ' ' ILE . 74.4 t -68.25 -39.11 80.58 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.526 173.631 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.855 ' HB2' HE22 ' A' ' 988' ' ' GLN . 13.1 t70 -66.53 -39.68 88.75 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 122.228 1.014 . . . . 0.0 108.77 -177.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.569 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 28.7 tt0 -70.69 -30.58 67.19 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 114.488 -1.233 . . . . 0.0 110.335 178.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 70.2 m -66.26 -17.74 64.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.272 173.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.615 ' HA ' HD13 ' A' ' 984' ' ' ILE . 10.5 tt -69.41 -51.81 16.17 Favored Pre-proline 0 CA--C 1.53 0.187 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.776 -176.085 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.582 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 94.9 Cg_endo -87.42 2.04 6.9 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 121.178 1.252 . . . . 0.0 113.45 174.426 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' ' 971' ' ' GLU . 25.1 t . . . . . 0 C--N 1.328 -0.331 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.253 172.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.629 ' OG1' ' HA ' ' A' 1043 ' ' ARG . 85.5 m . . . . . 0 CA--C 1.537 0.47 0 CA-C-O 121.147 0.499 . . . . 0.0 110.778 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -50.79 -27.36 7.11 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 178.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . 0.511 ' HA ' ' HG2' ' A' ' 985' ' ' GLU . 0.0 OUTLIER -83.11 -21.87 33.55 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 119.481 1.037 . . . . 0.0 111.149 -176.127 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.458 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 1.4 mp0 -77.03 -38.7 52.32 Favored 'General case' 0 CA--C 1.499 -0.981 0 CA-C-O 121.764 0.792 . . . . 0.0 109.143 168.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.847 HG12 HG12 ' A' 1039 ' ' ILE . 73.8 mt -68.17 -36.28 74.63 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.18 0 CA-C-N 114.145 -1.389 . . . . 0.0 109.503 -176.354 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . 0.78 ' O ' ' HD3' ' A' ' 989' ' ' LYS . 13.3 pt-20 -74.29 -40.8 62.03 Favored 'General case' 0 N--CA 1.439 -0.988 0 C-N-CA 118.159 -1.416 . . . . 0.0 109.426 -178.557 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . 0.53 ' O ' ' HB2' ' A' ' 989' ' ' LYS . 2.1 tmt? -68.63 -40.0 80.5 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.56 -174.428 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.973 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -71.88 -45.78 60.09 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.571 -174.104 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.855 HE22 ' HB2' ' A' ' 970' ' ' ASP . 4.4 pt20 -60.31 -23.89 64.56 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.808 175.284 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . 0.799 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 2.6 mptp? -72.55 -39.05 67.78 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.986 0.898 . . . . 0.0 111.05 171.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.591 ' HB3' ' O ' ' A' ' 987' ' ' ALA . 18.6 tp -54.32 -59.66 4.38 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.414 -1.267 . . . . 0.0 111.853 179.135 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.528 ' HB2' HD13 ' A' 1035 ' ' LEU . 0.4 OUTLIER -59.96 -33.06 71.41 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.745 0.783 . . . . 0.0 109.417 177.722 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . 0.799 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 22.7 t-20 -52.03 -52.57 50.01 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 113.911 -1.495 . . . . 0.0 111.438 179.569 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 2.6 p -77.59 -31.61 53.12 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.673 0.619 . . . . 0.0 112.673 -178.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -68.47 -40.51 80.99 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 119.729 -0.789 . . . . 0.0 111.189 176.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 0.88 ' HG ' HD11 ' A' ' 962' ' ' LEU . 0.9 OUTLIER -57.09 -36.65 70.84 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.066 0.546 . . . . 0.0 109.935 166.843 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -66.65 -30.39 70.63 Favored 'General case' 0 C--N 1.312 -1.052 0 C-N-CA 118.985 -1.086 . . . . 0.0 110.903 174.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -75.42 -38.33 59.86 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.853 -0.53 . . . . 0.0 110.678 174.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.882 HD13 ' HB2' ' A' 1025 ' ' ALA . 1.7 tp -56.23 -44.85 80.0 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 120.968 0.413 . . . . 0.0 110.843 178.546 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.51 ' O ' ' HB2' ' A' 1003 ' ' LYS . 77.8 mt -61.21 -43.97 97.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.084 -176.493 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 32.0 m-80 -58.64 -37.49 76.06 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.251 0.548 . . . . 0.0 111.915 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.492 ' O ' ' HB3' ' A' 1017 ' ' TYR . 33.6 mmtp -79.1 -40.92 29.88 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 122.291 1.043 . . . . 0.0 108.656 -176.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.739 ' HG3' ' HB3' ' A' ' 951' ' ' TYR . 9.0 tpp -61.15 -30.09 70.18 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 113.693 -1.594 . . . . 0.0 109.461 176.635 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.563 ' O ' ' HG3' ' A' 1006 ' ' GLN . 4.8 tptm -75.41 -53.54 8.54 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 114.928 -1.033 . . . . 0.0 111.696 -166.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.752 ' HB3' HD23 ' A' 1013 ' ' LEU . 7.3 mp -76.61 -12.43 60.01 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.149 -178.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.677 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -67.91 -42.63 80.81 Favored 'General case' 0 C--O 1.212 -0.874 0 C-N-CA 119.525 -0.87 . . . . 0.0 109.153 177.034 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.879 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -74.77 -33.16 62.25 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 119.024 -0.512 . . . . 0.0 111.668 170.3 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.656 ' HA ' HE21 ' A' 1007 ' ' GLN . 0.0 OUTLIER -47.53 -53.37 14.62 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.116 0.484 . . . . 0.0 110.388 175.609 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.916 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 40.1 m-85 -119.6 40.35 3.4 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.277 -0.569 . . . . 0.0 110.407 175.249 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 1.074 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 14.8 p -51.62 -22.29 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 121.382 0.611 . . . . 0.0 110.632 173.733 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 20.0 mmt -41.16 -38.18 1.03 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.242 -1.345 . . . . 0.0 111.706 175.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1011 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -174.47 -81.77 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 174.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 16.6 p -53.43 -73.52 0.04 OUTLIER 'General case' 0 C--O 1.241 0.649 0 CA-C-N 115.12 -0.945 . . . . 0.0 113.051 -166.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1013 ' ' LEU . . . . . 0.916 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 3.2 mp -46.1 -42.17 13.27 Favored 'General case' 0 CA--C 1.501 -0.921 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -179.502 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 1.074 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -57.33 -46.37 83.33 Favored 'General case' 0 N--CA 1.438 -1.035 0 O-C-N 123.753 0.658 . . . . 0.0 111.616 -166.552 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.716 ' O ' ' HB3' ' A' 1019 ' ' LYS . 47.2 mt-30 -72.52 -34.46 67.6 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 121.013 0.435 . . . . 0.0 110.103 -174.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -71.17 -53.25 15.11 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.856 0.836 . . . . 0.0 110.466 176.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.717 ' CE2' ' HG ' ' A' 1013 ' ' LEU . 7.1 m-85 -67.77 -38.82 83.92 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.618 -1.174 . . . . 0.0 113.95 -172.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.513 ' HD2' ' SD ' ' A' 1021 ' ' MET . 24.0 tptm -80.03 -29.88 39.42 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.91 -176.216 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . 0.716 ' HB3' ' O ' ' A' 1015 ' ' GLN . 1.5 tmtt? -76.21 -40.32 52.51 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.73 176.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . 0.419 ' N ' ' HD3' ' A' 1019 ' ' LYS . 25.4 mt-30 -63.9 -28.48 69.86 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.731 162.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.733 ' HG2' HD12 ' A' ' 998' ' ' LEU . 1.6 ttp -65.61 -47.11 76.77 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 176.622 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . 0.701 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -79.19 -8.96 59.42 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 119.165 -1.014 . . . . 0.0 109.767 -179.249 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 92.2 m -77.0 -44.03 32.5 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 172.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.47 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -78.88 -21.1 47.96 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-O 121.383 0.611 . . . . 0.0 109.659 175.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.882 ' HB2' HD13 ' A' ' 998' ' ' LEU . . . -83.94 -24.01 30.88 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.128 170.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.539 ' HB2' ' O ' ' A' 1022 ' ' LEU . 1.9 t60 -77.96 -22.66 49.15 Favored 'General case' 0 C--O 1.216 -0.658 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 165.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . 0.47 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -69.6 -42.39 74.47 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 123.094 0.558 . . . . 0.0 109.768 162.378 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.66 HD21 ' N ' ' A' ' 995' ' ' LEU . 34.7 mt -57.25 -49.48 75.93 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 169.696 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -58.05 -43.23 86.77 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 174.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.469 ' O ' ' HB2' ' A' 1033 ' ' LYS . 2.8 t -67.72 -51.01 55.23 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.234 0 CA-C-O 121.287 0.565 . . . . 0.0 110.394 -176.1 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.635 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 18.0 m-20 -76.6 -27.31 55.73 Favored 'General case' 0 C--O 1.213 -0.821 0 CA-C-N 115.475 -0.784 . . . . 0.0 112.024 -176.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.652 ' HA ' HD22 ' A' 1035 ' ' LEU . . . -61.47 -40.7 95.47 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 167.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.469 ' HB2' ' O ' ' A' 1030 ' ' VAL . 94.3 mttt -62.86 -39.72 95.27 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.444 0.64 . . . . 0.0 109.72 171.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.635 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 46.6 t30 -76.26 -54.67 6.45 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.856 -170.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.973 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 0.6 OUTLIER -61.71 -42.99 99.69 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 118.782 -0.628 . . . . 0.0 110.953 -173.307 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.656 HD22 HG23 ' A' ' 925' ' ' VAL . 4.6 pp -70.04 -39.87 75.46 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 116.472 -2.091 . . . . 0.0 109.628 -178.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.51 ' N ' HD12 ' A' 1036 ' ' LEU . 38.2 t70 -53.23 -43.33 67.21 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 122.098 0.951 . . . . 0.0 110.83 173.249 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.559 ' HB ' ' O ' ' A' 1035 ' ' LEU . 9.7 t -50.83 -48.82 27.99 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.585 0 CA-C-N 114.061 -1.427 . . . . 0.0 111.299 172.29 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.847 HG12 HG12 ' A' ' 984' ' ' ILE . 2.7 mp -74.95 -34.05 31.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 118.45 0.568 . . . . 0.0 110.912 178.36 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.511 ' O ' ' HG3' ' A' 1043 ' ' ARG . 83.5 m-20 -51.39 -53.9 31.94 Favored 'General case' 0 C--O 1.246 0.88 0 CA-C-O 122.403 1.097 . . . . 0.0 109.237 172.165 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -76.78 -32.14 57.48 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 115.122 -0.945 . . . . 0.0 110.9 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.661 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -54.82 -50.84 67.6 Favored 'General case' 0 CA--C 1.501 -0.922 0 C-N-CA 123.389 0.676 . . . . 0.0 111.62 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.663 ' HD3' ' N ' ' A' 1044 ' ' LEU . 0.0 OUTLIER -61.94 -37.66 85.54 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.723 -176.622 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . 0.663 ' N ' ' HD3' ' A' 1043 ' ' ARG . 15.4 mt . . . . . 0 CA--C 1.532 0.285 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.967 178.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.573 ' HB3' HG21 ' A' ' 968' ' ' THR . 51.2 mmtt . . . . . 0 N--CA 1.447 -0.6 0 CA-C-O 120.906 0.384 . . . . 0.0 111.249 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.67 ' CG2' ' HB2' ' A' 1036 ' ' LEU . 17.0 m -62.04 -35.06 66.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.365 0.602 . . . . 0.0 110.8 -178.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.5 -27.16 51.78 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 118.598 -0.715 . . . . 0.0 111.863 177.383 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . 0.484 ' O ' HG22 ' A' ' 930' ' ' THR . 6.6 pt-20 -75.75 -23.81 56.03 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 120.482 1.492 . . . . 0.0 109.784 178.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -76.36 -29.14 57.07 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 121.347 0.594 . . . . 0.0 110.19 172.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.636 HG21 HD23 ' A' 1036 ' ' LEU . 82.0 t -82.15 -31.99 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.729 175.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.484 HG22 ' O ' ' A' ' 927' ' ' GLU . 5.8 t -62.47 -29.34 70.46 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 120.349 1.432 . . . . 0.0 107.873 171.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -70.32 -52.22 18.41 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-N 114.452 -1.249 . . . . 0.0 113.17 171.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.461 HD21 HG22 ' A' ' 929' ' ' VAL . 2.0 pp -62.16 -48.31 80.66 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 117.648 0.724 . . . . 0.0 112.792 -178.03 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.701 ' O ' HG22 ' A' ' 936' ' ' VAL . 56.7 t -60.81 -41.83 90.06 Favored 'Isoleucine or valine' 0 C--O 1.239 0.535 0 CA-C-O 121.777 0.799 . . . . 0.0 109.703 -177.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -53.72 -43.3 68.92 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.7 -1.136 . . . . 0.0 110.322 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -67.89 -31.64 71.57 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -176.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.701 HG22 ' O ' ' A' ' 933' ' ' VAL . 2.9 m -61.59 -56.95 14.45 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.271 0 C-N-CA 121.004 -0.278 . . . . 0.0 111.048 -174.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.431 ' N ' HG23 ' A' ' 936' ' ' VAL . 7.1 pt -78.52 -40.32 24.3 Favored 'Isoleucine or valine' 0 C--O 1.25 1.118 0 CA-C-O 121.12 0.486 . . . . 0.0 111.257 -178.478 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -65.55 -49.21 69.75 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.696 -171.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 26.2 mmt -71.92 -26.18 62.2 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.6 -179.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . . . . . . . . . 5.2 m . . . . . 0 CA--C 1.515 -0.368 0 CA-C-O 121.218 0.533 . . . . 0.0 111.421 -176.121 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.794 ' CE1' ' HD3' ' A' 1018 ' ' LYS . 39.0 m-85 . . . . . 0 N--CA 1.467 0.385 0 N-CA-C 114.397 1.258 . . . . 0.0 114.397 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 0.628 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 22.3 t -43.66 -48.45 19.72 Favored Pre-proline 0 C--N 1.322 -0.606 0 C-N-CA 122.793 0.437 . . . . 0.0 111.98 174.291 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 0.628 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 13.8 Cg_exo -47.6 -49.26 13.71 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 122.861 2.374 . . . . 0.0 113.995 178.303 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.621 ' HG3' ' O ' ' A' ' 951' ' ' TYR . 4.5 ppp? -76.43 -32.26 58.35 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.212 0.529 . . . . 0.0 110.54 179.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.51 ' HA ' HG12 ' A' ' 958' ' ' VAL . 78.5 t -57.42 -35.3 49.0 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.374 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.327 168.156 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.493 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 9.9 tmtt? -65.71 -32.25 73.7 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.626 0.25 . . . . 0.0 111.122 173.489 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -77.99 -45.45 23.74 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.831 0.348 . . . . 0.0 110.993 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.51 HG12 ' HA ' ' A' ' 955' ' ' VAL . 13.3 p -76.4 -31.95 21.21 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.19 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.069 178.386 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . 0.469 ' O ' ' HG2' ' A' ' 963' ' ' ARG . . . -61.21 -38.39 95.57 Favored Glycine 0 N--CA 1.446 -0.685 0 N-CA-C 110.867 -0.893 . . . . 0.0 110.867 173.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . 0.492 HD12 HH11 ' A' ' 963' ' ' ARG . 15.5 tp -64.26 -42.79 96.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.929 0.395 . . . . 0.0 110.506 175.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -73.28 -34.61 65.87 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.087 0.47 . . . . 0.0 111.936 -176.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.863 HD11 HD22 ' A' ' 995' ' ' LEU . 3.6 pp -80.83 -30.34 35.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.83 -179.092 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.492 HH11 HD12 ' A' ' 960' ' ' LEU . 9.8 ptp85 -72.71 -33.8 66.68 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 119.629 -0.828 . . . . 0.0 110.943 170.538 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . 0.455 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 17.6 m -66.57 -33.52 75.85 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 119.603 -0.839 . . . . 0.0 108.974 176.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.487 ' O ' HG23 ' A' ' 969' ' ' VAL . 17.2 tp -60.84 -49.45 77.44 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.558 0.694 . . . . 0.0 109.612 170.306 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.573 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.4 tt -55.26 -45.34 76.1 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 114.459 -1.246 . . . . 0.0 109.735 -178.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -66.42 -42.01 88.39 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.007 -0.997 . . . . 0.0 112.131 178.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.573 HG21 ' HB3' ' A' ' 924' ' ' LYS . 0.8 OUTLIER -61.85 -34.91 76.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 119.193 0.906 . . . . 0.0 110.817 175.838 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.976 HG12 HG23 ' A' ' 984' ' ' ILE . 52.7 t -73.38 -42.03 57.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.916 175.54 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.983 ' HB2' HE22 ' A' ' 988' ' ' GLN . 31.4 t70 -69.9 -40.02 75.86 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 122.111 0.957 . . . . 0.0 109.228 -175.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.608 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 9.1 tp10 -66.69 -31.89 72.84 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.63 -1.168 . . . . 0.0 109.483 177.036 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.65 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 27.3 m -68.76 -17.35 64.02 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.256 174.681 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.753 ' HB2' HG21 ' A' ' 984' ' ' ILE . 9.0 tt -64.39 -51.94 57.07 Favored Pre-proline 0 C--O 1.226 -0.134 0 C-N-CA 120.451 -0.499 . . . . 0.0 109.969 -178.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.741 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 6.3 Cg_exo -80.99 -4.0 12.5 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 121.515 1.477 . . . . 0.0 113.262 171.571 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.65 ' HB ' ' HA ' ' A' ' 972' ' ' SER . 24.6 t . . . . . 0 C--N 1.329 -0.294 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.204 172.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.512 HG23 ' CB ' ' A' 1042 ' ' ALA . 20.6 m . . . . . 0 CA--C 1.532 0.255 0 CA-C-O 121.382 0.611 . . . . 0.0 110.308 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.623 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 11.6 m170 -50.88 -39.71 54.63 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 115.061 -0.972 . . . . 0.0 111.722 177.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . 0.428 ' HE ' ' HB3' ' A' ' 982' ' ' ARG . 5.6 ptp180 -83.41 -20.71 33.67 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.629 -0.428 . . . . 0.0 112.116 -173.03 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.599 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 1.3 mp0 -71.44 -34.7 70.51 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-O 121.614 0.721 . . . . 0.0 109.275 167.58 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.976 HG23 HG12 ' A' ' 969' ' ' VAL . 58.1 mt -72.24 -30.52 35.84 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-N 114.662 -1.154 . . . . 0.0 108.895 179.282 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . 0.623 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 35.5 mt-10 -65.41 -52.46 53.22 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.569 174.199 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 51.9 tpp -70.83 -42.52 70.09 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.913 -171.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.65 ' HB1' ' HB3' ' A' 1035 ' ' LEU . . . -74.21 -50.69 18.09 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.45 -172.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.983 HE22 ' HB2' ' A' ' 970' ' ' ASP . 2.7 pt20 -65.48 -22.2 66.71 Favored 'General case' 0 C--O 1.226 -0.151 0 CA-C-O 121.617 0.723 . . . . 0.0 109.204 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . 0.723 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 9.0 ttmm -73.47 -44.42 58.01 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 114.786 -1.097 . . . . 0.0 112.018 171.214 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.67 ' HB3' HD21 ' A' 1035 ' ' LEU . 15.6 tp -57.39 -58.36 8.62 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 119.569 -0.852 . . . . 0.0 111.705 -179.173 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.525 ' HB3' HD23 ' A' 1035 ' ' LEU . 3.2 pp -57.86 -29.62 65.15 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.38 0.609 . . . . 0.0 110.358 177.82 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . 0.723 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 44.9 t-20 -55.55 -55.91 26.41 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.637 -1.165 . . . . 0.0 110.986 175.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 46.2 m -73.01 -32.98 65.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.997 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . 0.718 ' C ' HD22 ' A' ' 998' ' ' LEU . 2.6 m-20 -55.08 -62.5 1.62 Allowed 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.903 174.412 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 0.863 HD22 HD11 ' A' ' 962' ' ' LEU . 18.0 tp -48.2 -30.06 4.32 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 123.291 0.37 . . . . 0.0 111.165 175.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -69.74 -37.87 76.63 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 119.556 -0.858 . . . . 0.0 111.764 178.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -78.26 -39.55 39.81 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.523 0.677 . . . . 0.0 109.937 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 1.041 HD23 ' HG ' ' A' 1028 ' ' LEU . 0.0 OUTLIER -58.18 -34.18 70.05 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.086 179.746 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.693 ' O ' ' HG3' ' A' 1002 ' ' MET . 44.1 mt -67.1 -37.74 79.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 CA-C-N 115.11 -0.95 . . . . 0.0 111.78 172.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.56 -34.77 74.64 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.365 0.602 . . . . 0.0 111.668 179.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.723 ' HD2' ' OE1' ' A' 1020 ' ' GLN . 42.8 mmtm -82.61 -41.34 19.63 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.418 0.628 . . . . 0.0 110.904 -175.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.693 ' HG3' ' O ' ' A' ' 999' ' ' ILE . 0.0 OUTLIER -61.25 -25.95 67.43 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 122.248 1.023 . . . . 0.0 108.642 175.326 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.603 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 26.8 tptt -71.83 -54.07 11.29 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 113.913 -1.494 . . . . 0.0 110.458 -167.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.806 ' HB3' HD23 ' A' 1013 ' ' LEU . 8.7 mp -73.65 -13.48 61.0 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.671 -179.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.772 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -68.97 -44.98 71.82 Favored 'General case' 0 C--N 1.319 -0.747 0 C-N-CA 119.533 -0.867 . . . . 0.0 109.983 178.087 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.82 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 1.0 OUTLIER -74.44 -28.57 61.11 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 121.891 -0.506 . . . . 0.0 111.265 173.406 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.969 ' HA ' HE21 ' A' 1007 ' ' GLN . 0.0 OUTLIER -50.16 -57.54 7.51 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.277 0.56 . . . . 0.0 110.25 173.995 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 1.073 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 24.2 m-85 -107.16 35.06 3.17 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.984 175.355 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 1.047 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 11.2 p -45.39 -29.11 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.494 0 O-C-N 123.536 0.522 . . . . 0.0 110.954 174.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 25.8 ttp -40.47 -45.78 2.31 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.52 -1.218 . . . . 0.0 111.599 178.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1011 ' ' THR . . . . . . . . . . . . . 28.1 m -161.53 -82.37 0.04 OUTLIER 'General case' 0 C--O 1.245 0.853 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 176.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 11.2 p -55.75 -71.64 0.08 Allowed 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.067 -0.97 . . . . 0.0 113.115 -164.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1013 ' ' LEU . . . . . 1.073 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 6.5 mp -51.84 -38.0 54.18 Favored 'General case' 0 CA--C 1.506 -0.736 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -178.207 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 1.047 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -55.19 -53.54 54.76 Favored 'General case' 0 N--CA 1.442 -0.837 0 O-C-N 123.423 0.452 . . . . 0.0 111.599 -168.264 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.45 HE21 ' HB3' ' A' 1015 ' ' GLN . 1.3 pt20 -73.45 -36.55 65.91 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.569 -175.677 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . 0.466 ' HG2' ' NE2' ' A' 1020 ' ' GLN . 36.5 tt0 -68.27 -57.63 5.67 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.566 178.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.772 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 7.3 m-85 -62.03 -33.15 73.82 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 113.696 0.999 . . . . 0.0 113.696 -176.324 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.794 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 35.0 tptt -80.24 -32.12 38.43 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.582 -176.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . 0.445 ' HA ' ' HD2' ' A' 1019 ' ' LYS . 0.2 OUTLIER -74.59 -35.37 63.0 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 176.347 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . 0.723 ' OE1' ' HD2' ' A' 1001 ' ' LYS . 77.5 mt-30 -56.59 -41.16 76.52 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.718 158.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.567 ' HG3' ' HB3' ' A' 1002 ' ' MET . 1.5 tmt? -65.99 -51.8 55.12 Favored 'General case' 0 C--O 1.219 -0.544 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -172.468 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.84 -18.5 53.91 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 119.676 -0.81 . . . . 0.0 110.394 -172.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 34.6 m -84.17 -27.02 28.36 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 175.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.754 ' HB1' ' CD1' ' A' ' 998' ' ' LEU . . . -81.36 -28.14 34.59 Favored 'General case' 0 C--O 1.212 -0.904 0 CA-C-N 115.454 -0.793 . . . . 0.0 109.596 172.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.484 ' HA ' ' HB2' ' A' 1028 ' ' LEU . . . -83.38 -19.6 35.76 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 169.399 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.522 ' O ' HG23 ' A' 1030 ' ' VAL . 32.7 t-80 -75.12 -21.75 58.65 Favored 'General case' 0 C--O 1.213 -0.863 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 161.522 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . 0.681 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -74.32 -39.46 62.84 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.33 0.652 . . . . 0.0 110.098 166.464 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 1.041 ' HG ' HD23 ' A' ' 998' ' ' LEU . 23.0 mt -55.92 -49.59 73.03 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 164.037 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . 0.514 ' CB ' HG22 ' A' ' 933' ' ' VAL . . . -60.21 -38.79 84.4 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 112.64 0.607 . . . . 0.0 112.64 177.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.522 HG23 ' O ' ' A' 1026 ' ' HIS . 11.3 t -75.89 -51.46 20.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.358 0.599 . . . . 0.0 110.995 -175.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.591 ' O ' HD22 ' A' 1035 ' ' LEU . 6.6 m-20 -75.39 -33.59 61.02 Favored 'General case' 0 C--O 1.212 -0.907 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.149 -176.384 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.432 ' HB1' HD22 ' A' ' 965' ' ' LEU . . . -70.88 -24.99 62.6 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.559 -0.456 . . . . 0.0 109.938 174.333 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.501 ' HB3' ' O ' ' A' 1030 ' ' VAL . 50.6 tttm -63.38 -52.2 62.64 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 167.4 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.48 ' O ' HG23 ' A' 1038 ' ' VAL . 52.5 t30 -63.51 -50.12 70.84 Favored 'General case' 0 C--O 1.209 -1.038 0 CA-C-N 114.599 -1.182 . . . . 0.0 111.48 -177.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.67 HD21 ' HB3' ' A' ' 990' ' ' LEU . 0.0 OUTLIER -59.29 -42.07 90.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 119.395 -0.336 . . . . 0.0 110.498 -178.067 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.67 ' HB2' ' CG2' ' A' ' 925' ' ' VAL . 3.2 pp -69.69 -41.26 75.66 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 117.549 -1.66 . . . . 0.0 109.295 179.712 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 14.1 t70 -56.3 -40.0 73.64 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 114.37 -1.287 . . . . 0.0 109.786 175.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.542 ' HB ' ' O ' ' A' 1035 ' ' LEU . 6.6 t -53.47 -48.34 58.0 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.091 0 CA-C-N 113.822 -1.536 . . . . 0.0 111.053 174.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.601 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 2.0 mp -74.27 -33.96 35.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 118.792 0.723 . . . . 0.0 111.044 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.442 ' O ' ' HG3' ' A' 1043 ' ' ARG . 0.5 OUTLIER -62.06 -49.87 74.23 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.21 0.529 . . . . 0.0 110.084 174.353 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -63.7 -40.71 97.47 Favored 'General case' 0 C--O 1.213 -0.862 0 C-N-CA 120.334 -0.546 . . . . 0.0 109.612 172.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.601 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -53.3 -52.83 57.85 Favored 'General case' 0 CA--C 1.494 -1.205 0 C-N-CA 123.619 0.768 . . . . 0.0 112.115 -175.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.609 ' HD3' ' N ' ' A' 1044 ' ' LEU . 0.1 OUTLIER -61.93 -44.12 97.42 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.034 -174.83 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . 0.609 ' N ' ' HD3' ' A' 1043 ' ' ARG . 3.7 tt . . . . . 0 N--CA 1.445 -0.707 0 CA-C-O 121.484 0.659 . . . . 0.0 110.291 -175.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . . . . . . . . . 2.0 tppp? . . . . . 0 CA--C 1.535 0.368 0 CA-C-O 120.766 0.317 . . . . 0.0 111.38 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.726 HG21 HD23 ' A' 1036 ' ' LEU . 26.9 m -64.15 -29.34 47.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.316 0.579 . . . . 0.0 111.092 176.043 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -70.51 -32.93 70.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.441 -178.628 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . 0.691 ' HA ' ' HB ' ' A' ' 930' ' ' THR . 10.8 pt-20 -76.91 -24.22 52.47 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 118.951 -1.1 . . . . 0.0 111.004 176.059 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -69.14 -31.08 69.5 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 172.316 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.587 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 43.7 t -80.45 -30.76 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.516 173.174 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.691 ' HB ' ' HA ' ' A' ' 927' ' ' GLU . 6.2 m -56.09 -43.32 77.94 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 166.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -69.54 -52.9 18.91 Favored Glycine 0 CA--C 1.531 1.074 0 CA-C-N 114.744 -1.116 . . . . 0.0 113.941 175.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.587 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.9 pp -65.78 -45.88 80.83 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 117.508 0.654 . . . . 0.0 112.763 -174.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 56.0 t -66.05 -36.43 77.45 Favored 'Isoleucine or valine' 0 C--O 1.239 0.509 0 CA-C-O 121.21 0.529 . . . . 0.0 110.636 -177.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.519 ' O ' ' HB3' ' A' ' 938' ' ' GLU . 60.9 tttt -63.79 -31.88 73.2 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.574 179.15 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 0.608 ' O ' ' HB2' ' A' ' 939' ' ' MET . . . -66.27 -40.88 90.43 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 121.946 -0.472 . . . . 0.0 110.724 175.124 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.847 HG22 ' HB1' ' A' 1025 ' ' ALA . 54.1 t -50.38 -76.73 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.342 -177.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.442 HG13 ' N ' ' A' ' 938' ' ' GLU . 25.0 pt -80.35 -45.29 22.15 Favored 'Isoleucine or valine' 0 C--O 1.244 0.776 0 CA-C-O 121.191 0.52 . . . . 0.0 112.188 -173.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.519 ' HB3' ' O ' ' A' ' 934' ' ' LYS . 31.7 tt0 -67.92 -47.36 68.97 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-O 121.267 0.556 . . . . 0.0 109.665 -169.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.608 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 63.6 mtt -74.46 -23.94 58.97 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.814 178.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.659 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 29.1 p . . . . . 0 N--CA 1.471 0.576 0 CA-C-O 121.578 0.704 . . . . 0.0 110.512 -176.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.996 ' HB3' ' HG2' ' A' 1002 ' ' MET . 24.9 m-85 . . . . . 0 C--O 1.22 -0.495 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 0.716 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 64.4 t -60.54 -53.14 67.46 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 110.466 -0.198 . . . . 0.0 110.466 175.398 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 0.716 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 17.3 Cg_exo -48.55 -34.5 26.61 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 122.315 2.01 . . . . 0.0 113.03 167.169 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.49 ' O ' HG12 ' A' ' 958' ' ' VAL . 34.3 tpp -73.26 -31.99 64.42 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.145 177.049 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.549 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 89.0 t -52.33 -39.53 28.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 169.62 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.513 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 8.0 tttt -67.31 -37.36 83.21 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.692 174.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -78.68 -46.82 18.24 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.992 0.368 . . . . 0.0 111.992 -173.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.535 HG11 HD21 ' A' ' 998' ' ' LEU . 12.5 p -86.63 -24.87 6.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 -178.206 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -65.25 -27.13 72.05 Favored Glycine 0 N--CA 1.445 -0.754 0 N-CA-C 110.24 -1.144 . . . . 0.0 110.24 171.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . 0.571 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 10.3 tt -76.92 -35.14 57.54 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.253 -0.473 . . . . 0.0 109.957 175.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.417 ' HB1' ' HB3' ' A' ' 932' ' ' LEU . . . -71.17 -42.09 69.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.306 -175.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.855 HD13 HD22 ' A' ' 991' ' ' LEU . 0.5 OUTLIER -67.41 -42.83 82.62 Favored 'General case' 0 C--O 1.217 -0.628 0 CA-C-O 118.853 -0.594 . . . . 0.0 111.056 170.757 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.571 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 29.2 ptt180 -64.87 -31.55 72.84 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 119.912 1.233 . . . . 0.0 110.381 -179.067 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 34.2 m -68.79 -33.99 74.79 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.497 HD21 HD21 ' A' 1035 ' ' LEU . 22.0 tp -70.92 -36.27 72.6 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.581 -1.19 . . . . 0.0 109.556 176.027 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.6 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.5 tt -71.77 -39.5 69.92 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 114.828 -1.078 . . . . 0.0 108.399 -175.312 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -74.05 -28.05 61.22 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 114.986 -1.006 . . . . 0.0 112.155 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.51 ' OG1' HG12 ' A' ' 925' ' ' VAL . 5.2 p -74.46 -41.05 61.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 118.475 0.579 . . . . 0.0 110.164 175.324 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.898 HG12 HG23 ' A' ' 984' ' ' ILE . 60.8 t -68.73 -36.48 74.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.564 172.251 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.792 ' HB2' HE22 ' A' ' 988' ' ' GLN . 24.1 t70 -70.87 -37.37 73.07 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.626 0.727 . . . . 0.0 109.175 179.652 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.615 ' O ' HG23 ' A' ' 975' ' ' VAL . 14.0 tp10 -65.88 -32.85 74.6 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.418 176.434 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.401 ' HA ' ' CG2' ' A' ' 975' ' ' VAL . 69.8 m -69.04 -17.59 63.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.055 175.406 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.724 ' HB2' HG21 ' A' ' 984' ' ' ILE . 9.2 tt -67.68 -51.42 30.79 Favored Pre-proline 0 CA--C 1.538 0.505 0 CA-C-O 119.543 -0.265 . . . . 0.0 110.43 -178.184 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.469 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 90.2 Cg_endo -82.9 2.07 8.72 Favored 'Trans proline' 0 C--N 1.356 0.932 0 C-N-CA 121.359 1.373 . . . . 0.0 112.955 170.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.615 HG23 ' O ' ' A' ' 971' ' ' GLU . 26.0 t . . . . . 0 C--N 1.33 -0.248 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 166.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.415 ' HA ' ' HB1' ' A' 1042 ' ' ALA . 89.7 m . . . . . 0 C--O 1.232 0.179 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.568 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 0.3 OUTLIER -58.12 -33.43 69.14 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 114.152 -1.386 . . . . 0.0 111.669 -179.861 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -84.25 -21.02 31.28 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 120.29 -0.564 . . . . 0.0 112.404 -176.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.516 ' HG3' HG13 ' A' 1038 ' ' VAL . 0.3 OUTLIER -73.14 -33.62 65.62 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 168.382 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.898 HG23 HG12 ' A' ' 969' ' ' VAL . 52.6 mt -68.66 -31.99 53.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.213 176.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . 0.568 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 46.2 mt-10 -62.69 -53.48 53.8 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.348 0.594 . . . . 0.0 109.751 175.687 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 89.8 mtp -69.84 -43.45 71.9 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.557 -171.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 1.065 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -67.78 -51.03 53.64 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.062 -0.972 . . . . 0.0 112.636 -171.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.792 HE22 ' HB2' ' A' ' 970' ' ' ASP . 3.7 pt20 -63.52 -28.39 69.92 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 119.815 -0.754 . . . . 0.0 111.232 -179.33 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . 0.721 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 90.9 mttt -70.04 -40.95 74.84 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.59 0.709 . . . . 0.0 111.492 172.46 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.62 HD23 ' HB3' ' A' 1035 ' ' LEU . 14.2 tp -49.6 -60.81 2.53 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 114.799 -1.092 . . . . 0.0 113.013 -176.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.855 HD22 HD13 ' A' ' 962' ' ' LEU . 5.1 tt -69.14 -27.45 65.57 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.239 0.542 . . . . 0.0 109.547 -179.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . 0.721 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 33.1 t-20 -51.08 -50.67 58.27 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.355 177.371 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 14.6 m -76.85 -33.32 57.9 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -65.31 -40.82 94.28 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 120.499 -0.481 . . . . 0.0 111.872 177.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 0.573 ' N ' HD21 ' A' 1028 ' ' LEU . 6.3 tt -71.28 -14.33 62.18 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 174.16 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -76.51 -26.27 55.09 Favored 'General case' 0 C--N 1.315 -0.893 0 C-N-CA 119.633 -0.827 . . . . 0.0 110.023 167.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.656 ' O ' ' HG2' ' A' 1001 ' ' LYS . 5.4 mm-40 -74.4 -43.75 54.98 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 173.223 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.678 HD13 ' HB2' ' A' 1025 ' ' ALA . 0.1 OUTLIER -55.08 -46.45 75.44 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.162 -0.926 . . . . 0.0 111.205 -178.657 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.495 ' O ' ' HB2' ' A' 1003 ' ' LYS . 95.1 mt -64.97 -42.66 95.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.666 -176.292 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -60.82 -41.62 96.08 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.174 0.511 . . . . 0.0 111.829 -178.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.871 ' HB3' ' HG3' ' A' 1020 ' ' GLN . 59.8 mmtt -73.86 -42.86 60.19 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 122.63 1.205 . . . . 0.0 108.457 -176.168 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.996 ' HG2' ' HB3' ' A' ' 951' ' ' TYR . 31.6 ttp -62.09 -28.57 69.71 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 113.101 -1.863 . . . . 0.0 109.307 179.499 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 8.7 tptm -69.43 -52.66 24.74 Favored 'General case' 0 N--CA 1.439 -0.999 0 CA-C-N 114.17 -1.377 . . . . 0.0 110.726 -169.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.613 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 93.1 mt -74.7 -13.24 60.59 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.443 -179.103 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.56 ' HB2' ' CB ' ' A' 1017 ' ' TYR . . . -66.72 -46.95 73.86 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 119.585 -0.846 . . . . 0.0 109.797 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.913 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 3.5 pp0? -70.61 -31.41 68.37 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 118.942 -0.551 . . . . 0.0 112.145 171.003 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.584 ' HG3' HD23 ' A' 1004 ' ' LEU . 18.2 mm-40 -48.76 -51.1 30.83 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.149 0.499 . . . . 0.0 111.287 178.321 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.901 ' HB2' ' HG ' ' A' 1013 ' ' LEU . 89.2 m-85 -121.87 43.13 2.93 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 120.279 -0.569 . . . . 0.0 109.861 172.033 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 0.992 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 7.7 p -51.71 -19.9 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.515 -0.4 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.81 172.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 87.6 mmm -32.09 -53.61 0.29 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.055 -1.43 . . . . 0.0 111.065 170.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1011 ' ' THR . . . . . . . . . . . . . 23.9 m -161.66 -80.77 0.04 OUTLIER 'General case' 0 C--O 1.246 0.878 0 CA-C-O 121.188 0.518 . . . . 0.0 112.265 176.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 3.2 p -55.51 -65.45 0.59 Allowed 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.256 -0.883 . . . . 0.0 113.224 -167.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1013 ' ' LEU . . . . . 0.901 ' HG ' ' HB2' ' A' 1008 ' ' TYR . 1.9 mm? -44.81 -45.38 10.06 Favored 'General case' 0 CA--C 1.508 -0.649 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 178.155 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 0.992 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -59.58 -48.13 82.87 Favored 'General case' 0 N--CA 1.442 -0.843 0 C-N-CA 119.985 -0.686 . . . . 0.0 110.941 -164.984 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -70.44 -40.42 73.77 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.639 -174.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -73.89 -41.04 62.72 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.286 0.565 . . . . 0.0 111.558 -177.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.746 ' CE1' HD13 ' A' 1013 ' ' LEU . 19.2 m-85 -81.1 -28.97 34.98 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 122.019 0.914 . . . . 0.0 112.442 -170.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.659 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 38.0 tptt -78.71 -28.4 45.08 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 113.933 -1.485 . . . . 0.0 110.29 178.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -71.86 -56.86 4.97 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.398 176.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . 0.871 ' HG3' ' HB3' ' A' 1001 ' ' LYS . 10.3 pt20 -53.69 -26.21 21.72 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 119.708 -0.187 . . . . 0.0 110.799 166.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.565 ' HB3' ' HA ' ' A' 1018 ' ' LYS . 2.1 tmt? -66.51 -51.75 53.3 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 118.207 0.458 . . . . 0.0 110.62 173.705 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . 0.835 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.2 OUTLIER -88.63 -1.76 58.24 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 119.205 -0.998 . . . . 0.0 109.84 -175.234 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . 0.42 ' HB ' ' HA ' ' A' 1020 ' ' GLN . 33.1 m -87.1 -39.15 15.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.447 171.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.531 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -76.92 -21.24 55.16 Favored 'General case' 0 C--O 1.222 -0.356 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 170.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.847 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -84.52 -25.44 28.79 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.169 169.624 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.623 ' O ' HG23 ' A' 1030 ' ' VAL . 4.1 t60 -74.17 -26.82 60.52 Favored 'General case' 0 C--O 1.217 -0.639 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 167.045 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -68.01 -42.46 80.67 Favored 'General case' 0 C--N 1.321 -0.654 0 C-N-CA 123.454 0.701 . . . . 0.0 110.327 164.318 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.628 HD11 HD22 ' A' ' 998' ' ' LEU . 20.3 mt -57.08 -46.61 82.39 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 170.463 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -58.07 -41.75 84.04 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 111.711 0.263 . . . . 0.0 111.711 173.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' 1026 ' ' HIS . 19.3 t -67.8 -51.79 46.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 121.276 0.56 . . . . 0.0 110.952 -175.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.508 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 12.9 m-20 -76.64 -28.9 56.21 Favored 'General case' 0 C--O 1.217 -0.611 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.882 -175.833 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.577 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -59.38 -38.29 80.14 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 168.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 65.2 tttp -65.45 -47.42 76.2 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.748 0.785 . . . . 0.0 109.621 172.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.508 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 38.2 t30 -68.13 -52.38 35.5 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 114.319 -1.31 . . . . 0.0 112.202 -172.076 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 1.065 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 3.8 pp -60.67 -37.05 80.27 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 -176.166 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.726 HD23 HG21 ' A' ' 925' ' ' VAL . 0.3 OUTLIER -68.17 -46.38 70.9 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 117.521 -1.672 . . . . 0.0 109.638 176.077 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 19.1 t70 -49.66 -39.15 35.28 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 122.238 1.018 . . . . 0.0 110.299 176.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.516 HG13 ' HG3' ' A' ' 983' ' ' GLU . 19.0 t -58.35 -45.25 89.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 113.665 -1.607 . . . . 0.0 112.38 175.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.642 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 2.0 mp -78.32 -31.59 16.23 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 CA-C-N 118.599 0.636 . . . . 0.0 110.722 177.504 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -58.42 -40.58 82.9 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-O 120.945 0.403 . . . . 0.0 110.377 172.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -76.12 -37.94 57.48 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.642 0.258 . . . . 0.0 110.689 172.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.642 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -54.48 -46.36 73.37 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.908 -179.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.624 ' HG2' ' O ' ' A' 1039 ' ' ILE . 11.5 ptm180 -71.97 -42.53 66.41 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.205 -176.662 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . 0.416 ' O ' HD23 ' A' 1044 ' ' LEU . 3.3 tt . . . . . 0 C--N 1.332 -0.182 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 177.402 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp . . . . . 0 N--CA 1.455 -0.224 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.511 HG21 ' HB2' ' A' 1036 ' ' LEU . 28.6 m -55.19 -41.41 60.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-N 117.959 0.345 . . . . 0.0 111.312 -179.695 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . 0.493 ' HA ' ' HB ' ' A' ' 929' ' ' VAL . 0.2 OUTLIER -79.26 -20.25 48.57 Favored 'General case' 0 CA--C 1.504 -0.801 0 O-C-N 122.105 -0.372 . . . . 0.0 111.003 179.583 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.73 -24.07 45.08 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 118.09 -1.444 . . . . 0.0 112.541 171.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -70.9 -26.78 63.37 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 167.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.553 HG21 HD23 ' A' 1036 ' ' LEU . 53.7 t -74.99 -32.22 26.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 114.223 -1.353 . . . . 0.0 110.419 174.67 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.499 ' O ' ' HB2' ' A' ' 934' ' ' LYS . 9.7 m -59.82 -42.99 94.75 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 119.032 0.833 . . . . 0.0 108.986 170.584 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -69.58 -52.46 20.85 Favored Glycine 0 CA--C 1.528 0.86 0 CA-C-N 115.242 -0.89 . . . . 0.0 113.557 178.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.55 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.9 pp -65.73 -49.39 68.61 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -176.097 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.546 HG22 ' HA ' ' A' 1029 ' ' ALA . 54.0 t -66.86 -40.85 86.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-O 120.872 0.368 . . . . 0.0 111.186 -173.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.654 ' O ' ' HG2' ' A' ' 938' ' ' GLU . 0.1 OUTLIER -58.3 -47.08 84.81 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.206 179.984 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -57.13 -43.19 82.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.19 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.828 HG22 ' HB1' ' A' 1025 ' ' ALA . 70.9 t -43.53 -68.32 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.892 177.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 13.7 pt -71.11 -49.69 47.18 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 N-CA-C 112.802 0.668 . . . . 0.0 112.802 -176.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.654 ' HG2' ' O ' ' A' ' 934' ' ' LYS . 11.6 pt-20 -73.06 -34.93 66.57 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 119.779 -0.768 . . . . 0.0 111.295 -169.142 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 62.5 mtt -74.33 -36.74 63.68 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 118.388 -1.325 . . . . 0.0 109.356 177.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.668 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 44.8 t . . . . . 0 CA--C 1.516 -0.355 0 CA-C-N 114.609 -1.178 . . . . 0.0 113.082 -168.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.576 ' HB3' ' CG ' ' A' 1002 ' ' MET . 0.3 OUTLIER . . . . . 0 C--O 1.22 -0.453 0 CA-C-O 120.89 0.376 . . . . 0.0 109.989 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 0.659 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 59.0 t -53.7 -48.23 94.02 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.867 170.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 0.659 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 81.7 Cg_exo -53.07 -34.16 66.72 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 121.917 1.744 . . . . 0.0 112.499 172.547 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.531 ' HA ' ' HB2' ' A' ' 957' ' ' GLU . 6.9 tpt -76.19 -31.43 58.46 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.065 177.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.513 HG22 ' HE3' ' A' 1002 ' ' MET . 75.4 t -53.39 -44.05 53.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 173.666 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 6.1 tmtt? -67.81 -34.01 75.91 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.828 -1.078 . . . . 0.0 112.055 175.009 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . 0.531 ' HB2' ' HA ' ' A' ' 954' ' ' MET . 25.3 mm-40 -77.63 -46.87 20.76 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -175.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.504 HG12 ' O ' ' A' ' 954' ' ' MET . 12.0 p -80.17 -31.86 13.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -59.35 -40.1 95.58 Favored Glycine 0 N--CA 1.444 -0.767 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 175.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . 0.543 HD12 ' HD3' ' A' ' 963' ' ' ARG . 23.7 tp -67.1 -33.6 75.83 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.66 -0.27 . . . . 0.0 111.112 176.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -80.38 -59.33 2.74 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.829 0.347 . . . . 0.0 110.696 -176.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.98 HD13 HD22 ' A' ' 995' ' ' LEU . 3.3 pp -50.76 -35.27 30.8 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.547 -0.751 . . . . 0.0 112.512 172.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.543 ' HD3' HD12 ' A' ' 960' ' ' LEU . 12.2 ptm180 -71.67 -38.77 70.6 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 119.958 1.254 . . . . 0.0 110.825 174.24 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 41.7 m -62.89 -34.42 77.35 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 176.188 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.891 HD23 HD22 ' A' ' 991' ' ' LEU . 26.3 tp -66.84 -45.31 78.65 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 114.845 -1.071 . . . . 0.0 111.021 176.044 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.632 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.4 tt -66.98 -36.14 81.53 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 -176.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 971' ' ' GLU . . . -72.66 -34.44 67.25 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 115.168 -0.923 . . . . 0.0 112.15 178.336 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 1.9 p -67.71 -37.63 82.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 119.031 0.832 . . . . 0.0 109.9 174.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.612 HG12 HG23 ' A' ' 984' ' ' ILE . 84.6 t -69.29 -40.6 80.43 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.535 172.518 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.59 ' HB2' HE22 ' A' ' 988' ' ' GLN . 18.9 t70 -68.17 -39.67 82.51 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.876 0.846 . . . . 0.0 109.216 -178.26 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.587 ' O ' HG23 ' A' ' 975' ' ' VAL . 6.8 tp10 -61.78 -36.56 81.44 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.553 -1.203 . . . . 0.0 109.135 176.082 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.446 ' HB2' ' O ' ' A' ' 969' ' ' VAL . 71.5 m -65.66 -19.56 65.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.361 176.23 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.662 ' HA ' HD13 ' A' ' 984' ' ' ILE . 51.7 tp -66.75 -52.31 34.29 Favored Pre-proline 0 CA--C 1.53 0.187 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.539 -174.145 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.625 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 95.7 Cg_endo -85.37 2.65 7.67 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 121.055 1.17 . . . . 0.0 112.996 172.148 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.587 HG23 ' O ' ' A' ' 971' ' ' GLU . 33.8 t . . . . . 0 C--N 1.328 -0.326 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 166.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.523 HG23 ' HB1' ' A' 1042 ' ' ALA . 65.4 m . . . . . 0 C--O 1.227 -0.094 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -55.19 -35.87 65.3 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 113.772 -1.558 . . . . 0.0 111.264 176.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . 0.517 ' HA ' ' HG2' ' A' ' 985' ' ' GLU . 1.5 ptp180 -82.99 -19.79 36.36 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.408 -0.517 . . . . 0.0 111.124 -178.276 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.533 ' HG3' HG13 ' A' 1038 ' ' VAL . 1.2 mp0 -77.17 -33.64 56.5 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 119.69 -0.804 . . . . 0.0 109.126 171.178 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.755 ' HA ' HD11 ' A' 1039 ' ' ILE . 67.9 mt -71.87 -34.78 52.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 CA-C-N 114.952 -1.022 . . . . 0.0 109.909 179.34 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . 0.517 ' HG2' ' HA ' ' A' ' 982' ' ' ARG . 10.7 pt-20 -70.21 -44.96 67.56 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.697 0.76 . . . . 0.0 109.563 -179.252 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . 0.551 ' HA ' ' HD3' ' A' ' 989' ' ' LYS . 66.3 mtt -73.63 -42.92 60.79 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 114.786 -1.097 . . . . 0.0 111.715 -172.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.843 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -68.24 -51.37 46.03 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.809 -173.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.632 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 3.5 pt20 -61.44 -24.32 66.47 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 120.497 -0.481 . . . . 0.0 110.754 177.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . 0.655 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 0.0 OUTLIER -76.12 -38.86 56.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.011 0.434 . . . . 0.0 111.181 173.842 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 12.3 tp -53.24 -59.74 4.18 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.692 -0.686 . . . . 0.0 112.107 178.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.891 HD22 HD23 ' A' ' 965' ' ' LEU . 9.9 tp -57.82 -38.5 75.72 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-O 121.529 0.68 . . . . 0.0 109.711 177.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . 0.655 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 42.4 t-20 -49.34 -51.32 35.26 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 113.895 -1.502 . . . . 0.0 111.549 -176.396 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . 0.456 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 28.7 t -78.17 -31.53 49.68 Favored 'General case' 0 C--N 1.319 -0.717 0 C-N-CA 120.163 -0.615 . . . . 0.0 111.969 179.267 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . 0.4 ' O ' ' HB2' ' A' ' 997' ' ' GLU . 0.1 OUTLIER -71.32 -34.6 70.72 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 119.146 -1.021 . . . . 0.0 111.76 -179.925 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 0.98 HD22 HD13 ' A' ' 962' ' ' LEU . 3.0 pp -71.71 -16.95 62.25 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 171.22 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -78.59 -27.0 45.58 Favored 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 119.981 -0.688 . . . . 0.0 109.898 167.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.456 ' HG2' ' O ' ' A' ' 993' ' ' SER . 5.0 mm-40 -72.15 -45.29 61.09 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 173.012 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.882 HD13 ' HB2' ' A' 1025 ' ' ALA . 0.1 OUTLIER -56.17 -48.03 77.12 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.941 -176.074 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.585 ' O ' ' HB2' ' A' 1003 ' ' LYS . 91.6 mt -66.75 -40.59 86.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.265 -175.329 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 16.7 m-80 -62.04 -40.15 94.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.344 0.592 . . . . 0.0 111.709 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.866 ' HD3' ' HG2' ' A' 1020 ' ' GLN . 86.6 mttt -79.84 -40.84 27.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 122.097 0.951 . . . . 0.0 109.288 -175.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.576 ' CG ' ' HB3' ' A' ' 951' ' ' TYR . 22.5 ttp -61.06 -26.38 67.6 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.232 -1.349 . . . . 0.0 109.637 175.18 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.585 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 11.5 tptp -74.12 -54.96 6.69 Favored 'General case' 0 N--CA 1.438 -1.037 0 CA-C-N 114.894 -1.048 . . . . 0.0 111.551 -171.43 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.73 ' HA ' ' HB2' ' A' 1007 ' ' GLN . 7.6 mp -68.05 -13.73 62.43 Favored 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 120.305 -0.558 . . . . 0.0 110.73 179.389 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.885 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -69.86 -42.2 73.84 Favored 'General case' 0 C--O 1.213 -0.841 0 C-N-CA 119.768 -0.773 . . . . 0.0 109.326 176.075 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.954 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -77.35 -34.57 55.09 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 119.063 -0.494 . . . . 0.0 111.754 171.224 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.73 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 14.7 mm100 -46.14 -49.01 17.26 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.399 0.618 . . . . 0.0 110.637 175.107 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.553 ' HB2' HD22 ' A' 1013 ' ' LEU . 60.0 m-85 -126.99 46.28 2.54 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.602 0.715 . . . . 0.0 110.584 172.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 1.11 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 10.7 p -54.05 -18.53 2.45 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.352 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.219 170.255 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 84.5 mtp -49.32 -38.17 26.82 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 113.796 -1.547 . . . . 0.0 111.731 174.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1011 ' ' THR . . . . . 0.419 ' O ' ' HB3' ' A' 1014 ' ' GLN . 0.0 OUTLIER -162.55 -102.82 0.02 OUTLIER 'General case' 0 C--O 1.245 0.862 0 N-CA-C 114.976 1.473 . . . . 0.0 114.976 179.729 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 19.7 m -57.7 -60.52 3.56 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.906 -164.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1013 ' ' LEU . . . . . 0.713 ' HG ' ' CE2' ' A' 1017 ' ' TYR . 3.1 mp -45.85 -43.09 13.21 Favored 'General case' 0 CA--C 1.506 -0.734 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 177.08 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 1.11 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.99 -50.21 69.57 Favored 'General case' 0 N--CA 1.443 -0.822 0 O-C-N 123.752 0.658 . . . . 0.0 111.879 -168.972 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.687 ' O ' ' HB3' ' A' 1019 ' ' LYS . 12.8 mm100 -70.26 -41.62 73.25 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.433 -174.383 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . 0.476 ' O ' ' HD3' ' A' 1019 ' ' LYS . 30.2 tt0 -69.3 -55.04 11.65 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.338 0.59 . . . . 0.0 110.833 178.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.885 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 9.9 m-85 -60.08 -38.8 83.98 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -176.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.601 ' HA ' ' HB3' ' A' 1021 ' ' MET . 23.5 tptm -81.21 -30.45 34.26 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.539 -178.406 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . 0.687 ' HB3' ' O ' ' A' 1015 ' ' GLN . 0.1 OUTLIER -73.34 -39.04 65.53 Favored 'General case' 0 C--O 1.222 -0.36 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 175.17 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . 0.866 ' HG2' ' HD3' ' A' 1001 ' ' LYS . 10.3 tt0 -63.66 -32.41 73.88 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.424 165.24 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.601 ' HB3' ' HA ' ' A' 1018 ' ' LYS . 2.0 tmt? -64.25 -51.12 65.19 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 177.538 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . 0.555 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -81.82 -6.82 59.4 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 119.343 -0.943 . . . . 0.0 109.919 -175.005 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 62.8 m -87.33 -36.75 17.66 Favored 'General case' 0 C--O 1.223 -0.313 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 173.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.514 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -79.08 -22.72 44.88 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 172.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.882 ' HB2' HD13 ' A' ' 998' ' ' LEU . . . -86.14 -22.44 27.05 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.113 169.612 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.591 ' O ' HG23 ' A' 1030 ' ' VAL . 83.7 t60 -76.43 -25.0 53.99 Favored 'General case' 0 C--O 1.214 -0.792 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 165.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . 0.514 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -69.14 -41.09 77.77 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 123.783 0.833 . . . . 0.0 109.959 163.332 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.681 ' CD1' HD22 ' A' ' 998' ' ' LEU . 18.0 mt -60.44 -45.58 93.14 Favored 'General case' 0 C--N 1.314 -0.95 0 C-N-CA 119.933 -0.707 . . . . 0.0 109.259 170.072 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . 0.546 ' HA ' HG22 ' A' ' 933' ' ' VAL . . . -57.55 -42.91 83.93 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.41 0.148 . . . . 0.0 111.274 173.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' 1026 ' ' HIS . 12.3 t -67.4 -52.16 44.84 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 CA-C-O 121.652 0.739 . . . . 0.0 110.648 -177.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.503 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 38.8 m-20 -77.34 -29.39 53.44 Favored 'General case' 0 C--O 1.216 -0.681 0 CA-C-N 114.742 -1.117 . . . . 0.0 112.207 -174.51 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.945 ' HA ' HD22 ' A' 1035 ' ' LEU . . . -71.82 -29.9 64.92 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 170.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.418 ' O ' ' HG ' ' A' 1036 ' ' LEU . 87.9 tttt -65.68 -49.36 68.86 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.823 0.821 . . . . 0.0 109.18 168.304 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.503 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 10.6 t30 -68.74 -44.3 74.08 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 114.383 -1.28 . . . . 0.0 112.8 -174.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.945 HD22 ' HA ' ' A' 1032 ' ' ALA . 0.2 OUTLIER -64.52 -37.63 88.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 118.039 0.382 . . . . 0.0 110.099 -176.75 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.553 HD23 HG21 ' A' ' 929' ' ' VAL . 4.0 pp -72.03 -41.57 67.37 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 117.25 -1.78 . . . . 0.0 108.888 178.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.495 ' HB3' ' O ' ' A' 1034 ' ' ASN . 7.6 t70 -49.85 -46.23 51.18 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 114.272 -1.331 . . . . 0.0 110.117 172.479 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.533 HG13 ' HG3' ' A' ' 983' ' ' GLU . 15.5 t -54.51 -47.28 71.42 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.643 0 CA-C-N 114.004 -1.453 . . . . 0.0 111.822 174.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.755 HD11 ' HA ' ' A' ' 984' ' ' ILE . 1.4 mp -77.77 -35.68 21.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 118.775 0.716 . . . . 0.0 112.076 179.338 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.777 ' HA ' ' HE ' ' A' 1043 ' ' ARG . 1.9 m-20 -59.23 -45.9 89.92 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-O 120.73 0.3 . . . . 0.0 110.832 173.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . 0.413 ' HB3' ' O ' ' A' 1037 ' ' ASP . 0.0 OUTLIER -77.73 -26.33 49.91 Favored 'General case' 0 N--CA 1.432 -1.353 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 176.294 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.569 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -54.29 -48.45 71.24 Favored 'General case' 0 CA--C 1.505 -0.773 0 C-N-CA 122.997 0.519 . . . . 0.0 111.804 175.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.777 ' HE ' ' HA ' ' A' 1040 ' ' ASP . 3.2 ptt180 -70.61 -40.5 73.15 Favored 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 120.432 -0.507 . . . . 0.0 109.75 -177.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 12.3 tp . . . . . 0 C--O 1.221 -0.432 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.104 173.608 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.458 ' HA ' ' HG2' ' A' ' 927' ' ' GLU . 12.2 mmtp . . . . . 0 N--CA 1.456 -0.169 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.619 HG23 HD22 ' A' 1036 ' ' LEU . 33.9 m -62.22 -29.86 47.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 176.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.02 -32.95 57.42 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 118.854 -0.594 . . . . 0.0 111.651 176.535 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . 0.826 ' HA ' ' HB ' ' A' ' 930' ' ' THR . 4.1 pt-20 -75.64 -25.59 56.98 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.833 1.197 . . . . 0.0 111.268 176.808 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.589 ' OD1' ' HB ' ' A' ' 964' ' ' THR . 69.8 m-80 -75.63 -26.89 58.15 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 119.338 0.972 . . . . 0.0 110.582 173.013 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.728 HG22 ' HB1' ' A' 1032 ' ' ALA . 98.4 t -75.15 -30.1 22.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 167.189 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.826 ' HB ' ' HA ' ' A' ' 927' ' ' GLU . 0.9 OUTLIER -63.26 -42.85 99.2 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 169.907 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -72.56 -54.02 7.97 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 120.667 -0.778 . . . . 0.0 113.585 176.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.556 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.8 pp -62.33 -48.47 79.67 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -176.577 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 79.7 t -67.28 -39.89 83.82 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 CA-C-O 121.103 0.477 . . . . 0.0 110.913 -175.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.602 ' HB2' ' O ' ' A' ' 930' ' ' THR . 0.2 OUTLIER -62.07 -35.38 78.47 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.683 179.036 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -64.16 -42.18 96.86 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.832 176.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.746 HG22 ' HB1' ' A' 1025 ' ' ALA . 49.6 t -49.76 -85.01 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 C-N-CA 123.36 0.664 . . . . 0.0 112.218 -179.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.452 ' O ' ' HB2' ' A' ' 940' ' ' SER . 15.8 pt -61.61 -42.47 94.24 Favored 'Isoleucine or valine' 0 C--O 1.248 1.005 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -173.03 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.523 ' HB3' ' O ' ' A' ' 934' ' ' LYS . 23.9 tp10 -61.5 -53.2 59.61 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.271 -172.504 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 78.4 mtp -71.3 -26.55 62.91 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.36 -177.076 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.452 ' HB2' ' O ' ' A' ' 937' ' ' ILE . 6.9 m . . . . . 0 CA--C 1.514 -0.441 0 O-C-N 124.238 0.961 . . . . 0.0 112.122 -172.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 1.119 ' HA ' ' HB3' ' A' ' 954' ' ' MET . 0.4 OUTLIER . . . . . 0 C--O 1.216 -0.67 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 0.698 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 56.8 t -64.42 -52.41 53.49 Favored Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 166.332 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 0.698 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 25.6 Cg_exo -50.01 -37.81 47.88 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 121.845 1.696 . . . . 0.0 112.474 162.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 1.119 ' HB3' ' HA ' ' A' ' 951' ' ' TYR . 3.6 tpt -64.96 -32.73 74.59 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 122.764 0.426 . . . . 0.0 110.825 174.359 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.624 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 87.9 t -53.75 -41.65 48.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 169.336 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.507 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 8.9 tmtt? -67.78 -32.04 72.35 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.482 176.071 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -78.0 -48.06 17.07 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.967 0.413 . . . . 0.0 111.597 -175.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.559 HG22 HD23 ' A' ' 962' ' ' LEU . 12.5 p -84.99 -35.52 10.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.279 -178.453 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -62.26 -41.25 99.73 Favored Glycine 0 N--CA 1.448 -0.546 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 179.182 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . 0.57 ' O ' ' HG3' ' A' ' 963' ' ' ARG . 24.9 tp -71.75 -31.2 66.41 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.667 -0.123 . . . . 0.0 110.667 178.039 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -73.7 -60.83 2.07 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.968 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 1.058 HD13 HD22 ' A' ' 995' ' ' LEU . 4.0 pp -50.64 -35.35 30.11 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 172.039 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.604 ' N ' HD12 ' A' ' 962' ' ' LEU . 0.0 OUTLIER -71.09 -36.21 72.11 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 120.173 1.351 . . . . 0.0 111.022 175.2 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . 0.589 ' HB ' ' OD1' ' A' ' 928' ' ' ASN . 17.6 m -71.56 -27.0 62.86 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.281 -0.567 . . . . 0.0 109.498 177.563 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.635 HD23 HD22 ' A' ' 991' ' ' LEU . 36.8 tp -65.65 -45.55 82.54 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-O 122.103 0.954 . . . . 0.0 109.566 169.303 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.717 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 9.2 tt -65.54 -37.25 86.19 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 114.484 -1.235 . . . . 0.0 108.664 -176.084 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . 0.585 ' O ' ' HB2' ' A' ' 971' ' ' GLU . . . -75.53 -29.47 59.44 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.492 179.277 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 1.1 p -72.03 -36.48 69.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 118.497 0.59 . . . . 0.0 110.029 174.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.702 HG12 HG23 ' A' ' 984' ' ' ILE . 96.9 t -72.43 -39.25 62.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.311 171.677 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.945 ' HB2' HE22 ' A' ' 988' ' ' GLN . 26.1 t70 -65.9 -38.15 87.98 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 122.19 0.995 . . . . 0.0 108.435 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.687 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 4.9 tp10 -63.56 -37.0 85.67 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.045 -1.434 . . . . 0.0 109.496 176.376 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.469 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 24.1 m -63.26 -17.97 63.07 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.559 175.596 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.765 ' HA ' HD13 ' A' ' 984' ' ' ILE . 8.4 tt -68.88 -52.62 16.73 Favored Pre-proline 0 CA--C 1.535 0.372 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.265 -177.199 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.736 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 1.8 Cg_endo -87.8 -14.3 3.65 Favored 'Trans proline' 0 C--N 1.358 1.036 0 C-N-CA 121.667 1.578 . . . . 0.0 113.676 174.409 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.498 HG23 ' O ' ' A' ' 971' ' ' GLU . 13.7 t . . . . . 0 C--O 1.233 0.2 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 173.035 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.486 HG23 ' HB1' ' A' 1042 ' ' ALA . 16.1 m . . . . . 0 CA--C 1.538 0.5 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -50.27 -36.26 30.62 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 -171.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . 0.534 ' HA ' ' HG2' ' A' ' 985' ' ' GLU . 7.0 ptp180 -83.2 -22.36 33.19 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 118.986 -1.085 . . . . 0.0 112.142 -168.74 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.515 ' OE2' HG13 ' A' 1038 ' ' VAL . 2.0 mt-10 -80.03 -35.74 36.81 Favored 'General case' 0 CA--C 1.501 -0.931 0 C-N-CA 119.39 -0.924 . . . . 0.0 109.734 171.095 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.765 HD13 ' HA ' ' A' ' 973' ' ' LEU . 48.7 mt -64.97 -37.44 80.25 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-N 114.795 -1.093 . . . . 0.0 108.927 178.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . 0.534 ' HG2' ' HA ' ' A' ' 982' ' ' ARG . 11.3 pt-20 -74.09 -38.52 63.85 Favored 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 118.317 -1.353 . . . . 0.0 110.362 -177.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . 0.654 ' O ' ' HB3' ' A' ' 989' ' ' LYS . 26.3 ttt -72.22 -37.28 69.24 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.889 -173.746 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.995 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -76.34 -49.74 16.08 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.878 -1.056 . . . . 0.0 111.879 -172.528 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.945 HE22 ' HB2' ' A' ' 970' ' ' ASP . 4.7 pt20 -59.73 -26.15 65.41 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.559 0.695 . . . . 0.0 109.629 173.378 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . 0.796 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 7.8 tmtm? -71.11 -39.73 71.9 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.586 -1.188 . . . . 0.0 111.287 172.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 18.2 tp -55.97 -58.36 8.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.569 176.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.635 HD22 HD23 ' A' ' 965' ' ' LEU . 13.0 tp -55.19 -36.07 65.5 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.557 0.694 . . . . 0.0 109.804 177.068 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . 0.796 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 25.4 t-20 -48.86 -52.04 26.43 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 113.751 -1.568 . . . . 0.0 112.119 -177.106 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 32.1 t -74.39 -35.83 63.49 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.33 -36.69 77.2 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 119.246 -0.982 . . . . 0.0 111.829 -178.358 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 1.058 HD22 HD13 ' A' ' 962' ' ' LEU . 3.2 pp -70.45 -23.47 62.72 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 122.808 0.443 . . . . 0.0 110.416 172.294 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -73.44 -28.1 61.78 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 119.527 -0.869 . . . . 0.0 109.978 170.318 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.766 ' O ' ' HG2' ' A' 1001 ' ' LYS . 17.0 mt-10 -75.25 -41.72 56.74 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 172.091 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.648 ' HB3' ' HA ' ' A' ' 995' ' ' LEU . 0.4 OUTLIER -54.78 -46.76 74.47 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.968 -175.611 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 995' ' ' LEU . 71.5 mt -66.84 -43.28 89.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.199 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 10.3 m-80 -58.5 -44.89 89.61 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.453 0.644 . . . . 0.0 112.34 -178.343 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.766 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 28.5 mmtp -74.7 -40.38 61.38 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 122.29 1.043 . . . . 0.0 108.381 -171.624 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.569 ' HG2' ' CG ' ' A' ' 951' ' ' TYR . 16.2 ttp -57.03 -43.89 82.36 Favored 'General case' 0 N--CA 1.428 -1.531 0 CA-C-N 113.894 -1.503 . . . . 0.0 108.419 176.841 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.494 ' HA ' ' CE1' ' A' ' 951' ' ' TYR . 1.5 tptm -64.0 -33.0 74.75 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 114.141 -1.391 . . . . 0.0 112.313 -168.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.801 HD13 ' HG3' ' A' 1007 ' ' GLN . 4.2 mm? -84.06 -14.87 49.39 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.007 -0.677 . . . . 0.0 110.948 177.273 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.64 ' HB1' ' HA ' ' A' 1014 ' ' GLN . . . -63.45 -50.81 68.26 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 119.391 -0.924 . . . . 0.0 110.55 -177.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 1.026 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 2.2 pp0? -76.99 -24.66 52.23 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 118.979 0.809 . . . . 0.0 110.936 177.328 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.801 ' HG3' HD13 ' A' 1004 ' ' LEU . 18.4 mm-40 -41.75 -40.08 1.91 Allowed 'General case' 0 C--N 1.344 0.336 0 CA-C-O 121.363 0.601 . . . . 0.0 109.795 169.737 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.921 ' HD2' HD22 ' A' 1013 ' ' LEU . 82.7 m-85 -132.1 45.1 2.81 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.631 166.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 1.032 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 7.3 p -49.48 -22.96 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 CA-C-O 121.251 0.548 . . . . 0.0 109.987 171.469 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 21.6 mmt -42.7 -45.83 4.86 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.938 174.043 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1011 ' ' THR . . . . . . . . . . . . . 15.9 m -162.23 -84.24 0.03 OUTLIER 'General case' 0 C--O 1.248 0.987 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 176.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1012 ' ' SER . . . . . 0.454 ' O ' ' HG2' ' A' 1015 ' ' GLN . 15.6 m -55.27 -73.41 0.05 Allowed 'General case' 0 C--O 1.234 0.256 0 CA-C-N 114.807 -1.088 . . . . 0.0 112.844 -164.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1013 ' ' LEU . . . . . 0.921 HD22 ' HD2' ' A' 1008 ' ' TYR . 8.7 mp -47.72 -42.85 26.22 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -177.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 1.032 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -55.8 -45.73 78.16 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.206 -0.598 . . . . 0.0 111.083 -169.403 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.46 ' O ' ' HD3' ' A' 1019 ' ' LYS . 11.0 pt20 -75.57 -41.04 55.76 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.153 -176.287 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -72.39 -56.33 5.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.328 0.585 . . . . 0.0 110.834 -178.184 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.695 ' CE2' ' HG ' ' A' 1013 ' ' LEU . 8.7 m-85 -58.03 -39.01 77.32 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.097 -0.956 . . . . 0.0 113.241 -178.12 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.572 ' HA ' ' CB ' ' A' 1021 ' ' MET . 8.4 ttpp -82.17 -24.59 34.91 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.844 -176.557 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . 0.46 ' HD3' ' O ' ' A' 1015 ' ' GLN . 4.0 mptp? -71.57 -46.12 60.28 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 171.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -56.19 -31.93 63.9 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 114.867 -1.061 . . . . 0.0 110.986 164.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.587 ' HG2' HD22 ' A' ' 998' ' ' LEU . 18.2 tmm? -69.21 -53.69 18.66 Favored 'General case' 0 CA--C 1.509 -0.611 0 O-C-N 122.16 -0.337 . . . . 0.0 110.793 176.076 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . 0.5 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.3 OUTLIER -80.29 -8.55 59.52 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 119.478 -0.889 . . . . 0.0 109.78 -171.229 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 85.3 m -88.83 -31.43 18.32 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.725 172.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.474 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -79.42 -24.73 42.32 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-O 121.419 0.628 . . . . 0.0 109.444 171.489 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.746 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -86.44 -24.74 25.55 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.222 170.59 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.563 ' O ' HG23 ' A' 1030 ' ' VAL . 47.0 t-80 -74.6 -26.73 60.1 Favored 'General case' 0 C--O 1.214 -0.765 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 164.533 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . 0.47 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -68.97 -40.72 78.67 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 123.664 0.785 . . . . 0.0 110.118 163.576 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.668 HD21 ' N ' ' A' ' 995' ' ' LEU . 22.6 mt -59.81 -44.69 93.86 Favored 'General case' 0 C--N 1.315 -0.898 0 C-N-CA 119.996 -0.682 . . . . 0.0 109.456 169.638 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -58.46 -43.25 88.8 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.755 0.312 . . . . 0.0 111.383 173.09 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.563 HG23 ' O ' ' A' 1026 ' ' HIS . 13.2 t -67.79 -50.55 59.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.168 0.509 . . . . 0.0 110.747 -177.113 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.6 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 47.0 m-20 -75.32 -28.93 59.85 Favored 'General case' 0 C--O 1.214 -0.804 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.551 -175.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.766 ' HA ' HD12 ' A' 1035 ' ' LEU . . . -64.35 -39.58 94.16 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 168.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.404 ' HE2' ' HB3' ' A' 1033 ' ' LYS . 13.4 ttpt -63.1 -43.94 97.07 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 122.092 0.948 . . . . 0.0 109.25 171.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.6 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 51.2 t30 -72.93 -52.56 14.15 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-N 113.975 -1.466 . . . . 0.0 112.465 -171.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.995 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 0.0 OUTLIER -64.32 -34.95 79.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 119.468 -0.301 . . . . 0.0 110.759 -173.284 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.678 ' N ' HD13 ' A' 1035 ' ' LEU . 4.6 pp -72.97 -36.47 67.11 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 116.88 -1.928 . . . . 0.0 109.673 177.252 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.541 ' HB3' ' O ' ' A' 1034 ' ' ASN . 20.5 t70 -55.24 -43.54 74.68 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 122.336 1.065 . . . . 0.0 110.087 172.637 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.547 ' HB ' ' O ' ' A' 1035 ' ' LEU . 15.2 t -51.95 -58.18 2.69 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.512 0 CA-C-N 113.302 -1.772 . . . . 0.0 111.019 172.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.763 HG12 HG12 ' A' ' 984' ' ' ILE . 2.5 mp -67.52 -23.87 30.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 118.188 0.449 . . . . 0.0 111.604 179.371 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 1.5 t0 -62.3 -48.98 77.48 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.694 0.759 . . . . 0.0 110.285 171.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -72.58 -36.31 68.13 Favored 'General case' 0 C--N 1.31 -1.136 0 O-C-N 122.021 -0.424 . . . . 0.0 109.951 176.183 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.702 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -53.02 -48.93 67.18 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 123.462 0.705 . . . . 0.0 112.499 -179.544 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.617 ' HG2' ' O ' ' A' 1039 ' ' ILE . 9.7 ptp180 -61.07 -51.8 67.62 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.353 179.444 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 3.2 tm? . . . . . 0 N--CA 1.464 0.246 0 CA-C-O 121.213 0.53 . . . . 0.0 109.836 179.612 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . . . . . . . . . 15.0 tptp . . . . . 0 N--CA 1.466 0.347 0 N-CA-C 111.779 0.289 . . . . 0.0 111.779 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.639 ' CG2' ' HB3' ' A' 1036 ' ' LEU . 1.5 p -61.11 -31.83 51.09 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 CA-C-O 121.295 0.569 . . . . 0.0 110.894 174.764 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -36.64 82.04 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 123.591 0.756 . . . . 0.0 111.882 178.031 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -75.04 -23.41 58.13 Favored 'General case' 0 C--N 1.313 -1.001 0 C-N-CA 118.374 -1.33 . . . . 0.0 110.195 -179.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.44 ' O ' ' HB1' ' A' ' 961' ' ' ALA . 1.6 m120 -69.21 -31.11 69.48 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 173.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.586 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 46.6 t -81.13 -28.87 10.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 114.79 -1.095 . . . . 0.0 110.154 174.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . . . . . . . . . 22.3 m -55.61 -43.12 75.79 Favored 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 165.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -71.03 -53.13 11.26 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-N 115.318 -0.855 . . . . 0.0 114.087 178.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.586 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.4 pp -62.22 -47.92 82.29 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 117.513 0.657 . . . . 0.0 112.694 -176.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 75.9 t -65.32 -36.12 76.95 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 CA-C-O 121.083 0.468 . . . . 0.0 110.862 -176.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.525 ' HD2' ' C ' ' A' ' 934' ' ' LYS . 0.1 OUTLIER -55.35 -45.39 76.46 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.822 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . 0.4 ' HB3' HG12 ' A' ' 958' ' ' VAL . . . -63.26 -34.15 77.06 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.625 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.769 HG22 ' HB1' ' A' 1025 ' ' ALA . 59.0 t -54.03 -76.03 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 CA-C-O 121.11 0.481 . . . . 0.0 112.166 -179.391 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 21.0 pt -68.7 -38.63 79.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -175.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -66.45 -52.22 48.61 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.613 0.72 . . . . 0.0 110.288 -175.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 23.2 mmt -69.66 -24.35 63.6 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 119.596 -0.842 . . . . 0.0 109.231 -179.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.523 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 5.7 p . . . . . 0 C--N 1.343 0.284 0 CA-C-O 121.187 0.518 . . . . 0.0 110.022 -175.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.597 ' O ' HG23 ' A' ' 955' ' ' VAL . 27.4 m-85 . . . . . 0 N--CA 1.469 0.479 0 N-CA-C 116.222 1.934 . . . . 0.0 116.222 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 0.601 ' O ' ' HB ' ' A' ' 955' ' ' VAL . 43.2 t -49.76 -45.56 79.68 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 118.667 0.667 . . . . 0.0 112.041 174.601 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 0.619 ' O ' ' HB3' ' A' ' 956' ' ' LYS . 36.3 Cg_exo -50.01 -44.55 36.91 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 122.089 1.859 . . . . 0.0 112.899 174.162 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.561 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 4.4 ptp -75.32 -29.75 60.12 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 178.158 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.601 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 99.2 t -54.67 -36.5 36.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.145 168.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.619 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 23.2 ttpt -59.07 -43.44 91.77 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.886 171.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . 0.52 ' HG2' ' HA ' ' A' ' 954' ' ' MET . 14.6 pt-20 -79.63 -43.41 22.9 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 119.75 -0.78 . . . . 0.0 112.087 -178.133 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.534 HG22 ' HA ' ' A' ' 955' ' ' VAL . 16.7 m -76.52 -33.04 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-O 120.689 0.281 . . . . 0.0 110.904 -179.042 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -68.88 -35.77 80.23 Favored Glycine 0 N--CA 1.436 -1.33 0 N-CA-C 110.474 -1.05 . . . . 0.0 110.474 175.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . 0.607 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 16.5 tp -65.73 -38.33 88.86 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 172.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.44 ' HB1' ' O ' ' A' ' 928' ' ' ASN . . . -68.45 -58.46 4.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.647 -0.251 . . . . 0.0 110.757 -177.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.576 HD22 HD22 ' A' ' 995' ' ' LEU . 0.1 OUTLIER -43.54 -49.91 7.32 Favored 'General case' 0 C--O 1.215 -0.748 0 CA-C-O 118.596 -0.716 . . . . 0.0 112.698 167.591 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.607 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 6.4 ptp180 -68.43 -29.0 67.56 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 120.303 1.41 . . . . 0.0 110.805 -179.163 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . 0.408 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 43.7 m -68.24 -37.99 81.37 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 174.572 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.619 HD11 HD21 ' A' 1035 ' ' LEU . 0.0 OUTLIER -66.28 -40.01 89.79 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.17 174.423 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.43 ' HG ' HE21 ' A' ' 988' ' ' GLN . 10.4 tt -67.91 -41.45 82.64 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 114.727 -1.124 . . . . 0.0 108.307 -175.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . 0.579 ' O ' ' HB2' ' A' ' 971' ' ' GLU . . . -72.59 -38.77 67.75 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-N 114.966 -1.015 . . . . 0.0 112.021 -179.508 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 9.8 p -61.92 -40.98 97.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 118.657 0.662 . . . . 0.0 110.3 177.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.985 HG12 HG23 ' A' ' 984' ' ' ILE . 67.7 t -73.94 -38.54 49.99 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.712 174.493 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.892 ' HB2' HE22 ' A' ' 988' ' ' GLN . 12.1 t70 -67.75 -44.38 77.66 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.805 0.812 . . . . 0.0 109.585 -177.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.592 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 0.6 OUTLIER -63.83 -32.5 74.04 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 114.667 -1.152 . . . . 0.0 109.26 177.536 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.631 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 39.8 m -65.3 -18.02 64.98 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.53 175.397 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.753 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 9.7 tt -69.62 -52.65 13.77 Favored Pre-proline 0 CA--C 1.532 0.262 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.087 -179.171 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.753 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 3.0 Cg_exo -80.36 -2.12 11.77 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.627 1.551 . . . . 0.0 113.116 172.54 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.631 ' HB ' ' HA ' ' A' ' 972' ' ' SER . 15.0 t . . . . . 0 C--N 1.329 -0.321 0 N-CA-C 110.094 -0.336 . . . . 0.0 110.094 173.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.414 ' HB ' ' HB1' ' A' 1042 ' ' ALA . 40.9 p . . . . . 0 CA--C 1.52 -0.184 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.714 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 0.3 OUTLIER -55.56 -34.34 64.65 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.345 -178.65 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . 0.457 HH11 ' HD3' ' A' ' 982' ' ' ARG . 9.5 ptp180 -84.48 -19.21 33.71 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.477 -178.479 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.733 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 0.5 OUTLIER -73.98 -38.85 64.04 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 172.586 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.985 HG23 HG12 ' A' ' 969' ' ' VAL . 65.6 mt -72.01 -29.51 33.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 114.225 -1.352 . . . . 0.0 109.206 179.387 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . 0.714 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 26.6 mt-10 -65.0 -51.63 60.63 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.402 0.62 . . . . 0.0 110.444 174.162 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 25.5 ttt -70.23 -43.28 70.95 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.311 -170.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.982 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -74.54 -50.85 16.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.066 -0.97 . . . . 0.0 112.827 -171.236 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.892 HE22 ' HB2' ' A' ' 970' ' ' ASP . 3.2 pt20 -65.29 -23.04 66.93 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 119.817 -0.753 . . . . 0.0 109.94 179.432 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . 0.772 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 6.8 tttp -74.31 -40.67 62.07 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.327 171.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.422 ' HB3' ' O ' ' A' ' 987' ' ' ALA . 27.5 tp -52.19 -59.79 3.97 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.208 178.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.648 ' HB2' ' CD2' ' A' 1035 ' ' LEU . 0.3 OUTLIER -66.04 -28.91 69.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.519 0.676 . . . . 0.0 109.789 179.059 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . 0.772 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 23.7 t-20 -52.05 -56.39 14.65 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.436 -1.257 . . . . 0.0 111.485 179.752 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 34.1 t -77.84 -33.99 52.07 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 111.776 0.288 . . . . 0.0 111.776 -178.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . 0.433 ' O ' ' HB3' ' A' ' 997' ' ' GLU . 0.6 OUTLIER -66.99 -36.34 81.95 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 120.176 -0.61 . . . . 0.0 112.354 -179.823 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 0.627 HD12 HD13 ' A' 1028 ' ' LEU . 8.4 tt -73.7 -17.45 61.13 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 173.041 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -75.29 -26.46 58.76 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 119.77 -0.772 . . . . 0.0 109.77 167.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.433 ' HB3' ' O ' ' A' ' 994' ' ' ASP . 3.8 tp10 -74.51 -40.63 61.67 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 173.14 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.95 HD13 ' HB2' ' A' 1025 ' ' ALA . 2.2 tp -55.91 -46.98 78.25 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.039 0.447 . . . . 0.0 110.747 178.058 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.78 ' HA ' ' SD ' ' A' 1002 ' ' MET . 80.1 mt -68.57 -38.5 79.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.881 -171.093 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -60.59 -46.86 88.65 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.442 0.639 . . . . 0.0 111.254 -177.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.531 ' O ' ' HB3' ' A' 1017 ' ' TYR . 89.7 mttt -84.62 -31.8 24.06 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.962 -173.165 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.78 ' SD ' ' HA ' ' A' ' 999' ' ' ILE . 13.1 ptm -64.29 -27.81 69.29 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 122.099 0.952 . . . . 0.0 108.512 173.47 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.616 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 9.4 tptp -67.26 -54.01 24.73 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 114.145 -1.389 . . . . 0.0 110.352 -171.255 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.634 ' HG ' ' NE2' ' A' 1007 ' ' GLN . 9.1 mp -71.14 -13.8 62.07 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.388 -178.68 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.655 ' HB1' ' NE2' ' A' 1014 ' ' GLN . . . -69.26 -55.15 11.37 Favored 'General case' 0 C--O 1.217 -0.638 0 C-N-CA 119.888 -0.725 . . . . 0.0 110.289 179.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.968 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 0.8 OUTLIER -63.88 -24.91 67.93 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 118.871 -0.585 . . . . 0.0 112.467 171.787 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.634 ' NE2' ' HG ' ' A' 1004 ' ' LEU . 19.3 mt-30 -51.98 -50.22 61.73 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.625 0.726 . . . . 0.0 110.07 175.528 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.738 ' HB2' ' HG ' ' A' 1013 ' ' LEU . 76.5 m-85 -124.99 49.74 1.83 Allowed 'General case' 0 N--CA 1.442 -0.835 0 CA-C-O 121.588 0.709 . . . . 0.0 109.617 172.361 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 1.052 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 9.3 p -55.41 -19.27 5.29 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.282 0 CA-C-N 114.157 -1.383 . . . . 0.0 109.678 170.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 65.0 mtt -40.01 -51.31 2.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.55 -1.204 . . . . 0.0 110.655 171.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1011 ' ' THR . . . . . . . . . . . . . 41.6 m -162.54 -75.66 0.05 OUTLIER 'General case' 0 C--O 1.239 0.52 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 175.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 13.1 p -55.93 -79.9 0.02 OUTLIER 'General case' 0 C--O 1.248 0.986 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -163.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1013 ' ' LEU . . . . . 0.738 ' HG ' ' HB2' ' A' 1008 ' ' TYR . 13.0 mt -48.19 -42.62 30.39 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.453 -175.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 1.052 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.1 OUTLIER -52.66 -59.15 4.82 Favored 'General case' 0 N--CA 1.437 -1.113 0 O-C-N 123.989 0.806 . . . . 0.0 110.477 -165.73 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.514 ' O ' ' HD3' ' A' 1019 ' ' LYS . 27.7 mt-30 -65.92 -38.21 88.07 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.651 -169.201 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -70.03 -44.94 68.22 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.468 0.652 . . . . 0.0 110.574 178.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.628 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 13.4 m-85 -71.94 -30.76 65.65 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.758 -176.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.596 ' HD3' ' CZ ' ' A' ' 951' ' ' TYR . 23.4 tptm -78.86 -33.99 45.4 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 114.172 -1.376 . . . . 0.0 109.951 -176.001 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . 0.514 ' HD3' ' O ' ' A' 1015 ' ' GLN . 4.6 mptp? -71.1 -44.65 65.21 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 175.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -57.8 -33.01 68.12 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.72 165.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.548 ' HB3' ' HA ' ' A' 1018 ' ' LYS . 1.9 tmt? -65.85 -51.5 58.31 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 110.294 -0.262 . . . . 0.0 110.294 179.21 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . 0.542 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -81.15 -9.69 59.76 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 119.423 -0.911 . . . . 0.0 109.869 -175.713 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 72.7 m -81.97 -41.11 21.22 Favored 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 173.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.503 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -78.51 -22.13 47.84 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-O 121.139 0.495 . . . . 0.0 109.843 174.733 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.95 ' HB2' HD13 ' A' ' 998' ' ' LEU . . . -85.57 -23.57 27.57 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.216 170.441 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.51 ' O ' HG23 ' A' 1030 ' ' VAL . 22.2 t-80 -76.04 -25.92 56.09 Favored 'General case' 0 C--O 1.214 -0.779 0 C-N-CA 120.164 -0.614 . . . . 0.0 109.422 164.154 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . 0.503 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -66.5 -40.15 89.07 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 162.552 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.627 HD13 HD12 ' A' ' 995' ' ' LEU . 16.6 mt -60.17 -49.16 78.73 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 170.629 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -57.11 -41.02 78.18 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 175.29 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.51 HG23 ' O ' ' A' 1026 ' ' HIS . 10.6 t -71.88 -51.55 30.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.44 0.638 . . . . 0.0 110.794 -176.17 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -77.11 -30.12 55.11 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.907 -174.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.516 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -70.7 -32.83 70.2 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 172.342 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 52.5 tttm -62.81 -45.69 91.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.768 0.794 . . . . 0.0 109.37 169.062 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.506 ' O ' ' HB3' ' A' 1037 ' ' ASP . 53.7 t30 -68.14 -50.32 55.35 Favored 'General case' 0 C--O 1.218 -0.595 0 CA-C-N 114.369 -1.287 . . . . 0.0 111.738 -176.408 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.982 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 1.9 pp -62.52 -40.84 98.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 119.084 -0.484 . . . . 0.0 111.047 -171.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.639 ' HB3' ' CG2' ' A' ' 925' ' ' VAL . 3.9 pp -66.26 -42.34 88.63 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 117.66 -1.616 . . . . 0.0 109.587 177.656 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.506 ' HB3' ' O ' ' A' 1034 ' ' ASN . 23.6 t70 -54.47 -38.36 66.29 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-N 113.982 -1.463 . . . . 0.0 110.128 175.663 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' 1034 ' ' ASN . 27.3 t -63.93 -36.5 76.95 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.614 0 CA-C-N 114.453 -1.249 . . . . 0.0 112.366 177.078 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.611 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 1.7 mp -86.56 -32.37 6.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 119.04 0.836 . . . . 0.0 111.094 177.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.524 ' O ' ' HG3' ' A' 1043 ' ' ARG . 4.0 m-20 -62.9 -41.27 99.38 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 169.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -68.2 -39.25 82.5 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.056 170.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.733 ' HB2' ' HG2' ' A' ' 983' ' ' GLU . . . -55.41 -48.75 73.91 Favored 'General case' 0 CA--C 1.49 -1.339 0 C-N-CA 123.066 0.546 . . . . 0.0 110.782 -176.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.639 ' HD3' ' N ' ' A' 1044 ' ' LEU . 0.0 OUTLIER -65.01 -34.97 79.7 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.402 -174.08 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . 0.639 ' N ' ' HD3' ' A' 1043 ' ' ARG . 3.1 tm? . . . . . 0 N--CA 1.45 -0.466 0 CA-C-O 121.567 0.698 . . . . 0.0 110.123 179.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.501 ' HA ' ' HG2' ' A' ' 927' ' ' GLU . 16.4 mmtp . . . . . 0 C--O 1.223 -0.29 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.627 HG23 HD22 ' A' 1036 ' ' LEU . 20.7 m -57.87 -29.12 34.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.709 0.766 . . . . 0.0 110.352 -179.73 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . 0.433 ' O ' HG23 ' A' ' 930' ' ' THR . 14.3 m-85 -72.94 -39.78 65.93 Favored 'General case' 0 CA--C 1.483 -1.603 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.582 175.503 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . 0.506 ' HA ' ' OG1' ' A' ' 930' ' ' THR . 9.3 pt-20 -74.38 -22.29 59.26 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 117.749 -1.58 . . . . 0.0 109.982 -176.406 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -75.05 -32.04 61.43 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.038 -0.726 . . . . 0.0 109.038 172.095 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.672 HG22 ' HB1' ' A' 1032 ' ' ALA . 85.4 t -81.13 -29.79 11.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.244 175.536 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.506 ' OG1' ' HA ' ' A' ' 927' ' ' GLU . 66.5 p -68.82 -29.28 67.58 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 169.351 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -70.19 -53.26 14.6 Favored Glycine 0 CA--C 1.529 0.958 0 CA-C-N 115.113 -0.949 . . . . 0.0 113.14 172.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.661 HD21 HG22 ' A' ' 929' ' ' VAL . 2.6 pp -65.28 -49.32 70.0 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -178.453 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.426 HG22 ' HA ' ' A' 1029 ' ' ALA . 88.6 t -64.27 -41.18 91.58 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-O 121.069 0.461 . . . . 0.0 110.238 -176.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . . . . . . . . . 1.4 ttpt -54.73 -39.92 68.74 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.133 -0.939 . . . . 0.0 109.958 177.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -66.72 -39.95 88.21 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.613 0.227 . . . . 0.0 111.613 -178.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.751 HG22 ' HB1' ' A' 1025 ' ' ALA . 59.7 t -47.46 -68.32 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 O-C-N 123.81 0.694 . . . . 0.0 111.3 179.506 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 26.5 pt -65.45 -37.29 79.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.905 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -58.89 -56.55 20.81 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.57 0.7 . . . . 0.0 110.747 -172.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.431 ' HB2' ' HE3' ' A' ' 954' ' ' MET . 13.3 mmt -76.52 -25.82 54.56 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.52 -0.763 . . . . 0.0 110.394 -177.076 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.546 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 76.9 p . . . . . 0 CA--C 1.516 -0.34 0 CA-C-O 121.447 0.642 . . . . 0.0 110.995 -169.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.992 ' HB3' ' HG3' ' A' 1002 ' ' MET . 22.9 m-85 . . . . . 0 N--CA 1.47 0.567 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 0.653 ' O ' ' HB ' ' A' ' 955' ' ' VAL . 61.4 t -43.87 -46.12 19.63 Favored Pre-proline 0 C--N 1.32 -0.709 0 C-N-CA 122.868 0.467 . . . . 0.0 111.65 172.297 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 0.635 ' HA ' ' HD3' ' A' ' 956' ' ' LYS . 14.1 Cg_exo -45.5 -51.07 8.47 Favored 'Trans proline' 0 CA--C 1.544 0.987 0 C-N-CA 122.434 2.089 . . . . 0.0 113.59 173.591 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.431 ' HE3' ' HB2' ' A' ' 939' ' ' MET . 6.8 ptm -69.56 -30.96 68.87 Favored 'General case' 0 N--CA 1.463 0.199 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 177.615 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.653 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 73.5 t -54.13 -36.68 32.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.778 171.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.635 ' HD3' ' HA ' ' A' ' 953' ' ' PRO . 2.4 mptp? -59.22 -41.63 89.09 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 119.097 -0.477 . . . . 0.0 111.371 171.179 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -77.54 -39.6 45.41 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 118.929 -1.108 . . . . 0.0 111.378 -177.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.649 HG22 ' HA ' ' A' ' 955' ' ' VAL . 24.3 m -73.97 -35.33 41.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 O-C-N 122.208 -0.308 . . . . 0.0 111.2 179.716 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -66.07 -34.96 89.87 Favored Glycine 0 N--CA 1.44 -1.082 0 N-CA-C 110.672 -0.971 . . . . 0.0 110.672 177.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . 0.545 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 9.4 tt -71.29 -33.11 69.43 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.127 -0.537 . . . . 0.0 109.803 176.007 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . 0.415 ' HB1' ' HB3' ' A' ' 932' ' ' LEU . . . -73.83 -37.8 64.74 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.513 -176.519 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.874 HD13 HD22 ' A' ' 991' ' ' LEU . 0.2 OUTLIER -66.5 -49.38 66.76 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-O 119.303 -0.38 . . . . 0.0 110.638 171.792 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.545 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 12.7 ptm180 -64.24 -30.29 71.35 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 118.856 0.753 . . . . 0.0 111.042 -177.416 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . 0.402 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 38.7 m -69.14 -33.89 74.15 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 176.641 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.466 ' CD1' ' HB ' ' A' ' 925' ' ' VAL . 31.9 tp -71.34 -39.87 71.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 122.053 0.93 . . . . 0.0 109.669 175.176 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.548 ' HG ' HE21 ' A' ' 988' ' ' GLN . 10.4 tt -63.18 -43.94 96.82 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 114.505 -1.225 . . . . 0.0 108.812 -177.251 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -70.19 -38.61 75.38 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 114.787 -1.097 . . . . 0.0 111.977 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 3.2 p -65.46 -44.17 88.03 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.544 177.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.869 HG12 HG23 ' A' ' 984' ' ' ILE . 61.2 t -68.35 -36.41 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.246 175.134 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.848 ' HB2' HE22 ' A' ' 988' ' ' GLN . 8.1 t70 -69.38 -41.96 75.8 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 122.24 1.019 . . . . 0.0 109.031 -179.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.619 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 39.1 tt0 -73.24 -22.31 60.44 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 114.482 -1.236 . . . . 0.0 109.476 -179.324 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.699 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 58.7 m -72.9 -15.97 61.57 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.925 172.324 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.764 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 8.1 tt -64.08 -50.65 67.8 Favored Pre-proline 0 C--N 1.329 -0.302 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 175.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.764 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 13.2 Cg_exo -72.34 -11.85 27.01 Favored 'Trans proline' 0 C--N 1.355 0.916 0 C-N-CA 121.705 1.603 . . . . 0.0 113.396 169.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.699 ' HB ' ' HA ' ' A' ' 972' ' ' SER . 45.9 t . . . . . 0 C--N 1.328 -0.366 0 O-C-N 122.034 -0.416 . . . . 0.0 110.269 174.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . . . . . . . . . 88.4 m . . . . . 0 CA--C 1.535 0.397 0 CA-C-O 121.104 0.478 . . . . 0.0 110.369 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.47 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 14.1 p80 -50.36 -57.37 8.09 Favored 'General case' 0 C--O 1.219 -0.517 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 -176.118 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 5.5 ptp180 -56.23 -22.65 30.9 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 113.974 1.101 . . . . 0.0 113.974 -176.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.54 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 2.6 mp0 -77.08 -38.21 52.92 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 119.11 0.868 . . . . 0.0 109.97 174.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.869 HG23 HG12 ' A' ' 969' ' ' VAL . 32.7 mt -71.11 -30.68 41.91 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.935 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.096 177.408 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 42.7 mt-10 -66.88 -51.77 51.45 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.437 177.511 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . 0.414 ' O ' ' HB3' ' A' ' 989' ' ' LYS . 68.5 mtt -70.79 -42.08 70.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 114.64 -1.163 . . . . 0.0 111.468 -175.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 1.053 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -69.4 -51.64 34.61 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.457 -0.792 . . . . 0.0 112.225 -170.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.848 HE22 ' HB2' ' A' ' 970' ' ' ASP . 3.7 pt20 -62.87 -21.82 66.26 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.375 177.661 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . 0.765 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 12.0 ttmt -70.29 -42.36 72.14 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.565 171.34 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 2.6 mp -55.35 -53.9 50.42 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.874 HD22 HD13 ' A' ' 962' ' ' LEU . 2.3 tt -67.88 -25.7 65.65 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 178.5 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . 0.765 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 25.3 t-20 -53.17 -56.74 14.0 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.29 178.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 3.8 p -79.14 -34.07 43.61 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -177.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.07 -41.99 97.13 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.335 -0.546 . . . . 0.0 111.407 178.301 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 0.63 ' N ' HD21 ' A' 1028 ' ' LEU . 2.3 tm? -64.03 -23.88 67.5 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 122.576 0.35 . . . . 0.0 110.184 173.16 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -70.91 -32.74 69.77 Favored 'General case' 0 C--N 1.313 -0.994 0 C-N-CA 119.274 -0.971 . . . . 0.0 110.835 169.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.518 ' O ' ' HG2' ' A' 1001 ' ' LYS . 74.1 mm-40 -76.29 -38.09 56.59 Favored 'General case' 0 CA--C 1.512 -0.505 0 O-C-N 121.858 -0.526 . . . . 0.0 110.1 177.279 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.636 HD21 ' SD ' ' A' 1021 ' ' MET . 1.1 tm? -56.24 -47.13 79.09 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.339 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.613 ' O ' ' HB2' ' A' 1003 ' ' LYS . 72.7 mt -65.71 -31.82 55.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.728 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -62.67 -38.82 91.85 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.872 0.368 . . . . 0.0 111.676 176.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.518 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 54.8 mmtt -77.5 -43.02 33.51 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 122.529 1.157 . . . . 0.0 108.46 -177.519 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.992 ' HG3' ' HB3' ' A' ' 951' ' ' TYR . 12.0 tpp -57.8 -29.96 65.32 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 113.482 -1.69 . . . . 0.0 109.2 177.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.613 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 15.7 tptt -73.28 -55.11 6.86 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 114.162 -1.381 . . . . 0.0 111.037 -167.155 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.855 ' HB3' HD23 ' A' 1013 ' ' LEU . 3.9 mm? -71.4 -13.66 61.92 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.32 -178.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.744 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -69.86 -45.22 68.23 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 119.366 -0.933 . . . . 0.0 109.477 179.705 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.942 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 3.4 pp0? -75.75 -26.73 57.67 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 120.071 -0.652 . . . . 0.0 111.718 172.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.691 ' HG3' HD13 ' A' 1004 ' ' LEU . 21.9 mm-40 -52.0 -54.61 27.79 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.152 0.501 . . . . 0.0 110.581 174.271 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.806 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 72.1 m-85 -114.98 41.15 2.46 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.229 -0.588 . . . . 0.0 109.96 173.573 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 1.053 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 14.7 p -49.41 -22.16 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.603 172.389 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 20.6 mmt -30.96 -57.13 0.22 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.202 173.096 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1011 ' ' THR . . . . . . . . . . . . . 97.9 m -164.98 -72.32 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 O-C-N 123.122 0.263 . . . . 0.0 111.646 173.034 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 32.5 t -50.8 -74.92 0.03 OUTLIER 'General case' 0 C--O 1.24 0.595 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.8 -169.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1013 ' ' LEU . . . . . 0.855 HD23 ' HB3' ' A' 1004 ' ' LEU . 7.6 mp -50.46 -39.08 46.89 Favored 'General case' 0 CA--C 1.504 -0.812 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -178.235 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 1.053 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.62 -49.25 70.94 Favored 'General case' 0 N--CA 1.442 -0.838 0 O-C-N 123.505 0.503 . . . . 0.0 111.465 -168.186 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.429 ' O ' ' HD3' ' A' 1019 ' ' LYS . 12.1 pt20 -74.67 -38.8 62.33 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.607 -176.466 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 53.5 tt0 -66.75 -53.75 30.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.583 0.706 . . . . 0.0 110.592 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.744 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 5.9 m-85 -65.67 -34.32 77.94 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.73 -1.123 . . . . 0.0 113.651 -174.177 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.515 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 51.4 tptt -80.32 -29.19 38.06 Favored 'General case' 0 N--CA 1.461 0.102 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.199 -177.7 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . 0.429 ' HD3' ' O ' ' A' 1015 ' ' GLN . 3.4 mptp? -72.52 -50.73 23.77 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 173.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -54.4 -31.84 55.87 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.086 166.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.636 ' SD ' HD21 ' A' ' 998' ' ' LEU . 10.9 tmm? -65.51 -52.32 53.53 Favored 'General case' 0 C--O 1.217 -0.651 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 174.092 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' 1022 ' ' LEU . 0.0 OUTLIER -74.08 -12.17 60.53 Favored 'General case' 0 C--O 1.218 -0.591 0 C-N-CA 119.258 -0.977 . . . . 0.0 109.806 -176.762 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 92.5 m -82.21 -41.86 19.74 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.205 175.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.548 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.12 -22.04 49.44 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-O 120.972 0.415 . . . . 0.0 109.937 174.134 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.751 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -84.7 -22.05 29.91 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.929 169.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.515 ' O ' HG23 ' A' 1030 ' ' VAL . 47.6 t60 -76.55 -25.62 54.26 Favored 'General case' 0 C--O 1.213 -0.854 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 164.587 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . 0.452 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -69.52 -41.4 76.07 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 122.746 0.419 . . . . 0.0 110.168 163.59 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.63 HD21 ' N ' ' A' ' 995' ' ' LEU . 21.0 mt -60.33 -46.56 89.46 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 170.921 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . 0.426 ' HA ' HG22 ' A' ' 933' ' ' VAL . . . -57.57 -43.04 84.22 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 123.192 0.308 . . . . 0.0 111.456 173.306 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.515 HG23 ' O ' ' A' 1026 ' ' HIS . 4.9 t -66.55 -50.74 64.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-O 120.916 0.389 . . . . 0.0 110.47 -176.663 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.69 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 14.0 m-20 -75.02 -29.1 60.72 Favored 'General case' 0 C--O 1.212 -0.871 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.212 -176.475 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.672 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -58.97 -45.82 89.58 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 168.438 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 56.1 tttm -65.29 -41.98 93.57 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.768 0.794 . . . . 0.0 109.877 175.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.69 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 38.9 t30 -70.5 -53.76 14.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.002 -1.454 . . . . 0.0 112.09 -172.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 1.053 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 2.5 pp -62.79 -38.57 91.19 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 119.332 -0.366 . . . . 0.0 110.599 -174.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.627 HD22 HG23 ' A' ' 925' ' ' VAL . 4.3 pp -71.43 -36.4 71.27 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 116.933 -1.907 . . . . 0.0 109.734 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.61 ' N ' HD12 ' A' 1036 ' ' LEU . 11.5 t70 -57.92 -39.76 78.77 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.749 174.291 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.54 ' HB ' ' O ' ' A' 1035 ' ' LEU . 13.1 t -55.86 -33.49 34.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 114.124 -1.398 . . . . 0.0 111.578 173.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.592 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 1.9 mp -86.44 -33.94 7.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 117.944 0.338 . . . . 0.0 111.486 175.19 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.467 ' O ' ' HG3' ' A' 1043 ' ' ARG . 1.0 OUTLIER -53.18 -49.45 66.64 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 166.424 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -69.2 -39.92 78.35 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.371 -0.832 . . . . 0.0 111.205 175.223 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.592 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -54.63 -49.28 70.89 Favored 'General case' 0 CA--C 1.497 -1.081 0 C-N-CA 122.932 0.493 . . . . 0.0 111.782 -175.637 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.548 ' HD3' ' N ' ' A' 1044 ' ' LEU . 0.0 OUTLIER -63.68 -38.52 91.42 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.818 -178.319 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . 0.548 ' N ' ' HD3' ' A' 1043 ' ' ARG . 56.4 tp . . . . . 0 N--CA 1.448 -0.527 0 CA-C-O 121.768 0.794 . . . . 0.0 109.566 178.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.766 ' HB3' HG21 ' A' ' 968' ' ' THR . 16.8 tppt? . . . . . 0 C--O 1.225 -0.222 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.525 ' O ' HG23 ' A' ' 929' ' ' VAL . 29.0 m -61.7 -29.8 46.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-O 121.079 0.466 . . . . 0.0 110.304 177.291 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -78.2 -26.28 47.46 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 176.356 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -76.02 -25.7 55.95 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.035 174.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.571 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 5.1 m120 -77.29 -29.84 53.94 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 121.663 0.744 . . . . 0.0 109.032 173.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.593 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 81.8 t -76.68 -29.48 18.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.329 174.642 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . 0.439 ' O ' ' HB3' ' A' ' 934' ' ' LYS . 36.1 m -60.49 -39.98 89.64 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 170.217 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -72.32 -53.25 9.11 Favored Glycine 0 CA--C 1.524 0.629 0 CA-C-N 115.103 -0.953 . . . . 0.0 113.708 178.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.593 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.8 pp -65.05 -47.61 76.76 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -175.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . 0.433 HG23 HG13 ' A' ' 929' ' ' VAL . 73.6 t -63.25 -42.9 98.12 Favored 'Isoleucine or valine' 0 C--O 1.24 0.582 0 CA-C-O 121.407 0.622 . . . . 0.0 110.52 -177.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.759 ' O ' ' HB2' ' A' ' 938' ' ' GLU . 16.0 ttpt -60.51 -40.22 90.62 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.655 178.449 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -58.59 -46.59 86.63 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.499 -0.48 . . . . 0.0 111.083 175.174 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.818 HG22 ' HB1' ' A' 1025 ' ' ALA . 57.8 t -45.05 -83.65 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 123.274 0.63 . . . . 0.0 112.386 -179.075 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 19.4 pt -64.6 -43.41 96.73 Favored 'Isoleucine or valine' 0 C--O 1.248 0.997 0 N-CA-C 112.316 0.488 . . . . 0.0 112.316 -173.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.759 ' HB2' ' O ' ' A' ' 934' ' ' LYS . 6.2 mm-40 -67.84 -51.29 50.17 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.855 -169.576 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . 0.53 ' HB3' ' HE1' ' A' ' 954' ' ' MET . 30.8 ttm -72.78 -27.81 62.22 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 120.093 -0.643 . . . . 0.0 109.686 -175.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . . . . . . . . . 2.8 m . . . . . 0 C--N 1.346 0.441 0 O-C-N 123.97 0.793 . . . . 0.0 112.501 -174.057 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.904 ' HB3' ' HG3' ' A' 1002 ' ' MET . 20.6 m-30 . . . . . 0 N--CA 1.479 1.022 0 N-CA-C 115.789 1.774 . . . . 0.0 115.789 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 0.507 ' O ' ' HB ' ' A' ' 955' ' ' VAL . 45.4 t -54.79 -40.6 84.9 Favored Pre-proline 0 C--N 1.32 -0.688 0 O-C-N 122.076 -0.39 . . . . 0.0 111.019 168.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 0.745 ' HA ' ' HD2' ' A' ' 956' ' ' LYS . 8.2 Cg_exo -44.57 -51.32 7.25 Favored 'Trans proline' 0 C--N 1.357 0.985 0 C-N-CA 122.468 2.112 . . . . 0.0 112.836 170.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.53 ' HE1' ' HB3' ' A' ' 939' ' ' MET . 0.4 OUTLIER -62.66 -41.76 99.24 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.884 172.144 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.507 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 54.9 t -52.4 -36.88 22.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.886 176.342 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . 0.745 ' HD2' ' HA ' ' A' ' 953' ' ' PRO . 59.6 mttt -66.12 -41.89 89.92 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 111.599 0.222 . . . . 0.0 111.599 173.15 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -77.32 -44.82 28.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.754 0.311 . . . . 0.0 111.356 -172.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.54 ' O ' ' HG ' ' A' ' 962' ' ' LEU . 14.4 p -75.1 -34.47 31.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 176.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -64.44 -43.72 96.32 Favored Glycine 0 N--CA 1.448 -0.56 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 177.266 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . 0.565 HD12 ' HD2' ' A' ' 963' ' ' ARG . 16.3 tp -63.14 -38.47 91.31 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.925 -0.137 . . . . 0.0 110.678 175.23 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -69.84 -60.02 2.57 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 120.898 0.38 . . . . 0.0 111.012 -177.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.857 HD13 HD22 ' A' ' 995' ' ' LEU . 4.1 pp -56.54 -29.66 62.19 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 173.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.565 ' HD2' HD12 ' A' ' 960' ' ' LEU . 9.9 ptp180 -73.77 -36.39 65.08 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 120.195 1.361 . . . . 0.0 110.637 172.027 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 32.2 m -62.72 -33.52 75.29 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 174.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.571 ' HA ' ' OD1' ' A' ' 928' ' ' ASN . 25.8 tp -61.65 -54.35 44.0 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.487 174.132 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.767 ' HG ' ' NE2' ' A' ' 988' ' ' GLN . 8.0 tt -54.95 -41.04 70.6 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.185 -1.37 . . . . 0.0 109.38 178.826 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -68.8 -35.07 76.57 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.034 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.766 HG21 ' HB3' ' A' ' 924' ' ' LYS . 23.2 m -73.17 -39.21 65.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 118.809 0.731 . . . . 0.0 110.675 177.305 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.773 HG12 HG23 ' A' ' 984' ' ' ILE . 27.1 t -67.31 -36.67 77.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 CA-C-O 120.726 0.298 . . . . 0.0 110.519 173.255 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.422 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 20.4 t70 -68.63 -42.37 78.14 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 179.217 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.664 ' O ' HG23 ' A' ' 975' ' ' VAL . 31.7 tp10 -68.34 -24.8 64.86 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 113.857 -1.52 . . . . 0.0 109.69 179.738 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 58.8 m -73.54 -17.59 61.19 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.366 177.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.687 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 35.0 tp -67.72 -52.81 24.25 Favored Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 119.741 -0.783 . . . . 0.0 110.284 172.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.687 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 19.2 Cg_exo -70.14 -11.31 30.1 Favored 'Trans proline' 0 C--N 1.358 1.041 0 C-N-CA 121.404 1.403 . . . . 0.0 113.502 172.905 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.664 HG23 ' O ' ' A' ' 971' ' ' GLU . 38.8 t . . . . . 0 N--CA 1.466 0.356 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 173.228 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.687 ' OG1' ' HB1' ' A' 1042 ' ' ALA . 6.0 t . . . . . 0 N--CA 1.455 -0.18 0 N-CA-C 110.856 -0.053 . . . . 0.0 110.856 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.495 ' O ' ' HG2' ' A' ' 985' ' ' GLU . 1.9 p80 -49.69 -49.14 48.82 Favored 'General case' 0 C--O 1.208 -1.101 0 O-C-N 123.224 0.327 . . . . 0.0 110.984 -177.675 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.65 -21.42 3.95 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 179.426 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.68 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 0.3 OUTLIER -80.08 -49.53 11.63 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 118.747 0.703 . . . . 0.0 111.45 171.071 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.773 HG23 HG12 ' A' ' 969' ' ' VAL . 2.9 mp -63.52 -30.94 51.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 178.174 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 981' ' ' HIS . 70.4 mm-40 -58.9 -46.17 88.52 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.083 175.718 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 24.6 mmt -73.13 -42.74 62.56 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.205 -176.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 0.814 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -65.65 -49.32 69.09 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 114.713 -1.131 . . . . 0.0 111.971 -176.384 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.784 ' O ' ' HB2' ' A' ' 992' ' ' ASN . 12.8 mm100 -56.02 -40.81 73.98 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.035 177.533 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . 0.592 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 0.0 OUTLIER -72.35 -39.2 68.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.297 -178.784 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.605 HD23 ' HB3' ' A' 1035 ' ' LEU . 26.7 tp -55.0 -59.12 5.18 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.921 179.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.619 ' HB3' ' CD2' ' A' 1035 ' ' LEU . 3.2 pp -63.08 -31.62 72.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.868 0.842 . . . . 0.0 109.741 179.007 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . 0.784 ' HB2' ' O ' ' A' ' 988' ' ' GLN . 20.6 t-20 -53.58 -57.33 11.13 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 113.564 -1.653 . . . . 0.0 112.747 -174.589 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 25.0 m -79.71 -25.34 41.2 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 -177.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -72.58 -38.03 68.01 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 119.346 -0.941 . . . . 0.0 111.404 177.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 0.857 HD22 HD13 ' A' ' 962' ' ' LEU . 0.5 OUTLIER -66.91 -24.25 66.07 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.132 171.033 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -78.19 -26.3 47.52 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 119.47 -0.892 . . . . 0.0 109.708 172.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . 0.53 ' O ' ' HG2' ' A' 1001 ' ' LYS . 6.8 tp10 -74.41 -42.69 58.79 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 173.636 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.761 HD22 HD11 ' A' 1028 ' ' LEU . 0.0 OUTLIER -56.99 -47.25 81.27 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.649 -178.89 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.644 ' O ' ' HB2' ' A' 1003 ' ' LYS . 82.6 mt -66.64 -39.26 83.38 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.332 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.246 -174.532 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 21.2 m-80 -62.18 -36.75 82.84 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.072 0.463 . . . . 0.0 111.633 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.53 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 72.3 mmtt -78.28 -40.61 36.41 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 122.133 0.968 . . . . 0.0 109.422 -177.42 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.904 ' HG3' ' HB3' ' A' ' 951' ' ' TYR . 5.0 tpt -63.86 -27.32 69.08 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.28 -1.327 . . . . 0.0 109.049 178.168 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.644 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 12.4 tptp -73.28 -53.09 11.71 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.031 -1.44 . . . . 0.0 110.506 -167.4 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.588 ' O ' HD23 ' A' 1013 ' ' LEU . 7.2 mp -77.4 -12.03 59.91 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.142 179.545 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.748 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -67.56 -40.74 84.93 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 119.526 -0.87 . . . . 0.0 109.526 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.76 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.3 pp0? -75.04 -32.72 61.63 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 119.115 -0.469 . . . . 0.0 111.69 169.56 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.57 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 10.6 mm-40 -46.37 -49.51 17.76 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.04 0.447 . . . . 0.0 110.588 175.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.904 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 49.7 m-85 -126.86 48.3 2.2 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 119.844 -0.743 . . . . 0.0 110.542 171.246 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 0.954 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 11.9 p -50.94 -21.54 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.593 167.711 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1010 ' ' MET . . . . . . . . . . . . . 87.8 mtp -37.9 -49.35 1.22 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.161 -1.382 . . . . 0.0 111.574 172.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1011 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -171.76 -81.8 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 177.338 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1012 ' ' SER . . . . . . . . . . . . . 2.5 m -49.89 -71.46 0.06 Allowed 'General case' 0 C--O 1.246 0.911 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.829 -168.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1013 ' ' LEU . . . . . 0.904 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 4.8 mp -46.56 -42.82 16.45 Favored 'General case' 0 CA--C 1.498 -1.047 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 179.539 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 0.954 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.82 -58.01 9.26 Favored 'General case' 0 N--CA 1.438 -1.048 0 C-N-CA 119.827 -0.749 . . . . 0.0 110.769 -166.833 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.622 ' O ' ' HB3' ' A' 1019 ' ' LYS . 40.3 mt-30 -67.83 -34.79 77.42 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.02 -169.452 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . 0.468 ' OE2' ' HE3' ' A' 1019 ' ' LYS . 18.4 tp10 -73.96 -41.64 61.68 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.307 -0.557 . . . . 0.0 111.142 177.517 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.748 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 6.1 m-85 -75.14 -34.4 61.64 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.93 0.871 . . . . 0.0 111.834 -173.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.517 ' HB2' ' NE2' ' A' 1014 ' ' GLN . 13.7 tptm -79.79 -40.86 27.7 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 113.414 -1.721 . . . . 0.0 110.825 -175.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . 0.622 ' HB3' ' O ' ' A' 1015 ' ' GLN . 0.0 OUTLIER -71.38 -35.19 71.0 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -179.58 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . 0.599 ' N ' ' HD3' ' A' 1019 ' ' LYS . 9.4 tt0 -69.99 -30.25 67.53 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.098 -1.41 . . . . 0.0 110.49 167.328 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.759 ' HG3' ' SD ' ' A' 1002 ' ' MET . 14.8 tmm? -69.02 -54.03 17.32 Favored 'General case' 0 CA--C 1.507 -0.702 0 C-N-CA 120.977 -0.289 . . . . 0.0 111.034 -179.616 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . 0.676 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.2 OUTLIER -83.63 -2.72 56.72 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 119.485 -0.886 . . . . 0.0 109.462 -172.43 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 46.1 m -86.11 -34.09 20.73 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 168.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.53 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -79.09 -22.6 45.0 Favored 'General case' 0 C--O 1.221 -0.425 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 173.015 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.818 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -85.9 -26.56 25.52 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.005 169.567 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.525 ' O ' HG23 ' A' 1030 ' ' VAL . 12.9 t60 -70.86 -30.7 67.17 Favored 'General case' 0 C--O 1.215 -0.762 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 165.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . 0.53 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -64.91 -42.46 94.71 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 123.975 0.91 . . . . 0.0 110.755 163.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.761 HD11 HD22 ' A' ' 998' ' ' LEU . 30.2 mt -58.13 -46.69 85.18 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 119.923 -0.711 . . . . 0.0 109.472 171.507 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . 0.426 ' CB ' HG22 ' A' ' 933' ' ' VAL . . . -59.09 -43.51 91.83 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 173.565 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.581 ' O ' ' HB3' ' A' 1033 ' ' LYS . 12.2 t -68.01 -51.23 51.4 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.211 0 CA-C-O 121.675 0.75 . . . . 0.0 110.863 -176.54 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.4 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 21.3 m-20 -76.76 -29.5 56.14 Favored 'General case' 0 C--O 1.214 -0.814 0 CA-C-N 115.056 -0.974 . . . . 0.0 112.158 -175.114 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.625 ' HA ' ' CD2' ' A' 1035 ' ' LEU . . . -71.28 -27.67 63.59 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.509 -0.476 . . . . 0.0 109.741 171.413 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.581 ' HB3' ' O ' ' A' 1030 ' ' VAL . 84.9 tttt -65.54 -45.92 81.57 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 122.091 0.948 . . . . 0.0 109.22 168.287 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.609 ' O ' ' HB3' ' A' 1037 ' ' ASP . 56.4 t30 -70.87 -46.61 62.32 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 113.967 -1.469 . . . . 0.0 112.599 -176.026 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 0.814 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 4.0 pp -63.9 -36.38 83.76 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 122.156 -0.34 . . . . 0.0 110.627 -177.128 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.463 HD12 ' N ' ' A' 1037 ' ' ASP . 4.7 pp -72.36 -35.87 68.62 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 117.282 -1.767 . . . . 0.0 109.745 178.173 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.696 ' HA ' ' OD2' ' A' 1040 ' ' ASP . 19.3 t70 -54.88 -30.93 59.18 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 122.999 1.38 . . . . 0.0 110.585 168.716 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.534 ' HB ' ' O ' ' A' 1035 ' ' LEU . 14.3 t -73.57 -36.96 48.94 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.54 177.479 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.708 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 2.0 mp -79.31 -26.05 12.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 C-N-CA 121.123 -0.231 . . . . 0.0 111.573 172.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . 0.696 ' OD2' ' HA ' ' A' 1037 ' ' ASP . 0.2 OUTLIER -59.93 -44.69 94.19 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 171.48 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . 0.408 ' N ' ' OD1' ' A' 1040 ' ' ASP . 12.4 mt-30 -76.55 -31.22 57.45 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.718 174.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.708 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -56.29 -55.97 26.84 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 120.973 0.416 . . . . 0.0 111.818 -179.275 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.569 ' HG2' ' O ' ' A' 1039 ' ' ILE . 11.8 ptm180 -65.73 -34.52 78.38 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.535 -176.045 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 49.5 tp . . . . . 0 C--O 1.216 -0.707 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.772 171.705 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 924' ' ' LYS . . . . . 0.526 ' HB3' HG21 ' A' ' 968' ' ' THR . 31.0 mmtp . . . . . 0 N--CA 1.468 0.468 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 925' ' ' VAL . . . . . 0.583 ' O ' HG23 ' A' ' 929' ' ' VAL . 35.0 m -56.94 -34.95 45.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.116 0.484 . . . . 0.0 110.641 177.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 926' ' ' TYR . . . . . 0.494 ' CZ ' ' HG3' ' A' ' 927' ' ' GLU . 0.1 OUTLIER -74.08 -37.28 64.25 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.405 174.952 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 927' ' ' GLU . . . . . 0.494 ' HG3' ' CZ ' ' A' ' 926' ' ' TYR 0.257 1.9 tt0 -78.38 -23.78 46.65 Favored 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 118.399 -1.32 . . . . 0.0 113.758 -177.334 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 928' ' ' ASN . . . . . 0.445 ' ND2' HG22 ' A' ' 964' ' ' THR . 87.1 m-20 -72.2 -27.77 62.77 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.22 0.533 . . . . 0.0 110.097 169.504 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 929' ' ' VAL . . . . . 0.588 HG22 ' HB1' ' A' 1032 ' ' ALA . 98.7 t -77.0 -29.38 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.953 171.776 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 930' ' ' THR . . . . . . . . . . . . . 25.7 m -61.48 -40.38 94.33 Favored 'General case' 0 C--N 1.311 -1.088 0 C-N-CA 119.507 -0.877 . . . . 0.0 108.898 171.121 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -71.57 -53.05 10.53 Favored Glycine 0 CA--C 1.527 0.786 0 CA-C-N 115.172 -0.922 . . . . 0.0 113.689 176.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 932' ' ' LEU . . . . . 0.565 ' CD2' ' HA ' ' A' ' 929' ' ' VAL . 1.8 pp -61.73 -46.67 88.65 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.94 0.718 . . . . 0.0 112.94 -176.19 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 73.5 t -68.99 -39.24 79.49 Favored 'Isoleucine or valine' 0 C--O 1.241 0.605 0 CA-C-O 121.154 0.502 . . . . 0.0 110.906 -176.039 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 934' ' ' LYS . . . . . 0.471 ' HD3' ' HG3' ' A' ' 938' ' ' GLU . 5.2 tppp? -55.63 -44.11 76.8 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.679 -178.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -60.13 -45.19 93.86 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.462 177.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 936' ' ' VAL . . . . . 0.693 HG22 ' HB1' ' A' 1025 ' ' ALA . 85.4 t -45.17 -74.32 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 123.6 0.76 . . . . 0.0 112.879 -176.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 937' ' ' ILE . . . . . 0.511 HG22 HD12 ' A' 1022 ' ' LEU . 14.5 pt -77.32 -42.53 30.76 Favored 'Isoleucine or valine' 0 C--O 1.245 0.849 0 CA-C-N 115.927 -0.579 . . . . 0.0 112.546 -174.171 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 938' ' ' GLU . . . . . 0.471 ' HG3' ' HD3' ' A' ' 934' ' ' LYS . 35.4 mm-40 -66.65 -43.41 84.69 Favored 'General case' 0 C--N 1.316 -0.867 0 C-N-CA 120.53 -0.468 . . . . 0.0 111.105 -173.059 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 11.1 ttp -75.59 -27.28 58.48 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 119.225 -0.99 . . . . 0.0 110.615 176.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 940' ' ' SER . . . . . 0.655 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 32.5 t . . . . . 0 C--O 1.236 0.393 0 O-C-N 123.8 0.687 . . . . 0.0 112.101 -170.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 951' ' ' TYR . . . . . 0.552 ' CD1' ' N ' ' A' ' 951' ' ' TYR . 0.4 OUTLIER . . . . . 0 C--O 1.216 -0.699 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 952' ' ' VAL . . . . . 1.005 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -59.85 -42.69 92.24 Favored Pre-proline 0 CA--C 1.542 0.665 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.41 172.342 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 953' ' ' PRO . . . . . 1.005 ' HD3' HG13 ' A' ' 952' ' ' VAL . 87.1 Cg_exo -55.21 -38.76 93.43 Favored 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 121.212 1.274 . . . . 0.0 111.735 167.572 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 954' ' ' MET . . . . . 0.46 ' O ' HG22 ' A' ' 958' ' ' VAL . 4.0 ttm -66.38 -30.56 70.97 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.874 176.082 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 955' ' ' VAL . . . . . 0.648 HG23 ' HA ' ' A' ' 952' ' ' VAL . 69.4 t -53.53 -42.99 51.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 174.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.41 -36.0 80.4 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.464 175.29 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -78.46 -45.93 20.96 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 111.911 0.338 . . . . 0.0 111.911 -174.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 958' ' ' VAL . . . . . 0.685 ' O ' ' HG ' ' A' ' 962' ' ' LEU . 17.7 m -81.63 -34.7 13.15 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.663 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -60.13 -35.59 88.11 Favored Glycine 0 N--CA 1.437 -1.241 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 178.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 960' ' ' LEU . . . . . 0.56 HD12 ' HD3' ' A' ' 963' ' ' ARG . 19.5 tp -76.77 -36.57 56.94 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-O 120.697 0.284 . . . . 0.0 110.682 176.219 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -72.11 -44.21 63.54 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.097 0.475 . . . . 0.0 111.93 -173.11 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 962' ' ' LEU . . . . . 0.89 HD11 ' HG ' ' A' ' 995' ' ' LEU . 4.6 pp -87.16 -18.09 31.21 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.843 -177.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 963' ' ' ARG . . . . . 0.56 ' HD3' HD12 ' A' ' 960' ' ' LEU . 12.0 ptm180 -72.79 -38.01 67.38 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 118.834 -1.147 . . . . 0.0 110.119 165.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 964' ' ' THR . . . . . 0.498 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 23.9 m -65.62 -31.27 72.2 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.171 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 965' ' ' LEU . . . . . 0.701 HD23 ' HG ' ' A' ' 991' ' ' LEU . 17.7 tp -62.6 -50.16 72.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.089 171.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 966' ' ' LEU . . . . . 0.789 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 9.8 tt -64.21 -36.37 83.84 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.08 -0.963 . . . . 0.0 108.489 -174.696 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 967' ' ' ALA . . . . . 0.426 ' HA ' ' HB3' ' A' ' 970' ' ' ASP . . . -71.87 -39.19 69.8 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.925 178.496 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 968' ' ' THR . . . . . 0.526 HG21 ' HB3' ' A' ' 924' ' ' LYS . 2.2 p -61.48 -35.81 78.7 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 118.945 0.793 . . . . 0.0 110.212 174.049 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 969' ' ' VAL . . . . . 0.909 HG12 HG23 ' A' ' 984' ' ' ILE . 49.1 t -74.43 -36.61 42.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.208 174.168 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 970' ' ' ASP . . . . . 0.697 ' HB2' HE22 ' A' ' 988' ' ' GLN . 17.3 t70 -70.13 -42.04 73.14 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 122.04 0.924 . . . . 0.0 109.201 -178.629 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 971' ' ' GLU . . . . . 0.603 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 7.9 tp10 -67.2 -31.18 71.38 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.258 -1.337 . . . . 0.0 109.904 176.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 972' ' ' SER . . . . . 0.479 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 46.9 m -68.38 -18.04 64.37 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.939 174.642 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 973' ' ' LEU . . . . . 0.907 ' HG ' ' HB2' ' A' ' 981' ' ' HIS . 10.4 tt -66.74 -51.67 38.13 Favored Pre-proline 0 CA--C 1.53 0.194 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 -177.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 974' ' ' PRO . . . . . 0.745 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 5.0 Cg_exo -79.61 -4.77 13.75 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 121.388 1.392 . . . . 0.0 113.004 172.322 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 975' ' ' VAL . . . . . 0.586 HG23 ' O ' ' A' ' 971' ' ' GLU . 40.1 t . . . . . 0 C--N 1.329 -0.287 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.125 171.608 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 980' ' ' THR . . . . . 0.509 HG23 ' CB ' ' A' 1042 ' ' ALA . 54.4 m . . . . . 0 CA--C 1.535 0.386 0 CA-C-O 120.661 0.267 . . . . 0.0 111.144 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 981' ' ' HIS . . . . . 0.907 ' HB2' ' HG ' ' A' ' 973' ' ' LEU . 0.3 OUTLIER -69.0 -18.4 64.05 Favored 'General case' 0 C--O 1.218 -0.554 0 O-C-N 121.934 -0.479 . . . . 0.0 112.187 -174.653 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -83.2 -21.65 33.39 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 119.849 -0.74 . . . . 0.0 110.87 177.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 983' ' ' GLU . . . . . 0.545 ' CB ' ' HB2' ' A' 1042 ' ' ALA . 3.0 mp0 -76.15 -33.51 59.38 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 165.046 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 984' ' ' ILE . . . . . 0.909 HG23 HG12 ' A' ' 969' ' ' VAL . 69.6 mt -68.36 -30.39 47.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.569 178.326 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 985' ' ' GLU . . . . . 0.636 ' HG2' ' O ' ' A' ' 981' ' ' HIS . 72.5 mm-40 -62.45 -53.16 58.88 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.269 176.054 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 20.5 ttt -69.82 -39.98 76.16 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.831 -172.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 987' ' ' ALA . . . . . 1.065 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -76.44 -53.41 8.17 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.099 -1.409 . . . . 0.0 112.624 -167.638 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 988' ' ' GLN . . . . . 0.789 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 3.2 pt20 -65.04 -21.77 66.88 Favored 'General case' 0 C--O 1.226 -0.167 0 C-N-CA 120.126 -0.629 . . . . 0.0 109.592 178.464 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 989' ' ' LYS . . . . . 0.59 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 34.0 tttp -73.3 -43.26 61.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.124 -0.944 . . . . 0.0 112.178 173.78 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 990' ' ' LEU . . . . . 0.595 ' O ' ' HB2' ' A' ' 994' ' ' ASP . 16.0 mt -52.54 -53.73 42.22 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.235 174.34 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 991' ' ' LEU . . . . . 0.707 HD11 ' HB2' ' A' ' 962' ' ' LEU . 0.4 OUTLIER -59.82 -39.54 85.41 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 175.946 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 992' ' ' ASN . . . . . 0.59 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 40.9 t-20 -52.88 -57.29 10.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.006 -0.997 . . . . 0.0 111.565 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 26.6 p -80.05 -31.24 39.5 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.211 0.448 . . . . 0.0 112.211 -178.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 994' ' ' ASP . . . . . 0.595 ' HB2' ' O ' ' A' ' 990' ' ' LEU . 0.1 OUTLIER -65.91 -42.07 90.62 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 120.272 -0.571 . . . . 0.0 110.87 178.72 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 995' ' ' LEU . . . . . 0.89 ' HG ' HD11 ' A' ' 962' ' ' LEU . 1.8 tm? -59.42 -32.86 70.57 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.486 0.715 . . . . 0.0 110.691 168.108 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -67.77 -28.34 67.53 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 118.8 -1.16 . . . . 0.0 110.28 174.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -75.26 -43.11 53.22 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 120.638 0.256 . . . . 0.0 110.337 175.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 998' ' ' LEU . . . . . 0.889 HD13 ' HB2' ' A' 1025 ' ' ALA . 8.3 tp -55.8 -47.55 76.94 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.168 0.509 . . . . 0.0 110.998 -179.059 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 999' ' ' ILE . . . . . 0.536 ' O ' ' HB2' ' A' 1003 ' ' LYS . 39.9 mm -68.12 -34.1 64.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 115.296 -0.866 . . . . 0.0 111.738 -172.099 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -63.05 -38.62 91.91 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.179 0.514 . . . . 0.0 111.618 179.095 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1001 ' ' LYS . . . . . 0.517 ' HA ' ' HD1' ' A' 1017 ' ' TYR . 14.3 mptt -83.63 -36.74 23.62 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.826 0.822 . . . . 0.0 109.402 -176.121 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1002 ' ' MET . . . . . 0.465 ' HB2' ' HG2' ' A' 1021 ' ' MET . 46.3 ttm -59.87 -30.81 69.24 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 114.349 -1.296 . . . . 0.0 109.684 174.079 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1003 ' ' LYS . . . . . 0.619 ' O ' ' HG3' ' A' 1006 ' ' GLN . 4.6 tptp -74.24 -53.54 9.56 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 114.694 -1.139 . . . . 0.0 111.699 -170.595 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1004 ' ' LEU . . . . . 0.882 HD23 ' HG3' ' A' 1007 ' ' GLN . 86.4 mt -72.48 -13.69 61.49 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.461 -179.459 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1005 ' ' ALA . . . . . 0.661 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -70.36 -42.48 71.75 Favored 'General case' 0 C--O 1.216 -0.692 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 177.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1006 ' ' GLN . . . . . 0.901 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 5.1 pp0? -75.86 -31.73 59.42 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 119.034 -0.508 . . . . 0.0 111.938 172.699 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1007 ' ' GLN . . . . . 0.882 ' HG3' HD23 ' A' 1004 ' ' LEU . 13.2 mm100 -48.36 -51.43 26.4 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.265 0.555 . . . . 0.0 110.045 175.491 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1008 ' ' TYR . . . . . 0.762 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 69.6 m-85 -120.74 45.85 2.14 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.368 173.178 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1009 ' ' VAL . . . . . 1.099 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 10.8 p -52.2 -20.54 1.91 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 CA-C-N 114.847 -1.069 . . . . 0.0 110.183 170.14 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1010 ' ' MET . . . . . 0.45 ' O ' ' HB ' ' A' 1011 ' ' THR . 24.3 mmt -38.53 -44.09 0.92 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 113.843 -1.526 . . . . 0.0 111.298 172.69 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1011 ' ' THR . . . . . 0.497 HG23 ' N ' ' A' 1012 ' ' SER . 8.1 t -178.76 -65.16 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 171.619 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1012 ' ' SER . . . . . 0.497 ' N ' HG23 ' A' 1011 ' ' THR . 6.9 m -57.65 -73.85 0.07 Allowed 'General case' 0 C--O 1.242 0.676 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -167.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1013 ' ' LEU . . . . . 0.762 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 7.8 mp -49.89 -37.1 29.88 Favored 'General case' 0 CA--C 1.504 -0.821 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.226 178.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1014 ' ' GLN . . . . . 1.099 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.88 -48.73 72.62 Favored 'General case' 0 N--CA 1.443 -0.815 0 O-C-N 123.633 0.583 . . . . 0.0 111.472 -167.088 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A 1015 ' ' GLN . . . . . 0.642 ' O ' ' HB3' ' A' 1019 ' ' LYS . 3.7 pt20 -76.27 -36.83 58.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.967 -176.102 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -74.11 -40.57 62.59 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.765 0.793 . . . . 0.0 110.836 -176.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1017 ' ' TYR . . . . . 0.661 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 5.3 m-85 -78.31 -37.92 43.59 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 115.441 -0.799 . . . . 0.0 112.7 -176.706 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1018 ' ' LYS . . . . . 0.612 ' HA ' ' CB ' ' A' 1021 ' ' MET . 35.7 ttpt -81.96 -25.52 34.75 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.733 -175.425 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1019 ' ' LYS . . . . . 0.642 ' HB3' ' O ' ' A' 1015 ' ' GLN . 0.0 OUTLIER -73.33 -32.47 64.59 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 174.883 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A 1020 ' ' GLN . . . . . 0.475 ' N ' ' HD3' ' A' 1019 ' ' LYS . 49.1 mt-30 -68.32 -32.89 73.33 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.652 162.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1021 ' ' MET . . . . . 0.612 ' CB ' ' HA ' ' A' 1018 ' ' LYS . 18.2 tmm? -64.9 -53.55 44.83 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 -179.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1022 ' ' LEU . . . . . 0.511 HD12 HG22 ' A' ' 937' ' ' ILE . 0.2 OUTLIER -78.15 -11.83 59.95 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 119.248 -0.981 . . . . 0.0 109.821 -173.069 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A 1023 ' ' THR . . . . . . . . . . . . . 63.0 m -86.57 -33.95 20.06 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.761 175.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1024 ' ' ALA . . . . . 0.484 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -79.32 -23.58 43.39 Favored 'General case' 0 C--O 1.221 -0.432 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 172.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1025 ' ' ALA . . . . . 0.889 ' HB2' HD13 ' A' ' 998' ' ' LEU . . . -86.28 -24.74 25.83 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.619 170.215 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1026 ' ' HIS . . . . . 0.545 ' O ' HG23 ' A' 1030 ' ' VAL . 47.0 t60 -73.37 -28.5 62.07 Favored 'General case' 0 C--O 1.217 -0.644 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 164.287 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1027 ' ' ALA . . . . . 0.484 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -66.19 -40.9 90.76 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 123.586 0.755 . . . . 0.0 110.418 163.419 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1028 ' ' LEU . . . . . 0.766 HD12 HD22 ' A' ' 998' ' ' LEU . 25.4 mt -61.83 -43.72 98.28 Favored 'General case' 0 C--N 1.313 -0.983 0 C-N-CA 119.919 -0.712 . . . . 0.0 109.89 170.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -58.29 -40.85 83.03 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.645 0.26 . . . . 0.0 110.884 171.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1030 ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' 1026 ' ' HIS . 4.7 t -67.27 -52.05 46.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 121.111 0.482 . . . . 0.0 110.742 -176.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1031 ' ' ASP . . . . . 0.654 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 1.4 m-20 -77.43 -27.85 52.36 Favored 'General case' 0 C--O 1.207 -1.144 0 CA-C-N 115.758 -0.656 . . . . 0.0 112.435 -177.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1032 ' ' ALA . . . . . 0.621 ' O ' HD12 ' A' 1036 ' ' LEU . . . -66.76 -32.7 74.16 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 121.769 -0.582 . . . . 0.0 109.438 169.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1033 ' ' LYS . . . . . 0.412 ' HB3' ' O ' ' A' 1030 ' ' VAL . 87.7 tttt -68.51 -39.66 81.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.894 0.854 . . . . 0.0 109.523 170.216 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1034 ' ' ASN . . . . . 0.654 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 36.6 t30 -71.21 -52.69 17.65 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 114.787 -1.097 . . . . 0.0 111.444 -177.267 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1035 ' ' LEU . . . . . 1.065 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 3.7 pp -64.14 -42.2 96.88 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 118.911 -0.566 . . . . 0.0 111.671 -171.29 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1036 ' ' LEU . . . . . 0.671 HD13 ' H ' ' A' 1037 ' ' ASP . 0.0 OUTLIER -71.76 -33.05 68.32 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 116.416 -2.114 . . . . 0.0 109.056 -178.573 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A 1037 ' ' ASP . . . . . 0.671 ' H ' HD13 ' A' 1036 ' ' LEU . 22.0 t70 -57.28 -44.93 84.46 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.073 171.034 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1038 ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' 1034 ' ' ASN . 37.4 t -56.15 -38.29 53.32 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.61 0 CA-C-N 114.193 -1.367 . . . . 0.0 111.812 175.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1039 ' ' ILE . . . . . 0.69 HD11 ' HA ' ' A' ' 984' ' ' ILE . 1.6 mp -80.61 -32.39 13.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 118.451 0.569 . . . . 0.0 111.814 175.332 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1040 ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.19 -38.57 89.59 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.55 0.691 . . . . 0.0 109.859 170.526 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -76.11 -33.13 59.46 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.779 173.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 1042 ' ' ALA . . . . . 0.55 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -55.89 -55.46 32.36 Favored 'General case' 0 CA--C 1.501 -0.94 0 C-N-CA 123.101 0.56 . . . . 0.0 111.984 178.249 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 1043 ' ' ARG . . . . . 0.71 ' HD3' ' N ' ' A' 1044 ' ' LEU . 0.0 OUTLIER -65.03 -34.61 78.84 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 -176.877 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A 1044 ' ' LEU . . . . . 0.71 ' N ' ' HD3' ' A' 1043 ' ' ARG . 30.8 tp . . . . . 0 N--CA 1.435 -1.176 0 CA-C-N 115.05 -0.977 . . . . 0.0 109.054 177.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.818 0 N-CA-C 112.02 -0.432 . . . . 0.0 112.02 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 909' ' ' SER . . . . . 0.424 ' HA ' ' HD3' ' A' ' 910' ' ' PRO . 9.6 t -103.62 118.49 57.36 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 910' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 909' ' ' SER . 28.0 Cg_endo -90.33 127.79 1.43 Allowed 'Trans proline' 0 N--CA 1.454 -0.851 0 C-N-CA 122.997 2.464 . . . . 0.0 112.421 178.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -143.51 24.31 2.17 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.088 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 8.0 tp -70.84 -29.72 38.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.036 0.446 . . . . 0.0 110.866 -179.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 13.2 p -139.99 147.82 41.0 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.61 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 169.46 -71.26 0.14 Allowed Glycine 0 N--CA 1.448 -0.52 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.9 178.37 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 121.37 -153.56 16.66 Favored Glycine 0 N--CA 1.445 -0.734 0 C-N-CA 120.939 -0.648 . . . . 0.0 111.867 -178.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . -86.56 60.87 4.47 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.254 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . 135.01 -148.93 19.76 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.978 -0.629 . . . . 0.0 112.529 178.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . 90.62 -168.9 33.59 Favored Glycine 0 N--CA 1.45 -0.431 0 N-CA-C 111.384 -0.687 . . . . 0.0 111.384 -177.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 919' ' ' ILE . . . . . 0.617 ' HB ' ' HB3' ' A' 1040 ' ' ASP . 2.1 pp -95.09 125.98 47.62 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 CA-C-N 117.039 0.42 . . . . 0.0 109.878 175.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.688 ' HB3' HD11 ' A' 1044 ' ' LEU . 60.7 ttp180 -158.72 109.64 2.1 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -176.264 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . 0.404 ' HB3' ' HD2' ' A' 1043 ' ' ARG . 62.5 p -176.16 -50.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.773 167.354 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 56.74 53.92 7.81 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 122.077 0.941 . . . . 0.0 109.012 -174.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.571 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 18.8 t0 -76.51 -174.41 2.9 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 113.879 -1.51 . . . . 0.0 111.438 -172.267 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.791 ' HB2' HG21 ' A' ' 968' ' ' THR . 33.4 mmtp -52.87 -27.92 20.7 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.711 176.021 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.607 ' O ' HG23 ' A' ' 929' ' ' VAL . 16.6 m -55.38 -31.84 28.15 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.396 0 CA-C-O 121.02 0.438 . . . . 0.0 110.528 175.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.571 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -77.79 -32.76 52.6 Favored 'General case' 0 CA--C 1.501 -0.938 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.585 177.175 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -77.53 -23.94 50.04 Favored 'General case' 0 C--N 1.3 -1.558 0 C-N-CA 118.261 -1.376 . . . . 0.0 112.397 178.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.516 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 2.7 m120 -72.44 -30.19 64.37 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 121.863 0.839 . . . . 0.0 108.848 171.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.651 ' HA ' HD23 ' A' ' 932' ' ' LEU . 90.2 t -79.51 -28.45 13.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 114.666 -1.152 . . . . 0.0 110.362 176.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.602 ' O ' ' HD2' ' A' ' 934' ' ' LYS . 53.2 m -57.47 -49.26 76.84 Favored 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 119.561 -0.856 . . . . 0.0 108.786 170.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -64.11 -51.4 53.33 Favored Glycine 0 CA--C 1.525 0.707 0 CA-C-N 115.355 -0.838 . . . . 0.0 113.459 177.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.651 HD23 ' HA ' ' A' ' 929' ' ' VAL . 0.3 OUTLIER -61.91 -49.02 77.85 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 112.751 0.648 . . . . 0.0 112.751 -175.882 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.47 HG23 HG13 ' A' ' 929' ' ' VAL . 53.0 t -70.17 -38.27 74.26 Favored 'Isoleucine or valine' 0 C--O 1.24 0.576 0 CA-C-O 120.947 0.403 . . . . 0.0 111.446 -174.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.602 ' HD2' ' O ' ' A' ' 930' ' ' THR . 0.2 OUTLIER -58.92 -37.15 76.01 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.492 179.208 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 0.491 ' HA ' ' SD ' ' A' ' 939' ' ' MET . . . -64.03 -42.01 97.22 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.607 -0.269 . . . . 0.0 111.066 177.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.77 HG22 ' HB1' ' A' 1025 ' ' ALA . 99.3 t -47.55 -69.79 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-N 115.961 -0.563 . . . . 0.0 112.065 -178.148 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 26.7 pt -71.95 -39.76 67.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 N-CA-C 112.489 0.551 . . . . 0.0 112.489 -176.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.412 ' O ' ' HG3' ' A' ' 942' ' ' LYS . 41.3 mt-10 -72.52 -52.19 16.76 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 119.722 -0.791 . . . . 0.0 111.37 -173.039 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.529 ' HA ' ' HD2' ' A' ' 942' ' ' LYS . 1.0 OUTLIER -68.59 -24.78 64.63 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.252 -0.579 . . . . 0.0 109.57 -179.065 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.743 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 8.7 p -53.9 -39.47 65.81 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.206 -179.079 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 11.9 m -94.97 -8.76 36.01 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.753 -179.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.529 ' HD2' ' HA ' ' A' ' 939' ' ' MET . 55.0 mttm -81.24 -13.59 58.35 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 175.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.772 HG21 ' HE1' ' A' ' 951' ' ' TYR . 2.0 pp -78.7 -2.59 5.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.117 169.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.737 ' HB3' ' HD3' ' A' ' 945' ' ' PRO . 10.0 tt0 -75.94 -53.74 2.29 Favored Pre-proline 0 CA--C 1.54 0.576 0 O-C-N 122.302 -0.249 . . . . 0.0 111.173 178.498 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.737 ' HD3' ' HB3' ' A' ' 944' ' ' GLN . 36.5 Cg_exo -62.12 -47.61 9.94 Favored 'Trans proline' 0 C--N 1.358 1.07 0 C-N-CA 121.896 1.73 . . . . 0.0 111.571 174.405 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . . . . . . . . . . . -109.38 99.07 35.09 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 176.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.796 ' HB2' ' HD3' ' A' ' 948' ' ' PRO . 54.0 Cg_exo -49.68 -61.49 0.56 Allowed 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 122.932 2.421 . . . . 0.0 113.718 -172.525 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.817 ' HB3' HG11 ' A' 1009 ' ' VAL . 5.6 Cg_endo -88.19 100.56 0.43 Allowed 'Trans proline' 0 N--CA 1.442 -1.547 0 C-N-CA 121.207 1.271 . . . . 0.0 112.298 178.418 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.709 ' HB2' HG22 ' A' ' 943' ' ' ILE . 55.4 tt0 -67.94 -13.53 62.24 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 114.471 -1.241 . . . . 0.0 108.699 168.275 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.516 ' HB2' ' O ' ' A' ' 949' ' ' GLU . 47.2 mt-10 72.2 -9.29 1.03 Allowed 'General case' 0 C--N 1.349 0.544 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.567 -165.431 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.989 ' HB3' ' HG2' ' A' 1002 ' ' MET . 22.4 m-85 52.18 -46.78 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.899 1.679 . . . . 0.0 114.774 178.327 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 0.604 ' O ' ' HB ' ' A' ' 955' ' ' VAL . 45.8 t -50.57 -43.13 79.9 Favored Pre-proline 0 C--N 1.322 -0.63 0 C-N-CA 122.861 0.464 . . . . 0.0 111.703 173.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 0.634 ' O ' ' HB3' ' A' ' 956' ' ' LYS . 24.3 Cg_exo -49.31 -43.05 39.14 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 122.022 1.815 . . . . 0.0 112.831 172.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.421 ' O ' HG12 ' A' ' 958' ' ' VAL . 21.2 ttt -76.26 -31.09 58.11 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.566 176.287 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.604 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 78.9 t -52.96 -35.77 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 167.741 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.634 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 11.1 tmtt? -66.58 -36.43 82.61 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.119 172.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -76.93 -47.0 22.24 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.908 0.385 . . . . 0.0 111.554 -174.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.619 HG22 HD23 ' A' ' 962' ' ' LEU . 14.1 p -85.4 -33.51 7.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.063 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -60.44 -43.11 99.09 Favored Glycine 0 N--CA 1.447 -0.59 0 N-CA-C 110.8 -0.92 . . . . 0.0 110.8 176.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . 0.419 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 14.7 tp -63.57 -36.76 84.87 Favored 'General case' 0 C--O 1.22 -0.468 0 C-N-CA 122.235 0.214 . . . . 0.0 110.716 176.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -75.72 -38.12 58.83 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.266 0.555 . . . . 0.0 111.046 -174.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.881 HD21 HD13 ' A' ' 995' ' ' LEU . 4.3 pp -87.37 -20.26 26.96 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.613 -178.203 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.419 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 15.3 ptm180 -77.01 -35.93 56.67 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 119.574 -0.85 . . . . 0.0 110.668 165.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 85.8 m -61.5 -36.02 79.34 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 173.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.516 ' HA ' ' OD1' ' A' ' 928' ' ' ASN . 18.5 tp -61.77 -47.85 83.34 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.293 -1.321 . . . . 0.0 110.207 173.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.768 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.4 tt -66.04 -37.85 86.89 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.191 -173.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -71.91 -31.15 66.1 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.901 178.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.791 HG21 ' HB2' ' A' ' 924' ' ' LYS . 23.5 m -71.22 -36.91 72.03 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 119.668 -0.813 . . . . 0.0 109.553 173.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.843 HG12 HG23 ' A' ' 984' ' ' ILE . 61.7 t -68.47 -39.78 81.19 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.338 172.458 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.764 ' HB2' HE22 ' A' ' 988' ' ' GLN . 10.3 t70 -67.23 -40.23 86.34 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.85 0.833 . . . . 0.0 108.758 -178.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.655 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 8.1 tp10 -68.28 -29.47 68.26 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 114.561 -1.2 . . . . 0.0 109.726 177.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.686 ' HA ' HG22 ' A' ' 975' ' ' VAL . 70.8 m -69.52 -17.91 63.62 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.879 175.65 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.899 ' HB2' HG21 ' A' ' 984' ' ' ILE . 10.5 tt -68.81 -52.78 16.81 Favored Pre-proline 0 N--CA 1.449 -0.493 0 C-N-CA 120.973 -0.291 . . . . 0.0 110.324 -177.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.655 ' HD2' ' O ' ' A' ' 971' ' ' GLU . 90.4 Cg_endo -90.91 0.75 4.94 Favored 'Trans proline' 0 C--N 1.357 0.991 0 C-N-CA 121.357 1.371 . . . . 0.0 114.72 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.686 HG22 ' HA ' ' A' ' 972' ' ' SER . 27.4 m -84.94 -26.52 6.73 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 O-C-N 121.427 -0.795 . . . . 0.0 111.298 172.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.578 ' HG ' ' HD2' ' A' ' 977' ' ' PRO . 1.1 tp -108.17 160.02 28.52 Favored Pre-proline 0 C--N 1.327 -0.384 0 C-N-CA 120.664 -0.414 . . . . 0.0 111.303 178.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 0.578 ' HD2' ' HG ' ' A' ' 976' ' ' LEU . 72.9 Cg_exo -53.13 167.08 0.8 Allowed 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 123.619 2.879 . . . . 0.0 113.703 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . 0.461 ' HA ' ' CD2' ' A' ' 981' ' ' HIS . . . -53.43 -32.7 50.96 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.032 -0.986 . . . . 0.0 113.436 -170.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.733 ' HB2' ' SD ' ' A' 1046 ' ' MET . 5.1 p -60.0 -53.12 61.52 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.818 HG23 ' HB1' ' A' 1042 ' ' ALA . 25.8 m -59.79 -21.75 61.25 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 122.488 0.315 . . . . 0.0 111.816 -176.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.518 ' O ' ' HG2' ' A' ' 985' ' ' GLU . 12.2 m170 -50.56 -40.54 52.39 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -177.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . 0.467 ' HA ' ' CG ' ' A' ' 985' ' ' GLU . 11.1 ptt180 -83.52 -18.75 37.37 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 -171.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.454 ' HG3' HG13 ' A' 1038 ' ' VAL . 0.4 OUTLIER -74.3 -34.6 63.57 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 171.7 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.899 HG21 ' HB2' ' A' ' 973' ' ' LEU . 1.8 mp -70.99 -32.75 49.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 176.058 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . 0.518 ' HG2' ' O ' ' A' ' 981' ' ' HIS . 64.5 mm-40 -57.6 -54.19 49.63 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.325 174.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 48.0 ttm -68.47 -45.59 72.03 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.246 -172.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.681 ' HB1' ' HB3' ' A' 1035 ' ' LEU . . . -68.69 -52.2 33.54 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.299 -0.864 . . . . 0.0 112.737 -171.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.768 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 3.3 pt20 -65.13 -26.98 68.42 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 119.759 -0.776 . . . . 0.0 111.446 -177.156 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . 0.821 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 54.9 mtpt -75.15 -42.31 56.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.282 0.563 . . . . 0.0 111.697 175.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.546 HD23 HD11 ' A' 1035 ' ' LEU . 39.3 tp -54.0 -58.19 8.25 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -178.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.881 HD11 ' HA ' ' A' 1028 ' ' LEU . 11.4 tp -68.3 -23.12 64.7 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 120.336 -0.545 . . . . 0.0 110.169 179.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . 0.821 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 25.2 t-20 -51.77 -54.13 32.05 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.82 174.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 6.8 p -76.49 -26.1 54.95 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.355 177.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -64.19 -52.46 58.79 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 121.323 0.582 . . . . 0.0 110.198 177.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 0.881 HD13 HD21 ' A' ' 962' ' ' LEU . 0.3 OUTLIER -51.95 -28.36 16.34 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.704 168.598 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -70.29 -35.77 73.93 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 118.789 -1.164 . . . . 0.0 111.291 176.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.546 ' O ' ' HD3' ' A' 1001 ' ' LYS . 3.9 pt-20 -78.06 -29.51 49.25 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 121.134 -0.979 . . . . 0.0 110.912 175.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.842 HD22 HD11 ' A' 1028 ' ' LEU . 0.1 OUTLIER -56.15 -47.08 78.91 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 121.296 0.569 . . . . 0.0 110.062 178.513 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.502 ' O ' ' HB2' ' A' 1003 ' ' LYS . 75.2 mt -70.66 -32.99 51.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 114.927 -1.033 . . . . 0.0 111.522 -174.552 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -65.46 -41.29 93.55 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.995 0.426 . . . . 0.0 111.879 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.546 ' HD3' ' O ' ' A' ' 997' ' ' GLU . 0.6 OUTLIER -78.39 -34.56 48.09 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 122.332 1.063 . . . . 0.0 108.742 -178.964 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.989 ' HG2' ' HB3' ' A' ' 951' ' ' TYR . 12.5 ttt -62.57 -27.74 69.39 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 113.977 -1.465 . . . . 0.0 109.046 176.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.502 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 2.6 tptp -74.84 -53.05 9.81 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 113.753 -1.567 . . . . 0.0 110.623 -167.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.561 ' HA ' ' HG2' ' A' 1007 ' ' GLN . 7.4 mp -75.15 -12.32 60.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.87 -179.024 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.754 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -70.28 -50.03 43.67 Favored 'General case' 0 C--O 1.216 -0.698 0 C-N-CA 119.364 -0.934 . . . . 0.0 109.747 177.316 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.927 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.3 pp0? -71.71 -30.64 65.87 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 174.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.561 ' HG2' ' HA ' ' A' 1004 ' ' LEU . 4.7 pt20 -57.87 -48.15 80.65 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 119.989 -0.684 . . . . 0.0 109.703 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.663 ' HB2' HD12 ' A' 1013 ' ' LEU . 14.0 m-30 -115.22 42.01 2.32 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 173.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 1.033 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 12.4 p -54.0 -24.56 11.14 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.301 0 CA-C-O 122.319 1.057 . . . . 0.0 109.743 173.259 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 49.3 mtt -55.96 -20.72 17.39 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 113.687 -1.597 . . . . 0.0 111.529 174.294 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . 0.542 ' HB ' ' H ' ' A' 1012 ' ' SER . 16.9 p -142.87 -153.08 0.44 Allowed 'General case' 0 C--O 1.262 1.713 0 CA-C-O 123.596 1.665 . . . . 0.0 115.276 -172.068 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . 0.542 ' H ' ' HB ' ' A' 1011 ' ' THR . 26.2 p -55.04 -37.99 67.4 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 113.048 -1.887 . . . . 0.0 112.743 -173.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.74 ' O ' ' HB2' ' A' 1017 ' ' TYR . 6.6 mt -52.9 -40.32 63.44 Favored 'General case' 0 CA--C 1.494 -1.185 0 C-N-CA 120.196 -0.602 . . . . 0.0 110.507 178.14 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 1.033 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.09 -53.7 49.56 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-O 121.699 0.761 . . . . 0.0 109.398 -173.952 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.508 ' O ' ' HD3' ' A' 1019 ' ' LYS . 0.9 OUTLIER -72.61 -41.14 65.89 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 114.587 -1.188 . . . . 0.0 112.231 -177.273 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -70.64 -55.47 8.69 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 122.818 0.447 . . . . 0.0 112.041 -178.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.754 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 7.3 m-85 -62.11 -33.33 74.25 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -177.205 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.631 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 54.3 tptt -78.93 -27.8 43.74 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.492 -177.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . 0.508 ' HD3' ' O ' ' A' 1015 ' ' GLN . 4.3 mptp? -71.68 -50.23 32.33 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 172.183 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . 0.409 ' HB3' ' HG2' ' A' 1001 ' ' LYS . 48.5 mt-30 -52.23 -31.41 32.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.83 165.241 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.568 ' HG3' ' CB ' ' A' 1002 ' ' MET . 2.3 ttp -67.81 -49.23 63.45 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 178.252 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . 0.769 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -81.92 -8.58 59.69 Favored 'General case' 0 C--O 1.218 -0.586 0 C-N-CA 118.987 -1.085 . . . . 0.0 109.41 -177.16 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 52.4 m -76.8 -45.74 27.64 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.718 171.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.56 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -74.85 -21.46 59.25 Favored 'General case' 0 C--O 1.213 -0.845 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 173.459 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.77 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -84.56 -25.94 28.34 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.223 172.428 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.466 ' O ' HG23 ' A' 1030 ' ' VAL . 42.4 t-80 -78.32 -22.71 47.69 Favored 'General case' 0 C--O 1.214 -0.793 0 O-C-N 121.845 -0.534 . . . . 0.0 109.641 167.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -69.84 -42.55 73.45 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 123.421 0.688 . . . . 0.0 109.82 162.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.881 ' HA ' HD11 ' A' ' 991' ' ' LEU . 49.7 mt -56.12 -50.05 72.17 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 168.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . 0.441 ' HA ' HG22 ' A' ' 933' ' ' VAL . . . -59.6 -43.48 93.7 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 175.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' 1026 ' ' HIS . 3.7 t -66.98 -50.82 60.92 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.305 0 CA-C-O 121.019 0.438 . . . . 0.0 110.564 -176.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.617 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 4.0 m-20 -76.36 -29.1 57.06 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.83 -178.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.531 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -67.22 -27.43 67.23 Favored 'General case' 0 C--N 1.321 -0.645 0 O-C-N 121.426 -0.796 . . . . 0.0 109.749 172.344 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.457 ' C ' ' HD3' ' A' 1033 ' ' LYS . 12.7 tmtt? -70.36 -51.86 26.76 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 167.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.617 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 36.1 t30 -63.37 -56.66 14.55 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 114.838 -1.074 . . . . 0.0 112.569 -174.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.681 ' HB3' ' HB1' ' A' ' 987' ' ' ALA . 0.2 OUTLIER -60.24 -35.85 76.41 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.775 -0.193 . . . . 0.0 110.578 -179.865 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.538 ' C ' HD23 ' A' 1036 ' ' LEU . 0.8 OUTLIER -67.57 -47.27 70.27 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 118.987 -1.085 . . . . 0.0 108.712 179.122 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.5 ' O ' ' HB2' ' A' 1041 ' ' GLN . 13.4 t70 -51.32 -28.35 11.99 Favored 'General case' 0 C--O 1.215 -0.729 0 CA-C-N 113.873 -1.512 . . . . 0.0 109.977 172.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.557 ' HB ' ' O ' ' A' 1035 ' ' LEU . 30.1 t -75.19 -29.95 22.36 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.536 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.778 178.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.545 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 1.8 mp -85.78 -34.75 8.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 CA-C-N 118.221 0.464 . . . . 0.0 111.577 172.094 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.617 ' HB3' ' HB ' ' A' ' 919' ' ' ILE . 0.9 OUTLIER -59.65 -42.86 93.75 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 167.221 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.5 ' HB2' ' O ' ' A' 1037 ' ' ASP . 1.7 mt-30 -58.53 -54.09 51.02 Favored 'General case' 0 C--O 1.218 -0.577 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.894 168.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.818 ' HB1' HG23 ' A' ' 980' ' ' THR . . . -53.19 -47.12 69.14 Favored 'General case' 0 CA--C 1.499 -1.017 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.735 -170.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.589 ' O ' HG12 ' A' 1047 ' ' ILE . 13.8 ptp180 -67.56 -46.69 71.96 Favored 'General case' 0 N--CA 1.432 -1.364 0 C-N-CA 119.91 -0.716 . . . . 0.0 110.668 -172.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.688 HD11 ' HB3' ' A' ' 920' ' ' ARG . 36.5 mt -80.49 -32.93 36.88 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 120.233 -0.587 . . . . 0.0 112.069 -178.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -68.22 -34.51 76.37 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 122.652 0.381 . . . . 0.0 111.056 -179.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.733 ' SD ' ' HB2' ' A' ' 979' ' ' SER . 24.1 mmt -73.83 -28.62 61.7 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.758 0.313 . . . . 0.0 110.755 176.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.589 HG12 ' O ' ' A' 1043 ' ' ARG . 49.0 mm -75.66 -33.71 27.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 121.23 0.538 . . . . 0.0 110.274 172.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 47.1 m -78.25 -11.43 59.93 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.832 178.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -84.97 151.58 24.11 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.068 -176.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 48.3 t -109.42 -37.94 5.6 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.688 -176.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . 0.601 ' CB ' ' HD3' ' A' 1052 ' ' PRO . 0.6 OUTLIER -76.48 -69.37 0.24 Allowed Pre-proline 0 CA--C 1.535 0.39 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.513 -173.75 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . 0.601 ' HD3' ' CB ' ' A' 1051 ' ' ARG . 66.0 Cg_endo -98.02 129.18 0.25 Allowed 'Trans proline' 0 N--CA 1.447 -1.243 0 C-N-CA 121.685 1.59 . . . . 0.0 112.377 178.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 55.4 t-80 . . . . . 0 C--N 1.324 -0.542 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.009 178.863 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.755 0 N-CA-C 111.987 -0.445 . . . . 0.0 111.987 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 909' ' ' SER . . . . . 0.464 ' HA ' ' HD3' ' A' ' 910' ' ' PRO . 27.5 t -126.95 137.03 29.73 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 179.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 910' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 909' ' ' SER . 12.6 Cg_exo -71.73 -2.42 11.39 Favored 'Trans proline' 0 CA--C 1.531 0.355 0 C-N-CA 123.18 2.586 . . . . 0.0 113.046 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -86.73 61.82 4.32 Favored Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 120.795 -0.716 . . . . 0.0 111.89 179.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 36.0 pt -102.23 -12.55 8.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 -176.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 8.8 p -130.19 -43.79 1.17 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.016 0.436 . . . . 0.0 111.1 -177.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . -174.73 -115.63 0.41 Allowed Glycine 0 N--CA 1.445 -0.716 0 N-CA-C 111.274 -0.73 . . . . 0.0 111.274 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 143.23 94.4 0.2 Allowed Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.434 178.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . -130.85 48.43 0.97 Allowed Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.363 -0.695 . . . . 0.0 111.363 177.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . 115.81 74.45 0.56 Allowed Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 110.76 -0.936 . . . . 0.0 110.76 -175.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -65.52 -17.65 64.71 Favored Glycine 0 N--CA 1.454 -0.133 0 C-N-CA 121.435 -0.412 . . . . 0.0 113.739 -174.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 919' ' ' ILE . . . . . 0.931 HG13 ' HG3' ' A' ' 920' ' ' ARG . 0.0 OUTLIER -77.58 137.98 21.27 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.226 0 CA-C-O 122.212 1.006 . . . . 0.0 111.4 179.436 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.931 ' HG3' HG13 ' A' ' 919' ' ' ILE . 58.4 mtt180 79.65 86.44 0.06 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 112.676 -2.056 . . . . 0.0 111.992 174.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 60.6 p -153.73 -12.45 0.14 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.779 -1.101 . . . . 0.0 111.222 173.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -94.93 -59.68 1.85 Allowed 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.272 -179.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.77 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 28.7 m-20 73.36 -10.53 1.02 Allowed 'General case' 0 C--O 1.213 -0.817 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 169.102 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.704 ' HG3' HG21 ' A' ' 968' ' ' THR . 17.9 tppt? -57.25 -33.68 67.84 Favored 'General case' 0 C--N 1.315 -0.898 0 O-C-N 120.937 -1.102 . . . . 0.0 111.927 -172.563 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.62 ' O ' HG23 ' A' ' 929' ' ' VAL . 12.3 t -65.7 -28.22 43.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.191 0.52 . . . . 0.0 110.691 177.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.77 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -75.94 -26.42 56.87 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.398 0.679 . . . . 0.0 111.66 -177.514 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . 0.515 ' O ' HG22 ' A' ' 930' ' ' THR . 7.8 pt-20 -76.74 -24.13 53.01 Favored 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 118.743 -1.183 . . . . 0.0 109.853 172.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.47 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 1.7 m120 -71.33 -30.72 66.54 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 170.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.62 HG23 ' O ' ' A' ' 925' ' ' VAL . 68.6 t -80.88 -30.53 11.88 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-N 114.811 -1.086 . . . . 0.0 111.68 177.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.515 HG22 ' O ' ' A' ' 927' ' ' GLU . 3.6 t -66.29 -30.8 71.3 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 120.222 1.374 . . . . 0.0 107.759 170.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -72.53 -52.73 9.6 Favored Glycine 0 CA--C 1.526 0.727 0 CA-C-N 115.35 -0.841 . . . . 0.0 113.239 175.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.547 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.1 pp -66.99 -49.35 65.64 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 -177.372 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.576 HG22 ' HA ' ' A' 1029 ' ' ALA . 79.0 t -68.42 -37.18 77.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-O 121.038 0.446 . . . . 0.0 111.151 -174.267 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.43 ' O ' ' HB2' ' A' ' 938' ' ' GLU . 30.2 ttpt -58.26 -46.31 86.24 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.159 179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -56.17 -36.68 68.61 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.671 176.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.792 HG22 ' HB1' ' A' 1025 ' ' ALA . 85.0 t -52.85 -75.45 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-O 121.12 0.486 . . . . 0.0 112.086 -178.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 30.7 pt -68.01 -41.68 84.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.328 -176.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.43 ' HB2' ' O ' ' A' ' 934' ' ' LYS . 9.2 mm-40 -64.49 -49.63 70.6 Favored 'General case' 0 C--N 1.311 -1.077 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.908 -174.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.567 ' HB3' ' OE1' ' A' ' 949' ' ' GLU . 25.0 mmt -74.53 -24.94 59.03 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.336 -179.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.59 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 24.8 p -52.87 -38.64 61.85 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.384 0.611 . . . . 0.0 111.078 -174.094 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 44.6 m -107.34 -18.09 13.96 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 114.932 -1.031 . . . . 0.0 112.453 -176.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -82.81 -7.68 59.64 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 119.554 -0.858 . . . . 0.0 110.292 -177.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.815 HD13 ' HG2' ' A' 1018 ' ' LYS . 41.0 pt -62.37 -26.49 40.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.331 165.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.671 ' HB3' ' HD3' ' A' ' 945' ' ' PRO . 6.5 tp-100 -65.2 -57.72 14.49 Favored Pre-proline 0 CA--C 1.54 0.561 0 N-CA-C 112.378 0.511 . . . . 0.0 112.378 -172.251 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.671 ' HD3' ' HB3' ' A' ' 944' ' ' GLN . 85.1 Cg_endo -85.17 16.26 2.02 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 121.882 1.721 . . . . 0.0 113.179 -178.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.586 ' HB1' ' HD2' ' A' ' 947' ' ' PRO . . . -135.58 170.17 11.79 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 116.614 -0.267 . . . . 0.0 110.546 -176.171 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.586 ' HD2' ' HB1' ' A' ' 946' ' ' ALA . 38.1 Cg_endo -67.99 170.0 15.24 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.099 1.866 . . . . 0.0 111.1 171.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.501 ' HA ' HG21 ' A' 1009 ' ' VAL . 4.3 Cg_exo -41.72 133.66 3.81 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.414 2.743 . . . . 0.0 112.957 -179.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.641 ' HB2' HG22 ' A' ' 943' ' ' ILE . 26.8 tt0 -59.64 -22.9 62.52 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.063 176.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.817 ' HB3' ' HG2' ' A' ' 953' ' ' PRO . 12.5 mm-40 55.22 66.64 1.17 Allowed 'General case' 0 N--CA 1.438 -1.033 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 -165.14 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.787 ' HB3' ' HB2' ' A' 1002 ' ' MET . 35.3 m-85 -53.58 -31.22 45.93 Favored 'General case' 0 C--O 1.21 -0.974 0 CA-C-N 113.545 -1.661 . . . . 0.0 111.912 179.25 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 0.657 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.1 OUTLIER -63.07 -52.88 59.55 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 120.663 -0.415 . . . . 0.0 110.859 174.097 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 0.817 ' HG2' ' HB3' ' A' ' 950' ' ' GLU . 0.5 OUTLIER -46.26 -43.68 20.93 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 121.936 1.757 . . . . 0.0 113.309 161.322 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.734 ' HB3' ' HA ' ' A' ' 951' ' ' TYR . 27.3 tpp -60.83 -33.49 73.12 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.794 0.33 . . . . 0.0 110.859 176.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.628 HG23 ' HA ' ' A' ' 952' ' ' VAL . 60.0 t -51.84 -40.1 26.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.249 -0.432 . . . . 0.0 109.946 172.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.599 ' HD3' ' HA ' ' A' ' 953' ' ' PRO . 3.2 mptp? -66.59 -36.73 83.33 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.735 0.302 . . . . 0.0 110.862 175.688 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -79.85 -45.45 18.66 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.186 -0.461 . . . . 0.0 112.125 -172.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.428 HG12 ' O ' ' A' ' 954' ' ' MET . 11.8 p -84.26 -26.34 7.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -65.02 -30.77 78.86 Favored Glycine 0 N--CA 1.442 -0.944 0 N-CA-C 110.03 -1.228 . . . . 0.0 110.03 169.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . 0.614 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 19.5 tp -71.08 -38.59 72.43 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.305 -0.448 . . . . 0.0 110.097 176.029 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.535 ' HB1' ' HB3' ' A' ' 932' ' ' LEU . . . -72.46 -39.7 67.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.905 0.383 . . . . 0.0 111.109 -174.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.454 HD22 HD22 ' A' ' 995' ' ' LEU . 0.0 OUTLIER -70.18 -40.53 74.61 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-O 119.095 -0.478 . . . . 0.0 110.873 173.346 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.614 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 4.6 ptp180 -67.03 -31.38 71.86 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 118.735 -1.186 . . . . 0.0 110.306 178.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . 0.496 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 40.5 m -68.62 -40.96 80.13 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.127 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.624 HD22 HD11 ' A' ' 991' ' ' LEU . 0.1 OUTLIER -63.76 -39.58 94.63 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 114.062 -1.426 . . . . 0.0 110.92 175.535 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.618 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.2 tt -76.17 -35.08 59.32 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 -172.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . 0.413 ' O ' ' HB2' ' A' ' 971' ' ' GLU . . . -72.08 -31.07 65.74 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.393 178.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.704 HG21 ' HG3' ' A' ' 924' ' ' LYS . 13.6 p -70.6 -41.58 72.12 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 118.347 0.521 . . . . 0.0 110.301 174.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 1.026 HG12 HG23 ' A' ' 984' ' ' ILE . 61.2 t -68.52 -38.19 78.82 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.991 172.494 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.58 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 16.5 t70 -68.06 -39.54 82.97 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.965 0.888 . . . . 0.0 108.88 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.625 ' O ' HG23 ' A' ' 975' ' ' VAL . 37.5 tt0 -65.74 -32.92 74.73 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.272 -1.331 . . . . 0.0 109.672 177.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.444 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 71.9 m -66.97 -17.81 65.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.979 175.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.752 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 8.5 tt -68.57 -52.39 19.64 Favored Pre-proline 0 CA--C 1.534 0.33 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 -178.314 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.752 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 5.7 Cg_exo -81.89 0.62 9.74 Favored 'Trans proline' 0 C--N 1.354 0.857 0 C-N-CA 121.478 1.452 . . . . 0.0 112.908 173.033 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.625 HG23 ' O ' ' A' ' 971' ' ' GLU . 17.5 t -73.44 -52.09 22.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 170.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . . . . . . . . . 32.1 tp -134.12 95.37 16.9 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-O 120.993 0.425 . . . . 0.0 110.38 178.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_exo -72.98 -173.72 1.32 Allowed 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 123.329 2.686 . . . . 0.0 112.067 178.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . 70.28 103.99 0.06 Allowed 'General case' 0 N--CA 1.463 0.19 0 O-C-N 123.761 0.663 . . . . 0.0 111.035 -178.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.677 ' O ' ' HG2' ' A' ' 982' ' ' ARG . 44.4 m 69.17 -59.7 0.47 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.246 -0.888 . . . . 0.0 113.334 178.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.42 ' OG1' ' HG2' ' A' 1046 ' ' MET . 1.9 m -52.75 -29.25 26.06 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 -171.21 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.712 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 19.2 p80 -50.2 -32.04 15.38 Favored 'General case' 0 C--O 1.214 -0.782 0 C-N-CA 121.135 -0.226 . . . . 0.0 111.54 174.39 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . 0.677 ' HG2' ' O ' ' A' ' 979' ' ' SER . 9.4 ptm180 -82.81 -20.51 35.58 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 121.147 -0.221 . . . . 0.0 111.069 -173.683 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.01 -34.47 57.41 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 169.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 1.026 HG23 HG12 ' A' ' 969' ' ' VAL . 69.0 mt -70.05 -32.82 52.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 114.913 -1.039 . . . . 0.0 109.441 177.339 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . 0.712 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 42.0 mt-10 -66.01 -51.62 56.68 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.312 177.477 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 18.2 mmt -71.58 -41.73 68.64 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.909 -172.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.999 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -75.56 -51.54 12.67 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.357 -0.838 . . . . 0.0 113.25 -171.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.71 ' O ' ' HB2' ' A' ' 992' ' ' ASN . 2.3 pt20 -62.42 -28.35 69.73 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 119.649 -0.82 . . . . 0.0 109.703 179.046 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . 0.71 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 21.0 tttm -69.48 -40.82 76.84 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.323 -0.853 . . . . 0.0 112.204 170.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.451 ' HB3' ' O ' ' A' ' 987' ' ' ALA . 17.2 tp -50.5 -60.36 3.09 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.47 -0.786 . . . . 0.0 113.032 -176.438 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.734 HD22 HD13 ' A' 1035 ' ' LEU . 1.5 pt? -76.55 -20.42 56.88 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-O 121.508 0.671 . . . . 0.0 109.826 -178.305 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . 0.71 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 50.3 t-20 -50.9 -53.97 28.07 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 114.424 -1.262 . . . . 0.0 110.876 175.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 3.7 m -73.75 -34.75 64.86 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 120.792 -0.363 . . . . 0.0 111.741 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . 0.412 ' O ' ' HB2' ' A' ' 997' ' ' GLU . 0.3 OUTLIER -66.91 -32.93 74.51 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 119.829 -0.748 . . . . 0.0 111.904 178.272 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 0.622 ' N ' HD21 ' A' 1028 ' ' LEU . 3.3 tt -69.6 -20.89 63.62 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 122.222 0.209 . . . . 0.0 110.697 170.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -75.76 -26.33 57.31 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 119.671 -0.811 . . . . 0.0 109.665 170.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.606 ' O ' ' HG2' ' A' 1001 ' ' LYS . 56.0 mm-40 -71.33 -46.23 61.09 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 171.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.76 HD22 HD11 ' A' 1028 ' ' LEU . 0.0 OUTLIER -55.38 -45.76 76.57 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.713 -177.404 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.585 ' HA ' ' HG2' ' A' 1002 ' ' MET . 85.6 mt -65.08 -37.74 80.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.356 -175.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 26.6 m-80 -61.33 -40.32 93.8 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.176 0.512 . . . . 0.0 111.457 177.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.606 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 51.1 mmtt -76.38 -45.23 32.76 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.942 0.877 . . . . 0.0 108.998 -171.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.787 ' HB2' ' HB3' ' A' ' 951' ' ' TYR . 14.5 ptp -62.25 -30.5 71.16 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.88 -1.054 . . . . 0.0 109.026 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.564 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 6.0 tptm -64.55 -53.02 54.41 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.35 -167.376 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.724 ' HB3' HD13 ' A' 1013 ' ' LEU . 7.2 mp -75.34 -13.82 60.44 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.876 -178.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.654 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -67.95 -43.7 78.48 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.099 -178.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.938 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -77.13 -23.82 51.71 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.349 -0.541 . . . . 0.0 111.485 174.373 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -52.89 -47.72 67.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.361 0.601 . . . . 0.0 110.638 174.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.639 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 74.6 m-85 -121.5 38.72 4.02 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.988 174.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 1.06 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 11.9 p -48.61 -23.07 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.665 173.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 1.4 mpt? -37.38 -49.92 1.02 Allowed 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.108 0.88 . . . . 0.0 111.328 173.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 71.4 m -163.56 -77.95 0.04 OUTLIER 'General case' 0 C--O 1.243 0.744 0 CA-C-O 121.125 0.488 . . . . 0.0 111.92 175.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . 0.474 ' O ' ' HG2' ' A' 1015 ' ' GLN . 6.3 m -50.55 -76.43 0.02 OUTLIER 'General case' 0 C--O 1.241 0.624 0 CA-C-N 115.278 -0.874 . . . . 0.0 113.297 -166.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.724 HD13 ' HB3' ' A' 1004 ' ' LEU . 2.8 mt -46.91 -42.57 17.84 Favored 'General case' 0 CA--C 1.501 -0.917 0 N-CA-C 113.569 0.951 . . . . 0.0 113.569 -178.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 1.06 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -55.68 -43.85 76.78 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.905 -166.907 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.474 ' HG2' ' O ' ' A' 1012 ' ' SER . 24.3 pt20 -75.73 -40.79 54.99 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.814 -175.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -69.97 -53.63 16.93 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.487 0.66 . . . . 0.0 110.54 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.682 ' CE2' HD22 ' A' 1013 ' ' LEU . 7.8 m-85 -63.86 -35.77 81.73 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.865 -1.061 . . . . 0.0 113.263 -173.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.815 ' HG2' HD13 ' A' ' 943' ' ' ILE . 21.4 tptm -80.63 -28.0 37.08 Favored 'General case' 0 N--CA 1.458 -0.066 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.292 -177.424 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . 0.416 ' O ' HD23 ' A' 1022 ' ' LEU . 11.9 mptt -73.38 -51.55 16.95 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 175.585 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -50.79 -34.99 29.7 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.265 163.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.644 ' HE2' HD11 ' A' ' 998' ' ' LEU . 1.7 tmt? -65.34 -50.72 64.53 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 110.28 -0.266 . . . . 0.0 110.28 175.551 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . 0.739 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -77.5 -6.58 54.09 Favored 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 119.328 -0.949 . . . . 0.0 109.788 -175.712 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 86.5 m -80.05 -44.44 20.08 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 173.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.49 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.29 -20.76 50.9 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-O 121.309 0.576 . . . . 0.0 109.543 175.281 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.792 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -84.17 -25.19 29.76 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.17 170.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.58 ' O ' HG23 ' A' 1030 ' ' VAL . 16.1 t-80 -76.05 -26.47 56.6 Favored 'General case' 0 C--O 1.215 -0.737 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 165.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . 0.476 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -66.03 -43.34 87.84 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 122.962 0.505 . . . . 0.0 110.297 162.274 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.76 HD11 HD22 ' A' ' 998' ' ' LEU . 17.0 mt -59.37 -46.1 89.6 Favored 'General case' 0 C--N 1.317 -0.838 0 C-N-CA 120.399 -0.52 . . . . 0.0 109.615 171.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . 0.627 ' O ' ' HB2' ' A' 1033 ' ' LYS . . . -57.45 -40.18 77.89 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.128 173.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.58 HG23 ' O ' ' A' 1026 ' ' HIS . 12.2 t -69.77 -51.45 40.71 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 CA-C-O 121.407 0.622 . . . . 0.0 110.644 -177.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.436 ' O ' ' HB3' ' A' 1035 ' ' LEU . 71.4 m-20 -75.11 -30.82 60.97 Favored 'General case' 0 C--O 1.221 -0.444 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.535 -173.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.818 ' HA ' HD22 ' A' 1035 ' ' LEU . . . -72.99 -35.46 66.87 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.841 0.353 . . . . 0.0 110.129 173.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.627 ' HB2' ' O ' ' A' 1029 ' ' ALA . 53.2 tttt -63.68 -46.24 86.44 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.944 0.878 . . . . 0.0 108.988 172.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.429 ' O ' HG23 ' A' 1038 ' ' VAL . 12.6 t30 -68.93 -51.84 35.58 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 113.996 -1.456 . . . . 0.0 112.485 -177.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.999 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 0.2 OUTLIER -59.24 -40.85 87.23 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 117.782 0.265 . . . . 0.0 111.139 -171.713 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.506 ' HG ' ' HB ' ' A' ' 925' ' ' VAL . 1.5 tm? -68.13 -47.56 67.79 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 118.574 -1.251 . . . . 0.0 109.289 -178.04 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 14.8 t70 -47.16 -45.92 23.1 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 114.912 -1.04 . . . . 0.0 110.363 171.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.47 ' HB ' ' O ' ' A' 1035 ' ' LEU . 22.4 t -56.18 -42.52 73.41 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.633 0 CA-C-N 113.912 -1.495 . . . . 0.0 112.818 177.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.587 HG12 HG12 ' A' ' 984' ' ' ILE . 1.6 mp -81.26 -31.77 11.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 119.304 0.956 . . . . 0.0 111.288 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.587 ' C ' ' HB ' ' A' ' 919' ' ' ILE . 3.0 m-20 -59.38 -41.25 88.92 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 167.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -71.94 -37.57 69.97 Favored 'General case' 0 C--O 1.215 -0.737 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.578 173.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.533 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -53.29 -55.56 23.63 Favored 'General case' 0 CA--C 1.499 -0.988 0 C-N-CA 123.468 0.707 . . . . 0.0 111.566 -179.241 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.468 ' O ' ' HG3' ' A' 1046 ' ' MET . 0.0 OUTLIER -63.45 -37.36 86.98 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.34 -175.56 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 2.8 tm? -66.83 -48.89 67.51 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.164 178.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . . . . . . . . . 45.8 mtpt -57.11 -44.51 83.3 Favored 'General case' 0 C--O 1.213 -0.836 0 C-N-CA 124.072 0.949 . . . . 0.0 112.838 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.468 ' HB3' ' HB2' ' A' ' 979' ' ' SER . 1.5 ptm -64.39 -26.37 68.43 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 119.142 -1.023 . . . . 0.0 111.638 -179.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . . . . . . . . . 51.5 mm -84.93 -52.03 12.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.793 0.33 . . . . 0.0 110.898 174.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 23.2 t -63.87 -42.06 97.61 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.553 -177.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 11.8 mm-40 -97.48 160.86 14.07 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.966 -171.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -123.43 -12.42 7.76 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.71 175.393 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . 0.756 ' H ' ' HD2' ' A' 1052 ' ' PRO . 38.7 mtm180 -131.26 -54.7 0.03 OUTLIER Pre-proline 0 CA--C 1.536 0.42 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . 0.756 ' HD2' ' H ' ' A' 1051 ' ' ARG . 50.4 Cg_endo -69.71 45.99 0.47 Allowed 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 122.955 2.437 . . . . 0.0 114.614 -178.228 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.324 -0.538 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 170.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.792 0 N-CA-C 112.033 -0.427 . . . . 0.0 112.033 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 909' ' ' SER . . . . . 0.404 ' N ' ' HD2' ' A' ' 910' ' ' PRO . 30.4 t -66.96 -51.24 38.49 Favored Pre-proline 0 CA--C 1.536 0.41 0 CA-C-O 119.672 -0.204 . . . . 0.0 110.858 179.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 910' ' ' PRO . . . . . 0.404 ' HD2' ' N ' ' A' ' 909' ' ' SER . 37.4 Cg_endo -69.05 69.9 1.23 Allowed 'Trans proline' 0 C--N 1.359 1.098 0 C-N-CA 121.781 1.654 . . . . 0.0 111.066 171.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . 179.09 -20.14 0.04 OUTLIER Glycine 0 N--CA 1.447 -0.58 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -176.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 61.9 mt -101.47 102.68 13.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 172.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 11.3 m -112.3 130.79 55.83 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.086 -174.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . -100.79 65.19 0.54 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 121.069 -0.586 . . . . 0.0 111.897 177.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 75.5 -147.55 35.83 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.97 -0.633 . . . . 0.0 112.151 -178.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 916' ' ' GLY . . . . . 0.498 ' HA2' HD13 ' A' ' 919' ' ' ILE . . . -78.12 93.53 1.2 Allowed Glycine 0 N--CA 1.445 -0.722 0 C-N-CA 120.978 -0.63 . . . . 0.0 111.798 178.086 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . -63.78 -69.53 1.3 Allowed Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 121.051 -0.595 . . . . 0.0 112.833 -177.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -131.85 31.86 2.99 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.343 -0.932 . . . . 0.0 113.182 -177.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 919' ' ' ILE . . . . . 0.861 HG13 ' HA ' ' A' 1041 ' ' GLN . 2.4 mp -59.95 81.98 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 C-N-CA 123.042 0.537 . . . . 0.0 110.438 174.467 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.496 ' HB2' ' O ' ' A' ' 919' ' ' ILE . 15.0 tpp180 175.54 102.6 0.01 OUTLIER 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.455 170.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 49.4 m -137.97 116.46 12.04 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 168.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -58.1 161.67 3.96 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.825 0.822 . . . . 0.0 111.569 -167.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.677 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 10.9 t70 -174.48 136.01 0.44 Allowed 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 114.322 -1.308 . . . . 0.0 113.83 -165.386 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.586 ' HB2' HG21 ' A' ' 968' ' ' THR . 0.0 OUTLIER -49.83 -14.33 0.13 Allowed 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.127 -0.942 . . . . 0.0 113.398 177.076 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.777 ' HA ' HD21 ' A' ' 928' ' ' ASN . 4.2 p -59.84 -34.53 56.18 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 CA-C-N 119.708 1.14 . . . . 0.0 110.942 167.019 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.677 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 2.4 p90 -77.23 -28.13 53.6 Favored 'General case' 0 CA--C 1.506 -0.737 0 O-C-N 121.601 -0.687 . . . . 0.0 109.394 174.458 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.85 -24.88 48.45 Favored 'General case' 0 C--N 1.307 -1.282 0 C-N-CA 118.698 -1.201 . . . . 0.0 113.962 178.243 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.777 HD21 ' HA ' ' A' ' 925' ' ' VAL . 13.0 p30 -72.21 -27.66 62.69 Favored 'General case' 0 C--N 1.317 -0.807 0 C-N-CA 118.661 -1.216 . . . . 0.0 108.992 166.06 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.787 HG22 ' HB1' ' A' 1032 ' ' ALA . 71.6 t -76.61 -30.7 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 115.19 -0.914 . . . . 0.0 111.137 179.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . . . . . . . . . 26.8 m -61.2 -42.9 99.4 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 172.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -67.12 -52.72 30.38 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-N 114.61 -1.177 . . . . 0.0 113.808 176.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.62 ' HB3' ' HB1' ' A' ' 961' ' ' ALA . 2.4 pp -64.67 -49.47 70.85 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -174.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.531 ' O ' ' HB ' ' A' ' 936' ' ' VAL . 54.3 t -64.2 -37.84 80.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-O 121.311 0.576 . . . . 0.0 110.663 -176.146 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.404 ' O ' ' HB3' ' A' ' 938' ' ' GLU . 19.2 ttpp -59.87 -51.42 69.8 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.08 178.064 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -51.81 -39.69 59.17 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 111.672 0.249 . . . . 0.0 111.672 178.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.909 HG22 ' HB1' ' A' 1025 ' ' ALA . 92.0 t -46.73 -76.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 O-C-N 123.747 0.654 . . . . 0.0 111.852 177.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.448 HG13 ' N ' ' A' ' 938' ' ' GLU . 26.9 pt -68.66 -40.7 82.05 Favored 'Isoleucine or valine' 0 C--O 1.244 0.788 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -176.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.642 ' O ' ' HD3' ' A' ' 942' ' ' LYS . 30.8 tt0 -61.47 -52.86 62.77 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.117 -171.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.552 ' HA ' HG12 ' A' ' 943' ' ' ILE . 85.7 mtp -76.23 -26.93 56.55 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 119.782 -0.767 . . . . 0.0 110.721 -178.226 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.634 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 28.5 t -52.95 -45.75 67.85 Favored 'General case' 0 CA--C 1.52 -0.21 0 O-C-N 123.925 0.766 . . . . 0.0 112.502 -170.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 8.3 t -121.37 -18.31 7.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.191 -0.913 . . . . 0.0 112.24 -170.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.642 ' HD3' ' O ' ' A' ' 938' ' ' GLU . 0.5 OUTLIER -84.05 -44.95 13.58 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 118.793 -1.163 . . . . 0.0 110.376 -179.904 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.552 HG12 ' HA ' ' A' ' 939' ' ' MET . 26.0 mm -74.26 -21.31 17.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.255 179.703 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.486 ' HB3' ' HD3' ' A' ' 945' ' ' PRO . 20.1 tt0 -60.9 -47.75 94.71 Favored Pre-proline 0 CA--C 1.544 0.743 0 N-CA-C 114.114 1.153 . . . . 0.0 114.114 -173.214 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.486 ' HD3' ' HB3' ' A' ' 944' ' ' GLN . 18.2 Cg_exo -69.63 57.23 1.4 Allowed 'Trans proline' 0 C--N 1.358 1.028 0 C-N-CA 122.65 2.233 . . . . 0.0 113.028 179.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.666 ' HB1' ' HD2' ' A' ' 947' ' ' PRO . . . -169.99 -176.4 0.4 Allowed Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 -178.498 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.666 ' HD2' ' HB1' ' A' ' 946' ' ' ALA . 87.3 Cg_exo -50.66 161.16 1.4 Allowed 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 121.817 1.678 . . . . 0.0 111.287 168.114 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.563 ' HA ' HG21 ' A' 1009 ' ' VAL . 4.3 Cg_exo -34.73 131.14 0.2 Allowed 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 124.11 3.206 . . . . 0.0 113.677 -174.16 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.731 ' H ' ' HE1' ' A' ' 951' ' ' TYR . 29.6 mt-10 -66.67 29.03 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 114.815 -1.084 . . . . 0.0 112.782 -176.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.652 ' HB2' ' HG2' ' A' ' 953' ' ' PRO . 9.3 pt-20 33.53 66.15 0.24 Allowed 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 122.108 0.956 . . . . 0.0 110.559 -169.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.868 ' CD1' ' HB3' ' A' 1006 ' ' GLN . 0.8 OUTLIER -63.94 -49.02 74.22 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.238 -1.346 . . . . 0.0 110.509 -169.411 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 0.797 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 26.6 t -59.5 -54.13 59.04 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.963 174.16 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 0.797 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 34.7 Cg_exo -49.01 -41.51 40.03 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 122.059 1.839 . . . . 0.0 112.628 171.535 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . . . . . . . . . 27.0 ttt -64.36 -38.25 90.38 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.376 175.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.747 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 35.1 t -52.25 -47.44 45.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.378 169.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -64.21 -29.89 70.98 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.27 177.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -78.26 -46.07 21.23 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 121.151 0.5 . . . . 0.0 111.012 -174.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . . . . . . . . . 14.8 p -81.66 -26.48 9.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.482 -179.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -67.05 -34.49 86.9 Favored Glycine 0 N--CA 1.447 -0.59 0 N-CA-C 110.493 -1.043 . . . . 0.0 110.493 171.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . 0.577 HD12 ' HD2' ' A' ' 963' ' ' ARG . 20.2 tp -63.88 -30.39 71.48 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.288 -0.456 . . . . 0.0 110.213 175.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.62 ' HB1' ' HB3' ' A' ' 932' ' ' LEU . . . -76.41 -56.86 4.25 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.105 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.624 HD22 HD12 ' A' ' 995' ' ' LEU . 0.2 OUTLIER -44.07 -47.35 8.85 Favored 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 169.22 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.577 ' HD2' HD12 ' A' ' 960' ' ' LEU . 9.5 ptp180 -69.79 -27.18 64.68 Favored 'General case' 0 C--N 1.32 -0.699 0 O-C-N 120.848 -1.158 . . . . 0.0 110.831 179.159 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . 0.484 HG22 ' HB3' ' A' ' 928' ' ' ASN . 93.0 m -68.94 -32.78 72.63 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 171.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.743 HD22 HD23 ' A' ' 991' ' ' LEU . 0.2 OUTLIER -65.44 -41.87 92.99 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.073 172.721 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.546 ' HG ' HE21 ' A' ' 988' ' ' GLN . 5.1 tt -69.98 -42.91 72.48 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.415 -0.811 . . . . 0.0 108.95 -174.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -66.99 -44.07 81.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.258 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.586 HG21 ' HB2' ' A' ' 924' ' ' LYS . 19.4 p -62.38 -48.48 79.57 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.77 0.319 . . . . 0.0 111.224 179.455 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 1.073 HG12 HG23 ' A' ' 984' ' ' ILE . 45.7 t -72.68 -31.43 37.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.81 178.393 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.823 ' HB2' HE22 ' A' ' 988' ' ' GLN . 15.1 t70 -69.96 -40.87 75.16 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 178.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.581 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 31.2 tt0 -64.79 -34.23 77.87 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 114.013 -1.449 . . . . 0.0 109.258 178.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.515 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 61.6 m -71.36 -18.81 62.35 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.324 178.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.747 ' HB2' HG21 ' A' ' 984' ' ' ILE . 9.7 tt -65.27 -49.78 63.08 Favored Pre-proline 0 CA--C 1.532 0.254 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.482 -176.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.702 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 4.9 Cg_exo -81.84 -9.68 11.93 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 121.659 1.573 . . . . 0.0 113.058 171.16 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.569 HG23 ' O ' ' A' ' 971' ' ' GLU . 25.4 t -66.47 -51.03 62.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 171.593 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.553 ' O ' ' HB ' ' A' ' 980' ' ' THR . 20.3 tp -128.75 90.05 47.29 Favored Pre-proline 0 N--CA 1.45 -0.465 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 173.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -87.49 -154.96 0.05 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.995 2.464 . . . . 0.0 114.104 -169.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . 68.04 -93.68 0.03 OUTLIER 'General case' 0 C--O 1.231 0.124 0 CA-C-N 114.896 -1.047 . . . . 0.0 111.815 178.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.487 ' O ' ' HG2' ' A' ' 982' ' ' ARG . 19.7 m -99.45 -34.72 10.16 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.606 -173.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.553 ' HB ' ' O ' ' A' ' 976' ' ' LEU . 54.6 m -62.58 -18.92 63.12 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 121.936 0.874 . . . . 0.0 109.366 175.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.634 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 2.8 t60 -56.9 -35.09 68.58 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 114.187 -1.37 . . . . 0.0 111.427 178.486 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . 0.487 ' HG2' ' O ' ' A' ' 979' ' ' SER . 6.0 ptp180 -84.54 -19.46 33.15 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -174.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.633 ' HG3' HG13 ' A' 1038 ' ' VAL . 0.4 OUTLIER -75.55 -33.98 60.71 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 121.903 0.859 . . . . 0.0 108.785 171.542 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 1.073 HG23 HG12 ' A' ' 969' ' ' VAL . 62.1 mt -72.95 -29.24 28.57 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.893 0 CA-C-N 114.219 -1.355 . . . . 0.0 109.596 177.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . 0.634 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 57.6 mt-10 -63.27 -47.87 80.55 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.512 0.672 . . . . 0.0 109.844 172.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . 0.511 ' HG2' HD13 ' A' ' 990' ' ' LEU . 54.0 ttm -71.64 -47.38 54.79 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.88 -172.39 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.861 ' HA ' ' HG ' ' A' 1035 ' ' LEU . . . -61.1 -50.61 72.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.929 -1.032 . . . . 0.0 111.785 -175.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.823 HE22 ' HB2' ' A' ' 970' ' ' ASP . 53.4 mt-30 -56.99 -30.67 64.34 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.0 0.429 . . . . 0.0 110.696 177.056 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . 0.733 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 1.9 ttmt -79.09 -40.33 31.44 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 -178.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.511 HD13 ' HG2' ' A' ' 986' ' ' MET . 3.1 mp -60.33 -54.05 50.29 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 119.552 -0.859 . . . . 0.0 112.867 -178.119 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.743 HD23 HD22 ' A' ' 965' ' ' LEU . 11.7 tp -65.64 -26.44 67.81 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.061 -0.656 . . . . 0.0 109.401 177.225 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . 0.733 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 23.8 t-20 -52.97 -57.74 9.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.632 178.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 13.4 m -80.42 -36.3 33.91 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -175.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.43 -36.7 84.71 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 119.386 -0.926 . . . . 0.0 111.268 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 0.689 ' N ' HD21 ' A' 1028 ' ' LEU . 2.3 tm? -68.16 -24.79 65.02 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.308 171.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -71.61 -28.7 63.98 Favored 'General case' 0 C--N 1.316 -0.86 0 C-N-CA 119.283 -0.967 . . . . 0.0 109.978 170.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -76.26 -37.66 57.3 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 110.415 -0.217 . . . . 0.0 110.415 173.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.889 HD12 ' HB2' ' A' 1025 ' ' ALA . 1.1 tt -56.6 -46.77 80.68 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.293 0.568 . . . . 0.0 110.855 178.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.511 ' N ' HD23 ' A' ' 998' ' ' LEU . 84.7 mt -65.95 -46.76 87.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.722 -172.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -56.38 -40.28 74.32 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.333 0.587 . . . . 0.0 111.552 -177.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.688 ' HD3' ' HG2' ' A' 1020 ' ' GLN . 96.8 mttt -84.88 -33.92 22.7 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.79 -173.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.68 ' SD ' ' HE3' ' A' 1018 ' ' LYS . 5.3 ttp -62.4 -30.31 71.12 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 122.351 1.072 . . . . 0.0 108.574 173.267 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.504 ' O ' ' HG3' ' A' 1006 ' ' GLN . 3.8 tptm -67.38 -53.03 32.94 Favored 'General case' 0 N--CA 1.439 -0.975 0 CA-C-N 113.777 -1.556 . . . . 0.0 110.491 -171.001 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.69 ' HB3' HD23 ' A' 1013 ' ' LEU . 8.4 mp -69.95 -16.65 63.24 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.815 -179.356 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.719 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -70.98 -39.45 72.47 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 119.344 -0.942 . . . . 0.0 110.219 -178.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.887 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.4 pp0? -74.75 -32.95 62.23 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 120.384 -0.526 . . . . 0.0 111.328 167.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.627 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 28.5 mt-30 -50.92 -44.51 60.13 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.258 0.551 . . . . 0.0 110.379 176.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.739 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 49.7 m-85 -122.2 41.1 3.49 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.561 172.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 1.052 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 14.9 p -50.52 -21.18 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.646 171.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . 0.501 ' O ' HG23 ' A' 1011 ' ' THR . 97.0 mmm -38.7 -50.32 1.63 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.33 -1.304 . . . . 0.0 111.381 172.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . 0.501 HG23 ' O ' ' A' 1010 ' ' MET . 0.7 OUTLIER -163.68 -86.15 0.02 OUTLIER 'General case' 0 C--O 1.246 0.897 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 179.369 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 42.5 t -54.02 -67.46 0.26 Allowed 'General case' 0 C--O 1.238 0.474 0 CA-C-N 114.786 -1.097 . . . . 0.0 112.605 -166.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.739 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 6.8 mp -50.09 -42.39 50.13 Favored 'General case' 0 CA--C 1.5 -0.967 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 -179.189 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 1.052 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -53.47 -48.53 68.79 Favored 'General case' 0 N--CA 1.442 -0.827 0 O-C-N 123.65 0.594 . . . . 0.0 111.222 -166.866 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 27.0 pt20 -74.45 -45.56 45.49 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.262 -176.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -66.53 -53.14 38.16 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.495 0.664 . . . . 0.0 110.751 -178.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.719 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 15.9 m-85 -62.93 -37.63 87.8 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 114.628 -1.169 . . . . 0.0 113.37 -174.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.68 ' HE3' ' SD ' ' A' 1002 ' ' MET . 17.3 tptm -81.54 -29.1 33.62 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.988 -177.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . 0.433 ' O ' HD23 ' A' 1022 ' ' LEU . 4.5 mptp? -74.27 -51.74 14.41 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 174.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . 0.688 ' HG2' ' HD3' ' A' 1001 ' ' LYS . 10.5 tt0 -51.02 -34.47 29.62 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.07 163.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.635 ' HE2' ' HE2' ' A' 1018 ' ' LYS . 9.9 tmm? -62.87 -50.55 70.47 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 174.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . 0.89 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -80.11 -2.83 46.21 Favored 'General case' 0 C--O 1.221 -0.445 0 C-N-CA 119.276 -0.97 . . . . 0.0 109.858 -176.811 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 88.5 m -84.57 -39.56 18.59 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 171.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.514 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.21 -21.16 50.44 Favored 'General case' 0 C--O 1.22 -0.486 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 172.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.909 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -85.03 -25.11 27.86 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.137 170.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.582 ' O ' HG23 ' A' 1030 ' ' VAL . 61.0 t60 -75.78 -23.91 55.95 Favored 'General case' 0 C--O 1.217 -0.61 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 164.365 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -71.01 -39.98 72.09 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 123.057 0.543 . . . . 0.0 109.8 164.118 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.697 HD12 HD13 ' A' ' 998' ' ' LEU . 15.0 mt -62.47 -44.7 95.77 Favored 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.104 170.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -60.01 -36.43 77.19 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 111.286 0.106 . . . . 0.0 111.286 173.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.582 HG23 ' O ' ' A' 1026 ' ' HIS . 8.8 t -70.35 -50.81 43.4 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 CA-C-O 121.506 0.67 . . . . 0.0 109.795 -179.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -71.16 -42.35 69.23 Favored 'General case' 0 C--O 1.208 -1.101 0 CA-C-N 114.784 -1.098 . . . . 0.0 111.483 -175.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.787 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -66.8 -32.64 74.06 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.668 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 65.4 tttp -64.37 -49.82 70.12 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.747 0.784 . . . . 0.0 110.116 170.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.471 ' O ' HG23 ' A' 1038 ' ' VAL . 59.9 t30 -72.28 -38.74 68.72 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 114.826 -1.079 . . . . 0.0 112.018 -173.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.861 ' HG ' ' HA ' ' A' ' 987' ' ' ALA . 0.0 OUTLIER -64.83 -40.5 95.29 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 119.215 -0.421 . . . . 0.0 110.817 -177.498 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.551 ' HB3' HG22 ' A' ' 925' ' ' VAL . 4.2 pp -67.8 -39.57 84.0 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 117.232 -1.787 . . . . 0.0 110.177 174.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.08 -39.26 59.47 Favored 'General case' 0 C--N 1.344 0.328 0 CA-C-O 121.725 0.774 . . . . 0.0 110.207 172.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.633 HG13 ' HG3' ' A' ' 983' ' ' GLU . 12.3 t -57.91 -46.35 87.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 114.321 -1.309 . . . . 0.0 111.841 176.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.602 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 2.4 mp -73.91 -27.62 22.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 118.329 0.513 . . . . 0.0 111.484 174.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.526 ' HB3' HG23 ' A' ' 919' ' ' ILE . 4.3 m-20 -64.45 -46.96 80.87 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.332 170.662 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.861 ' HA ' HG13 ' A' ' 919' ' ' ILE . 45.7 mt-30 -60.47 -46.09 91.34 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 172.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.602 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -55.49 -51.4 67.09 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.58 -175.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.519 ' HG2' ' O ' ' A' 1039 ' ' ILE . 4.8 ptp85 -62.07 -34.73 76.82 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.034 -173.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . . . . . . . . . 12.9 mt -83.47 -42.21 17.16 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 119.201 -1.0 . . . . 0.0 111.635 174.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.43 ' O ' ' HB2' ' A' 1049 ' ' GLN . 24.9 ttpp -55.13 -34.62 63.89 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.218 0.532 . . . . 0.0 111.294 -177.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.636 ' O ' ' HB3' ' A' 1050 ' ' SER . 18.2 mmt -86.57 -39.11 16.49 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 177.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.735 HG22 ' HA ' ' A' 1053 ' ' HIS . 3.7 mm -96.0 -46.8 13.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 O-C-N 121.77 -0.581 . . . . 0.0 111.603 -174.213 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 56.4 m -63.36 -6.71 5.07 Favored 'General case' 0 C--N 1.316 -0.851 0 O-C-N 121.202 -0.936 . . . . 0.0 111.626 177.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . 0.616 ' HA ' HE21 ' A' 1049 ' ' GLN . 0.1 OUTLIER -128.54 -70.39 0.68 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.256 -0.429 . . . . 0.0 112.056 -169.296 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . 0.636 ' HB3' ' O ' ' A' 1046 ' ' MET . 36.0 t -58.55 -61.86 2.28 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.871 0.367 . . . . 0.0 111.024 -179.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . 0.423 ' HA ' ' HD2' ' A' 1052 ' ' PRO . 78.5 mtp180 -132.83 104.83 12.81 Favored Pre-proline 0 C--N 1.326 -0.434 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 178.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . 0.423 ' HD2' ' HA ' ' A' 1051 ' ' ARG . 26.7 Cg_exo -21.3 130.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.855 1 C-N-CA 126.439 4.76 . . . . 0.0 116.818 -172.374 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . 0.735 ' HA ' HG22 ' A' 1047 ' ' ILE . 54.0 t-80 . . . . . 0 C--N 1.337 0.047 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.441 -179.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.767 0 N-CA-C 112.303 -0.319 . . . . 0.0 112.303 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 15.9 t -87.09 139.53 32.47 Favored Pre-proline 0 C--N 1.323 -0.566 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 178.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.44 163.28 39.38 Favored 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 122.429 2.086 . . . . 0.0 112.063 178.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -90.46 95.36 2.08 Favored Glycine 0 N--CA 1.444 -0.774 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 177.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 912' ' ' ILE . . . . . 0.679 HG13 ' H ' ' A' ' 913' ' ' SER . 13.6 pt 41.46 -99.46 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 124.046 0.938 . . . . 0.0 112.726 -175.728 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 913' ' ' SER . . . . . 0.679 ' H ' HG13 ' A' ' 912' ' ' ILE . 14.6 t -123.51 141.35 52.09 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 -178.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 101.29 4.2 53.47 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.267 -178.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 79.46 -72.43 2.53 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 121.136 -0.554 . . . . 0.0 112.5 178.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . -161.84 87.74 0.11 Allowed Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 121.198 -0.525 . . . . 0.0 111.838 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . -89.61 71.02 2.3 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.223 -179.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . 0.706 ' HA3' ' HB2' ' A' 1044 ' ' LEU . . . -61.92 -52.19 51.98 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.811 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 919' ' ' ILE . . . . . 0.462 ' HB ' ' HB3' ' A' 1040 ' ' ASP . 0.0 OUTLIER -65.85 130.1 30.8 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.706 0 CA-C-O 121.269 0.556 . . . . 0.0 110.195 176.629 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . . . . . . . . . 36.6 mmm-85 -115.04 -36.26 4.47 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.729 -169.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 50.3 m 60.69 30.94 20.05 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.637 -174.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -126.12 96.25 4.67 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.518 -1.219 . . . . 0.0 108.377 178.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.576 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 2.6 p30 -166.63 150.02 7.0 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 123.195 1.474 . . . . 0.0 114.344 -168.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.821 ' HB3' HG21 ' A' ' 968' ' ' THR . 14.0 tppt? -58.22 -26.98 63.51 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 113.312 -1.767 . . . . 0.0 112.651 170.113 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.624 HG12 HD12 ' A' ' 965' ' ' LEU . 3.6 t -64.29 -43.36 97.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-N 118.79 0.723 . . . . 0.0 111.274 -172.726 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.576 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.2 OUTLIER -78.69 -19.06 53.36 Favored 'General case' 0 CA--C 1.502 -0.89 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.845 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -76.66 -23.32 53.25 Favored 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 119.64 -0.824 . . . . 0.0 111.147 168.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.451 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 8.2 m120 -74.74 -27.53 60.4 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 168.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.668 HG22 ' HB1' ' A' 1032 ' ' ALA . 60.0 t -77.51 -30.95 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.258 176.224 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . . . . . . . . . 27.9 m -60.32 -41.36 93.35 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 171.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -68.72 -54.05 17.0 Favored Glycine 0 CA--C 1.526 0.761 0 CA-C-N 114.996 -1.002 . . . . 0.0 113.621 176.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.553 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.2 pp -63.44 -49.33 74.12 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -175.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 63.5 t -65.62 -36.84 78.56 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-O 121.112 0.482 . . . . 0.0 110.883 -175.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.651 ' O ' ' HB2' ' A' ' 938' ' ' GLU . 4.3 ttpm? -58.92 -46.58 87.58 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.178 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -55.3 -41.63 72.61 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 111.545 0.202 . . . . 0.0 111.545 176.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.771 HG22 ' HB1' ' A' 1025 ' ' ALA . 61.9 t -49.21 -75.49 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 123.206 0.603 . . . . 0.0 112.448 -177.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.425 HG13 ' N ' ' A' ' 938' ' ' GLU . 35.4 pt -74.3 -42.03 50.6 Favored 'Isoleucine or valine' 0 C--O 1.245 0.836 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -175.123 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.651 ' HB2' ' O ' ' A' ' 934' ' ' LYS . 25.4 mm-40 -60.86 -51.29 69.94 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.907 0.384 . . . . 0.0 110.529 -174.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.651 ' HB3' ' OE1' ' A' ' 950' ' ' GLU . 65.4 mtt -74.16 -26.52 60.35 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.861 -178.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.629 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 53.3 p -52.05 -48.15 64.75 Favored 'General case' 0 CA--C 1.52 -0.202 0 O-C-N 123.705 0.628 . . . . 0.0 111.672 -170.142 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 23.3 t -116.27 -23.07 8.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.606 -173.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.599 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 0.4 OUTLIER -83.63 -46.42 12.37 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 119.787 -0.765 . . . . 0.0 111.304 -173.245 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.638 HG12 ' HA ' ' A' ' 939' ' ' MET . 44.8 mm -70.89 -23.49 23.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . . . . . . . . . 2.8 mm100 -61.73 -35.78 25.17 Favored Pre-proline 0 CA--C 1.544 0.75 0 N-CA-C 115.236 1.569 . . . . 0.0 115.236 -172.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.599 ' HD2' ' O ' ' A' ' 942' ' ' LYS . 76.5 Cg_exo -55.12 -23.18 34.85 Favored 'Trans proline' 0 C--N 1.353 0.784 0 C-N-CA 121.771 1.647 . . . . 0.0 112.905 170.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.785 ' HB1' ' HD2' ' A' ' 947' ' ' PRO . . . -92.79 -178.98 0.95 Allowed Pre-proline 0 C--N 1.326 -0.446 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 178.336 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.785 ' HD2' ' HB1' ' A' ' 946' ' ' ALA . 64.8 Cg_exo -40.85 113.6 0.24 Allowed 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 122.696 2.264 . . . . 0.0 112.549 173.378 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.649 ' HB2' HG21 ' A' 1009 ' ' VAL . 81.8 Cg_endo -83.13 -156.63 0.07 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.646 0 C-N-CA 123.183 2.589 . . . . 0.0 113.922 -170.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.864 ' HB3' ' HB2' ' A' 1006 ' ' GLN . 2.3 mt-10 61.47 10.63 3.3 Favored 'General case' 0 CA--C 1.494 -1.191 0 CA-C-N 114.403 -1.271 . . . . 0.0 109.714 -169.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.714 ' O ' ' HB3' ' A' ' 954' ' ' MET . 0.6 OUTLIER -61.41 0.27 0.31 Allowed 'General case' 0 C--O 1.209 -1.06 0 O-C-N 123.815 0.697 . . . . 0.0 111.972 -170.337 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.659 ' CD1' ' HD3' ' A' 1018 ' ' LYS . 0.1 OUTLIER -68.62 -34.91 76.58 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 123.56 0.744 . . . . 0.0 110.031 177.021 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 0.998 HG23 ' HD3' ' A' ' 953' ' ' PRO . 0.9 OUTLIER -82.62 -39.22 0.83 Allowed Pre-proline 0 N--CA 1.453 -0.281 0 CA-C-O 119.219 -0.42 . . . . 0.0 111.415 176.175 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 0.998 ' HD3' HG23 ' A' ' 952' ' ' VAL . 35.8 Cg_exo -49.84 -42.15 45.05 Favored 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 121.417 1.412 . . . . 0.0 110.729 161.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.714 ' HB3' ' O ' ' A' ' 950' ' ' GLU . 2.5 ttm -70.4 -28.96 65.49 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 113.831 -1.531 . . . . 0.0 111.846 177.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.88 HG23 ' HA ' ' A' ' 952' ' ' VAL . 76.0 t -53.39 -40.34 39.91 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 173.037 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.404 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 8.9 tmtt? -68.45 -33.17 73.72 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 114.973 -1.012 . . . . 0.0 111.723 173.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . 0.419 ' HB2' ' HA ' ' A' ' 954' ' ' MET . 6.9 mm-40 -78.35 -47.63 17.3 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -176.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.607 HG23 ' HG3' ' A' ' 954' ' ' MET . 2.7 t -84.54 -34.92 9.9 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.011 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 -178.143 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -59.8 -39.53 95.49 Favored Glycine 0 N--CA 1.434 -1.453 0 N-CA-C 110.636 -0.986 . . . . 0.0 110.636 178.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . 0.547 ' O ' ' HG2' ' A' ' 963' ' ' ARG . 9.1 tt -68.13 -36.17 79.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.348 -0.426 . . . . 0.0 110.626 175.276 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -76.25 -60.23 2.42 Favored 'General case' 0 C--N 1.321 -0.65 0 O-C-N 122.093 -0.379 . . . . 0.0 110.952 -174.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 1.108 HD13 HD22 ' A' ' 995' ' ' LEU . 3.4 pp -53.54 -34.13 57.11 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 112.435 0.531 . . . . 0.0 112.435 173.153 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.547 ' HG2' ' O ' ' A' ' 960' ' ' LEU . 3.7 ptm180 -71.83 -39.98 69.39 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 119.949 1.25 . . . . 0.0 111.166 174.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 38.3 m -61.24 -38.82 88.05 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 174.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.667 HD11 HD21 ' A' 1035 ' ' LEU . 0.3 OUTLIER -55.97 -54.72 41.42 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.66 174.738 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.667 ' HG ' HE21 ' A' ' 988' ' ' GLN . 5.2 tt -69.52 -34.68 74.62 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.164 -172.572 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . 0.418 ' O ' ' HB2' ' A' ' 971' ' ' GLU . . . -71.8 -29.16 64.15 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.807 178.108 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.821 HG21 ' HB3' ' A' ' 924' ' ' LYS . 23.7 m -71.99 -32.9 67.68 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 118.824 0.738 . . . . 0.0 109.79 172.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 1.003 HG12 HG23 ' A' ' 984' ' ' ILE . 24.3 t -70.24 -40.8 78.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.424 171.404 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.916 ' HB2' HE22 ' A' ' 988' ' ' GLN . 16.4 t70 -65.58 -42.1 92.13 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 122.301 1.048 . . . . 0.0 108.864 179.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.525 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 37.6 tt0 -62.16 -37.6 85.85 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 113.54 -1.664 . . . . 0.0 109.867 177.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 63.7 m -67.1 -18.76 65.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.085 176.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.63 ' HG ' ' HB2' ' A' ' 981' ' ' HIS . 9.4 tt -68.69 -51.74 20.56 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.648 -172.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.549 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 95.7 Cg_endo -84.37 -7.35 9.91 Favored 'Trans proline' 0 C--N 1.354 0.821 0 CA-C-N 119.883 0.994 . . . . 0.0 112.878 174.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 971' ' ' GLU . 75.3 t -74.96 -42.95 46.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 C-N-CA 120.226 -0.59 . . . . 0.0 109.419 170.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.452 HD22 HG21 ' A' ' 980' ' ' THR . 4.7 mp -115.63 83.93 11.85 Favored Pre-proline 0 C--O 1.233 0.197 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 174.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_exo -72.28 -7.08 20.31 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.166 2.578 . . . . 0.0 113.307 -172.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . 0.551 ' HB3' ' SD ' ' A' 1046 ' ' MET . . . -83.94 -159.11 0.36 Allowed 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 110.089 -0.338 . . . . 0.0 110.089 178.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.567 ' O ' ' HG2' ' A' ' 982' ' ' ARG . 18.4 m -37.67 -36.35 0.17 Allowed 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 114.163 1.172 . . . . 0.0 114.163 -177.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.867 ' HA ' ' HB1' ' A' 1042 ' ' ALA . 89.4 m -53.89 -36.36 62.6 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 117.879 0.308 . . . . 0.0 111.703 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.63 ' HB2' ' HG ' ' A' ' 973' ' ' LEU . 0.5 OUTLIER -62.66 -33.81 75.8 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.961 -175.729 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . 0.567 ' HG2' ' O ' ' A' ' 979' ' ' SER . 9.3 ptm180 -85.4 -19.82 30.77 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 121.046 -0.261 . . . . 0.0 111.046 -178.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.67 -34.48 69.75 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 166.256 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 1.003 HG23 HG12 ' A' ' 969' ' ' VAL . 44.9 mt -69.9 -33.01 53.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.637 176.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . 0.53 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 50.5 mt-10 -57.96 -49.81 75.53 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.559 175.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 50.9 ttp -72.83 -42.49 63.74 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 114.9 -1.046 . . . . 0.0 110.755 -175.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.809 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -68.21 -50.27 55.25 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 114.898 -1.046 . . . . 0.0 112.279 -172.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.916 HE22 ' HB2' ' A' ' 970' ' ' ASP . 48.7 mt-30 -54.39 -43.73 71.67 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 176.2 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . 0.708 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 0.0 OUTLIER -63.52 -42.15 98.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.046 177.88 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 26.3 tp -51.86 -59.32 4.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.033 -0.53 . . . . 0.0 112.324 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.452 ' HA ' HD22 ' A' ' 991' ' ' LEU . 0.7 OUTLIER -63.43 -35.5 80.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.709 0.766 . . . . 0.0 108.936 178.143 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . 0.708 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 25.5 t-20 -50.37 -55.39 15.86 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 113.82 -1.536 . . . . 0.0 112.749 -176.661 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 5.5 m -77.86 -30.03 50.69 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.31 -0.556 . . . . 0.0 111.99 -178.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . 0.436 ' O ' ' HB3' ' A' ' 997' ' ' GLU . 0.1 OUTLIER -73.75 -33.79 64.46 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 118.877 -1.129 . . . . 0.0 111.667 179.826 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 1.108 HD22 HD13 ' A' ' 962' ' ' LEU . 1.9 pp -68.02 -19.12 64.88 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 169.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -78.21 -23.93 47.31 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 119.414 -0.914 . . . . 0.0 110.133 169.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.436 ' HB3' ' O ' ' A' ' 994' ' ' ASP . 6.9 tp10 -74.23 -43.96 55.04 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.976 -0.749 . . . . 0.0 108.976 171.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.715 HD13 ' HB2' ' A' 1025 ' ' ALA . 7.5 tp -56.91 -48.06 79.09 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.266 -179.371 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.874 ' HA ' ' SD ' ' A' 1002 ' ' MET . 67.5 mt -68.76 -38.08 78.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.828 -171.278 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 25.8 m-80 -62.76 -35.41 79.72 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.63 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.486 ' HA ' ' HD1' ' A' 1017 ' ' TYR . 0.7 OUTLIER -85.4 -39.84 17.13 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.293 0.568 . . . . 0.0 110.816 -175.469 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.874 ' SD ' ' HA ' ' A' ' 999' ' ' ILE . 8.2 ptm -62.29 -27.08 68.77 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 122.255 1.026 . . . . 0.0 108.653 177.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.671 ' O ' ' HG3' ' A' 1006 ' ' GLN . 19.9 tptt -73.92 -54.04 8.81 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 114.158 -1.383 . . . . 0.0 110.575 -171.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.549 ' HA ' ' HB2' ' A' 1007 ' ' GLN . 6.4 mt -69.54 -12.52 61.72 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.004 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.749 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -75.73 -38.7 58.27 Favored 'General case' 0 C--O 1.213 -0.838 0 C-N-CA 119.296 -0.962 . . . . 0.0 108.594 -178.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.967 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 1.3 pp0? -74.33 -36.7 63.66 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.764 -0.375 . . . . 0.0 111.126 170.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.549 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 33.9 mt-30 -49.26 -43.32 42.86 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.034 0.445 . . . . 0.0 111.289 178.599 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.658 ' HB2' ' HG ' ' A' 1013 ' ' LEU . 49.4 m-85 -126.04 44.74 2.78 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.313 0.578 . . . . 0.0 110.839 169.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 1.013 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 7.9 p -53.17 -20.21 2.57 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.409 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.63 171.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . 0.462 ' O ' HG23 ' A' 1011 ' ' THR . 60.2 mtm -48.42 -40.59 26.51 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.162 -1.381 . . . . 0.0 111.915 174.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . 0.462 HG23 ' O ' ' A' 1010 ' ' MET . 1.0 OUTLIER -160.66 -94.18 0.02 OUTLIER 'General case' 0 C--O 1.248 0.998 0 N-CA-C 114.237 1.199 . . . . 0.0 114.237 -179.344 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 4.6 m -59.12 -62.65 1.72 Allowed 'General case' 0 C--O 1.24 0.555 0 CA-C-N 114.517 -1.22 . . . . 0.0 113.121 -162.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.701 HD22 ' HE2' ' A' 1017 ' ' TYR . 14.6 mt -53.57 -37.38 62.86 Favored 'General case' 0 CA--C 1.498 -1.044 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.735 -178.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 1.013 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -53.78 -54.56 36.46 Favored 'General case' 0 N--CA 1.441 -0.919 0 O-C-N 123.867 0.729 . . . . 0.0 110.817 -166.693 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -70.57 -42.45 71.07 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.82 -175.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -67.0 -53.76 28.26 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.555 0.693 . . . . 0.0 111.149 -179.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.749 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 12.0 m-85 -62.56 -34.34 76.77 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 113.823 1.045 . . . . 0.0 113.823 -176.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.659 ' HD3' ' CD1' ' A' ' 951' ' ' TYR . 54.1 tptt -79.05 -31.38 44.51 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 114.92 -1.036 . . . . 0.0 110.247 -176.122 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -71.81 -42.51 66.96 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 175.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -56.16 -36.25 68.1 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.539 163.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.597 ' HB3' ' HA ' ' A' 1018 ' ' LYS . 0.0 OUTLIER -66.82 -51.74 52.0 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.377 0.132 . . . . 0.0 110.834 -177.032 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . 0.417 ' O ' ' HG ' ' A' 1022 ' ' LEU . 0.0 OUTLIER -78.09 -13.48 59.85 Favored 'General case' 0 C--O 1.218 -0.558 0 C-N-CA 119.595 -0.842 . . . . 0.0 109.955 -176.036 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . 0.499 ' HA ' ' HB3' ' A' 1026 ' ' HIS . 87.5 m -88.44 -32.75 18.14 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.671 177.093 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.499 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.28 -23.36 47.24 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 171.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.771 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -86.21 -21.67 27.34 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.255 169.307 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.636 ' O ' HG23 ' A' 1030 ' ' VAL . 84.9 t60 -76.38 -27.07 56.22 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 165.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -68.98 -41.51 77.78 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 123.806 0.842 . . . . 0.0 109.957 163.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.623 HD21 ' N ' ' A' ' 995' ' ' LEU . 12.3 mt -61.23 -39.95 92.18 Favored 'General case' 0 C--N 1.313 -0.98 0 C-N-CA 119.989 -0.684 . . . . 0.0 109.666 170.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -60.96 -37.34 82.05 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.484 0.183 . . . . 0.0 110.973 171.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.636 HG23 ' O ' ' A' 1026 ' ' HIS . 18.1 t -69.28 -50.45 52.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 121.746 0.784 . . . . 0.0 110.109 -178.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -74.18 -32.83 63.25 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-N 114.445 -1.252 . . . . 0.0 111.024 -174.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.874 ' HA ' HD22 ' A' 1035 ' ' LEU . . . -71.39 -32.36 68.35 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 173.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -63.73 -43.89 95.17 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.661 0.743 . . . . 0.0 109.363 171.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.439 ' O ' ' HB3' ' A' 1037 ' ' ASP . 48.3 t30 -79.22 -49.25 12.81 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 114.865 -1.061 . . . . 0.0 112.364 -173.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.874 HD22 ' HA ' ' A' 1032 ' ' ALA . 0.2 OUTLIER -60.33 -39.7 88.01 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 118.012 0.369 . . . . 0.0 110.662 -174.422 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.511 ' H ' HD23 ' A' 1035 ' ' LEU . 2.5 tm? -68.83 -43.19 76.02 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 117.998 -1.481 . . . . 0.0 108.87 178.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.439 ' HB3' ' O ' ' A' 1034 ' ' ASN . 27.8 t70 -52.6 -41.76 63.95 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.457 174.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.474 ' HB ' ' O ' ' A' 1035 ' ' LEU . 24.6 t -56.41 -41.38 71.71 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.694 0 CA-C-N 114.182 -1.372 . . . . 0.0 111.706 174.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.657 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 1.6 mp -81.16 -28.63 10.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 118.215 0.461 . . . . 0.0 111.282 177.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.462 ' HB3' ' HB ' ' A' ' 919' ' ' ILE . 0.1 OUTLIER -59.23 -48.6 81.01 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 168.889 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -70.76 -33.43 70.78 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.53 175.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.867 ' HB1' ' HA ' ' A' ' 980' ' ' THR . . . -55.37 -50.22 70.27 Favored 'General case' 0 CA--C 1.512 -0.511 0 C-N-CA 123.384 0.673 . . . . 0.0 112.422 178.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.591 ' HG2' ' O ' ' A' 1039 ' ' ILE . 4.0 ptp85 -64.58 -34.87 79.28 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.911 -0.404 . . . . 0.0 109.911 -177.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.706 ' HB2' ' HA3' ' A' ' 918' ' ' GLY . 51.7 tp -72.31 -30.91 65.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.102 0.477 . . . . 0.0 110.61 173.16 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . . . . . . . . . 4.5 tmtm? -71.76 -37.92 70.43 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.055 -174.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.551 ' SD ' ' HB3' ' A' ' 978' ' ' ALA . 1.2 ptm -73.09 -30.52 63.73 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.834 172.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.465 HG12 ' O ' ' A' 1043 ' ' ARG . 34.5 mm -73.65 -42.2 55.13 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 118.608 0.64 . . . . 0.0 110.381 179.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 68.9 p -72.38 -5.42 36.27 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.362 178.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . 0.458 ' HB3' ' O ' ' A' 1046 ' ' MET . 41.9 tp60 -86.23 -77.37 0.31 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.221 -0.9 . . . . 0.0 111.543 -177.368 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . 0.406 ' OG ' ' HG3' ' A' 1049 ' ' GLN . 36.9 p 176.5 -46.62 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.853 -172.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . 0.451 ' HA ' ' HD3' ' A' 1052 ' ' PRO . 54.6 ttt180 -85.82 103.09 3.21 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.295 178.36 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' 1051 ' ' ARG . 4.1 Cg_exo -79.27 -171.74 1.33 Allowed 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 122.801 2.334 . . . . 0.0 113.486 -169.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 51.6 t-80 . . . . . 0 C--N 1.326 -0.424 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.172 -177.662 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.701 0 N-CA-C 111.842 -0.503 . . . . 0.0 111.842 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 909' ' ' SER . . . . . 0.477 ' HA ' ' HD3' ' A' ' 910' ' ' PRO . 34.8 t -95.68 138.64 21.76 Favored Pre-proline 0 C--N 1.321 -0.643 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 179.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 910' ' ' PRO . . . . . 0.477 ' HD3' ' HA ' ' A' ' 909' ' ' SER . 17.2 Cg_exo -67.8 81.03 0.47 Allowed 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.915 2.41 . . . . 0.0 112.284 178.37 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -147.44 26.04 1.53 Allowed Glycine 0 N--CA 1.447 -0.585 0 N-CA-C 111.228 -0.749 . . . . 0.0 111.228 177.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 60.0 mt -92.98 92.1 3.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.208 0.528 . . . . 0.0 110.015 -177.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 6.0 p -91.25 -25.56 19.43 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.031 -179.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 98.58 -0.3 58.1 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.904 -0.665 . . . . 0.0 111.909 -177.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 915' ' ' GLY . . . . . 0.463 ' HA3' ' NH2' ' A' ' 920' ' ' ARG . . . 83.32 -82.91 1.64 Allowed Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 121.098 -0.572 . . . . 0.0 112.152 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . 171.42 -61.0 0.17 Allowed Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 121.1 -0.571 . . . . 0.0 111.866 179.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . -154.37 -155.38 7.22 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.074 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . 0.6 ' CA ' ' HB2' ' A' 1044 ' ' LEU . . . 76.52 136.23 0.68 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 121.276 -0.488 . . . . 0.0 112.868 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 919' ' ' ILE . . . . . 0.444 ' HB ' ' HB3' ' A' 1040 ' ' ASP . 0.1 OUTLIER -79.21 117.05 24.18 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.39 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 171.565 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.463 ' NH2' ' HA3' ' A' ' 915' ' ' GLY . 81.5 mtt180 -97.24 -11.02 24.67 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.758 -172.35 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . 0.451 ' O ' ' HB2' ' A' ' 922' ' ' ASN . 32.3 t 69.24 114.67 0.04 OUTLIER 'General case' 0 CA--C 1.513 -0.445 0 O-C-N 124.034 0.834 . . . . 0.0 109.777 -177.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.658 ' O ' ' HB2' ' A' ' 923' ' ' ASP . 13.9 m120 73.61 -167.55 0.11 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.662 -1.154 . . . . 0.0 109.733 -174.083 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.784 ' HB3' HG22 ' A' ' 925' ' ' VAL . 3.5 t70 145.82 -177.83 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 -167.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.462 ' HA ' ' HD2' ' A' ' 924' ' ' LYS . 0.3 OUTLIER -57.95 -29.47 65.21 Favored 'General case' 0 C--N 1.317 -0.808 0 O-C-N 121.685 -0.634 . . . . 0.0 110.138 174.328 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.784 HG22 ' HB3' ' A' ' 923' ' ' ASP . 20.0 m -60.42 -29.22 43.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.318 0.58 . . . . 0.0 110.744 175.221 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.712 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -73.79 -35.16 64.9 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.004 -0.544 . . . . 0.0 112.205 179.381 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . 0.843 ' HA ' ' HB ' ' A' ' 930' ' ' THR . 12.1 pt-20 -76.26 -22.71 54.79 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 119.566 1.075 . . . . 0.0 110.736 179.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.416 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 1.4 m120 -71.81 -30.3 65.35 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 174.306 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.661 HG22 ' HB1' ' A' 1032 ' ' ALA . 75.6 t -80.53 -32.5 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.297 0 CA-C-N 114.593 -1.185 . . . . 0.0 109.556 172.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.843 ' HB ' ' HA ' ' A' ' 927' ' ' GLU . 1.2 m -54.4 -44.72 72.59 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 167.137 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -68.35 -53.2 22.59 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-N 115.006 -0.997 . . . . 0.0 114.008 175.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.574 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.0 pp -64.68 -48.32 75.18 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 117.518 0.659 . . . . 0.0 112.772 -175.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 49.7 t -66.64 -36.69 77.88 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.394 0 CA-C-O 121.04 0.448 . . . . 0.0 110.925 -174.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.41 ' HE2' ' HB3' ' A' ' 934' ' ' LYS . 22.0 ttpt -60.09 -41.98 93.65 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.303 179.046 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -62.46 -32.1 72.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.554 0.216 . . . . 0.0 111.543 176.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.814 HG22 ' HB1' ' A' 1025 ' ' ALA . 98.6 t -58.6 -75.83 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -177.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 27.4 pt -73.35 -39.45 55.38 Favored 'Isoleucine or valine' 0 C--O 1.239 0.516 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -173.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -63.09 -51.9 64.79 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.686 0.755 . . . . 0.0 109.809 -174.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.817 ' HA ' ' HG3' ' A' ' 942' ' ' LYS . 21.6 mmt -73.32 -26.59 61.11 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.877 -177.383 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.662 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 25.7 p -52.74 -41.38 63.94 Favored 'General case' 0 CA--C 1.519 -0.247 0 O-C-N 123.746 0.654 . . . . 0.0 111.458 -173.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 45.0 m -99.43 -20.52 16.42 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.95 -175.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.817 ' HG3' ' HA ' ' A' ' 939' ' ' MET . 0.0 OUTLIER -82.4 -8.22 59.63 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 119.133 -1.027 . . . . 0.0 109.958 -178.996 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.932 HG22 ' HB2' ' A' ' 949' ' ' GLU . 41.0 pt -45.05 -53.15 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 O-C-N 123.515 0.509 . . . . 0.0 111.492 170.013 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.659 ' N ' HG13 ' A' ' 943' ' ' ILE . 27.7 mm-40 67.34 147.66 0.11 Allowed Pre-proline 0 CA--C 1.534 0.363 0 O-C-N 123.727 0.642 . . . . 0.0 111.256 -174.341 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 944' ' ' GLN . 8.1 Cg_exo -73.7 60.59 4.38 Favored 'Trans proline' 0 CA--C 1.531 0.371 0 C-N-CA 122.873 2.382 . . . . 0.0 113.076 -177.152 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.883 ' HB3' ' HD3' ' A' ' 947' ' ' PRO . . . -167.98 -58.17 0.01 OUTLIER Pre-proline 0 CA--C 1.537 0.469 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.523 176.044 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.883 ' HD3' ' HB3' ' A' ' 946' ' ' ALA . 3.5 Cg_exo -79.11 129.74 8.97 Favored 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 122.451 2.101 . . . . 0.0 111.612 174.191 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.429 ' HB3' HG21 ' A' 1009 ' ' VAL . 95.8 Cg_endo -80.69 26.51 0.59 Allowed 'Trans proline' 0 CA--C 1.515 -0.441 0 C-N-CA 122.794 2.329 . . . . 0.0 113.697 -176.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.932 ' HB2' HG22 ' A' ' 943' ' ' ILE . 43.3 tt0 60.71 -13.26 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.438 0 O-C-N 123.775 0.672 . . . . 0.0 112.686 -178.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.749 ' HB3' ' HG2' ' A' ' 953' ' ' PRO . 1.8 mp0 52.15 64.2 1.94 Allowed 'General case' 0 N--CA 1.44 -0.944 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 -154.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.833 ' CE1' ' HD3' ' A' 1018 ' ' LYS . 23.6 m-85 -47.79 -59.41 3.33 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.23 -0.895 . . . . 0.0 111.834 -175.485 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 0.881 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -54.69 -51.78 75.83 Favored Pre-proline 0 CA--C 1.542 0.643 0 CA-C-O 119.077 -0.487 . . . . 0.0 111.877 178.76 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 0.881 ' HD3' HG13 ' A' ' 952' ' ' VAL . 5.7 Cg_exo -46.4 -49.18 12.15 Favored 'Trans proline' 0 C--N 1.354 0.827 0 C-N-CA 122.522 2.148 . . . . 0.0 113.73 169.492 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.706 ' SD ' ' HG3' ' A' ' 939' ' ' MET . 2.3 tpt -58.47 -49.03 78.8 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.546 0.688 . . . . 0.0 110.233 176.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.884 HG21 ' HG2' ' A' 1002 ' ' MET . 56.8 t -53.37 -33.57 21.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 114.56 -1.2 . . . . 0.0 112.414 171.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 5.7 mptp? -63.36 -31.68 72.9 Favored 'General case' 0 C--N 1.315 -0.901 0 C-N-CA 119.737 -0.785 . . . . 0.0 111.149 173.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . 0.432 ' O ' ' HB3' ' A' ' 960' ' ' LEU . 45.0 mm-40 -79.76 -42.76 23.85 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.545 0.212 . . . . 0.0 111.506 176.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' ' 954' ' ' MET . 2.0 t -69.42 -33.46 57.55 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 177.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -66.1 -37.4 93.03 Favored Glycine 0 N--CA 1.435 -1.401 0 N-CA-C 110.352 -1.099 . . . . 0.0 110.352 173.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . 0.565 HD12 ' HD3' ' A' ' 963' ' ' ARG . 16.3 tp -62.81 -31.98 73.08 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 115.034 -0.583 . . . . 0.0 110.045 172.538 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.51 ' HB1' ' HB3' ' A' ' 932' ' ' LEU . . . -73.76 -58.54 3.23 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.763 -0.198 . . . . 0.0 110.588 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.535 ' HG ' ' N ' ' A' ' 963' ' ' ARG . 0.1 OUTLIER -39.22 -53.65 1.88 Allowed 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 166.682 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.565 ' HD3' HD12 ' A' ' 960' ' ' LEU . 6.5 ptm180 -67.7 -31.96 72.27 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 119.318 0.963 . . . . 0.0 111.516 -178.111 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 83.5 m -65.96 -35.6 81.04 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 175.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.941 HD21 HD11 ' A' 1035 ' ' LEU . 52.9 tp -70.88 -37.76 73.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.52 -1.218 . . . . 0.0 109.63 176.569 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 9.7 tt -68.21 -40.37 82.12 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 114.628 -1.169 . . . . 0.0 108.36 -175.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -70.63 -37.18 73.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.531 -0.759 . . . . 0.0 112.262 178.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 7.6 p -66.07 -41.42 90.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 118.802 0.728 . . . . 0.0 110.169 176.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.973 HG12 HG23 ' A' ' 984' ' ' ILE . 77.0 t -71.1 -38.58 71.87 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.324 174.619 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.648 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 7.1 t70 -68.01 -41.49 82.16 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.647 0.736 . . . . 0.0 109.045 -178.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.469 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 45.5 tt0 -62.93 -33.37 75.19 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.519 176.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.42 ' HB2' ' O ' ' A' ' 969' ' ' VAL . 62.2 m -67.06 -20.03 65.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.184 176.396 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.713 ' HB2' HG21 ' A' ' 984' ' ' ILE . 9.1 tt -68.64 -53.18 16.88 Favored Pre-proline 0 CA--C 1.534 0.352 0 CA-C-O 119.513 -0.28 . . . . 0.0 110.907 -174.192 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.693 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 4.1 Cg_endo -89.29 -2.69 6.06 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 121.766 1.644 . . . . 0.0 113.143 176.647 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . . . . . . . . . 20.9 t -86.5 -40.44 14.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.616 175.137 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.413 HD13 ' HB3' ' A' 1043 ' ' ARG . 91.1 mt -73.55 125.21 90.76 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.089 0.471 . . . . 0.0 110.544 177.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -81.8 24.11 0.73 Allowed 'Trans proline' 0 C--O 1.233 0.258 0 C-N-CA 123.395 2.73 . . . . 0.0 113.526 -173.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . 0.558 ' HB1' ' HB3' ' A' 1046 ' ' MET . . . -125.19 -176.06 3.47 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.568 -177.401 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.575 ' HB2' ' SD ' ' A' 1046 ' ' MET . 18.1 m -80.61 24.49 0.47 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.118 0.485 . . . . 0.0 111.008 -179.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.891 HG23 ' HB1' ' A' 1042 ' ' ALA . 23.7 m -63.61 -9.84 15.61 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.625 -178.025 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.455 ' HA ' ' HG ' ' A' ' 973' ' ' LEU . 7.9 p80 -52.98 -32.62 47.29 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -179.525 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . 0.546 ' HA ' ' HG2' ' A' ' 985' ' ' GLU . 4.4 ptm180 -83.46 -21.57 32.84 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 120.268 -0.573 . . . . 0.0 111.714 -174.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.436 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 0.4 OUTLIER -79.33 -39.88 31.67 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 121.882 0.849 . . . . 0.0 109.232 171.63 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.973 HG23 HG12 ' A' ' 969' ' ' VAL . 75.0 mt -69.02 -33.22 57.75 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 CA-C-N 114.254 -1.339 . . . . 0.0 110.0 -178.334 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . 0.546 ' HG2' ' HA ' ' A' ' 982' ' ' ARG . 12.8 pt-20 -71.2 -43.54 67.17 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 119.553 -0.859 . . . . 0.0 109.525 -179.499 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 54.3 tpp -71.3 -43.52 66.94 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 114.583 -1.189 . . . . 0.0 111.344 -172.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.987 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -74.83 -50.09 18.33 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.879 -1.055 . . . . 0.0 112.687 -170.327 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.629 HE22 ' HB2' ' A' ' 970' ' ' ASP . 3.6 pt20 -60.02 -29.1 68.27 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.972 176.472 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . 0.722 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 20.8 tttm -70.03 -39.64 75.66 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.19 172.479 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.463 ' HB3' ' O ' ' A' ' 987' ' ' ALA . 16.7 tp -50.37 -60.54 2.89 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.412 -0.813 . . . . 0.0 112.651 -179.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.718 HD22 ' HG ' ' A' 1035 ' ' LEU . 1.6 pt? -73.46 -22.25 60.23 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.584 0.707 . . . . 0.0 110.036 -177.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . 0.722 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 48.8 t-20 -51.94 -55.43 20.37 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 114.317 -1.311 . . . . 0.0 110.965 175.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 14.6 m -73.16 -31.87 64.51 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.854 -179.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.5 -31.73 68.94 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 119.58 -0.848 . . . . 0.0 112.059 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 0.592 ' N ' HD21 ' A' 1028 ' ' LEU . 8.3 tt -71.05 -16.65 62.61 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 122.168 -0.333 . . . . 0.0 110.227 171.187 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -76.81 -24.41 52.79 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 119.854 -0.738 . . . . 0.0 109.901 168.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -74.1 -42.93 59.34 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 109.144 -0.688 . . . . 0.0 109.144 171.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.645 HD22 HD11 ' A' 1028 ' ' LEU . 0.4 OUTLIER -55.69 -43.48 76.47 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.34 -0.846 . . . . 0.0 111.024 -179.597 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.795 HG12 HG11 ' A' ' 955' ' ' VAL . 75.5 mt -64.45 -43.94 96.98 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.957 -177.016 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 29.1 m-80 -63.8 -33.75 76.38 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.321 0.582 . . . . 0.0 111.856 -178.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.977 ' HD3' ' HG2' ' A' 1020 ' ' GLN . 89.7 mttt -82.55 -42.48 18.29 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.539 -174.055 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.884 ' HG2' HG21 ' A' ' 955' ' ' VAL . 0.0 OUTLIER -62.88 -25.48 68.32 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.919 0.866 . . . . 0.0 108.893 176.341 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.615 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 10.4 tptp -71.04 -54.97 9.3 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.432 -168.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.773 ' HB3' HD23 ' A' 1013 ' ' LEU . 80.3 mt -70.69 -14.11 62.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.343 179.242 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.76 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -70.5 -50.95 32.46 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 119.704 -0.798 . . . . 0.0 110.002 178.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.68 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.2 pp0? -74.11 -30.4 62.31 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.319 -0.553 . . . . 0.0 112.049 173.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.618 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 12.1 mt-30 -50.78 -45.42 59.11 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.524 0.678 . . . . 0.0 110.175 173.165 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.637 ' CD1' HD22 ' A' 1013 ' ' LEU . 73.3 m-85 -121.93 43.58 2.82 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.267 175.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 1.087 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 7.7 p -51.92 -29.44 11.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 CA-C-O 121.79 0.805 . . . . 0.0 110.65 173.256 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . 0.429 ' HG3' ' OG1' ' A' 1011 ' ' THR . 24.1 ptp -69.04 -5.69 23.46 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.003 -0.999 . . . . 0.0 111.897 176.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . 0.911 HG22 ' H ' ' A' 1012 ' ' SER . 1.2 m -141.55 -168.45 2.66 Favored 'General case' 0 C--O 1.258 1.544 0 CA-C-O 122.952 1.358 . . . . 0.0 113.98 -172.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . 0.911 ' H ' HG22 ' A' 1011 ' ' THR . 15.5 m -57.72 -32.57 67.53 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 114.2 -1.364 . . . . 0.0 111.899 -175.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.773 HD23 ' HB3' ' A' 1004 ' ' LEU . 7.5 mp -49.72 -43.32 47.63 Favored 'General case' 0 CA--C 1.499 -1.006 0 C-N-CA 120.425 -0.51 . . . . 0.0 112.206 172.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 1.087 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -56.63 -50.16 72.85 Favored 'General case' 0 N--CA 1.439 -1.016 0 C-N-CA 119.871 -0.731 . . . . 0.0 109.437 -173.533 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.481 ' N ' HE21 ' A' 1014 ' ' GLN . 3.7 pt20 -71.31 -42.15 69.0 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 114.869 -1.059 . . . . 0.0 111.965 -175.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -67.12 -56.31 10.53 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.352 0.596 . . . . 0.0 111.623 179.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.76 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 13.8 m-85 -63.93 -33.1 74.95 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 -173.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.833 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 42.2 tptt -79.68 -30.8 41.24 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.453 -178.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . 0.511 ' O ' HD23 ' A' 1022 ' ' LEU . 1.1 mptm? -70.68 -51.21 29.19 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 173.152 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . 0.977 ' HG2' ' HD3' ' A' 1001 ' ' LYS . 8.0 tt0 -50.69 -33.56 23.24 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.761 -1.109 . . . . 0.0 111.206 165.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.655 ' HG3' ' HB3' ' A' 1002 ' ' MET . 1.9 tmt? -68.32 -46.82 69.21 Favored 'General case' 0 CA--C 1.512 -0.508 0 O-C-N 122.168 -0.333 . . . . 0.0 110.355 176.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . 0.682 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -80.47 -7.29 59.11 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 118.857 -1.137 . . . . 0.0 109.595 -179.28 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 84.8 m -83.93 -40.4 18.58 Favored 'General case' 0 C--N 1.333 -0.133 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 174.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.555 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -77.27 -21.13 54.13 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 172.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.814 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -85.09 -23.01 28.69 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.401 169.437 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.564 ' O ' HG23 ' A' 1030 ' ' VAL . 16.3 t60 -76.96 -24.84 52.3 Favored 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 166.26 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . . . . . . . . . . . -73.74 -39.01 64.58 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 123.489 0.716 . . . . 0.0 109.67 165.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.645 HD11 HD22 ' A' ' 998' ' ' LEU . 22.7 mt -60.63 -44.34 96.48 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 168.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -59.99 -38.45 82.62 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 111.445 0.165 . . . . 0.0 111.445 173.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' 1026 ' ' HIS . 7.8 t -69.93 -50.31 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.166 0 CA-C-O 121.488 0.661 . . . . 0.0 110.071 -178.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.469 ' O ' HD12 ' A' 1035 ' ' LEU . 23.8 m-20 -66.63 -38.05 86.11 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 114.687 -1.142 . . . . 0.0 110.496 -178.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.661 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -59.76 -42.57 93.57 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.349 173.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 50.9 mttp -64.03 -53.14 54.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.665 0.745 . . . . 0.0 110.054 173.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.433 ' O ' HG23 ' A' 1038 ' ' VAL . 9.0 t30 -63.18 -52.18 63.4 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.175 -1.375 . . . . 0.0 111.813 -171.207 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.987 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 0.0 OUTLIER -65.31 -38.0 88.85 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 119.307 -0.378 . . . . 0.0 110.825 -173.204 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.721 ' N ' HD13 ' A' 1035 ' ' LEU . 4.0 pp -72.98 -35.1 66.83 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 116.951 -1.899 . . . . 0.0 109.718 -179.326 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.424 ' N ' HD12 ' A' 1036 ' ' LEU . 38.3 t70 -59.12 -42.86 91.56 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 114.988 -1.006 . . . . 0.0 109.823 174.494 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' 1034 ' ' ASN . 19.6 t -53.9 -42.3 52.77 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.706 0 CA-C-N 113.847 -1.524 . . . . 0.0 111.522 173.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.647 ' O ' ' HG2' ' A' 1043 ' ' ARG . 1.7 mp -79.11 -31.11 14.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 118.35 0.523 . . . . 0.0 111.387 177.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.444 ' HB3' ' HB ' ' A' ' 919' ' ' ILE . 0.4 OUTLIER -56.83 -50.39 72.53 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.655 0.74 . . . . 0.0 109.511 169.907 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -65.61 -42.93 91.04 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.222 174.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.891 ' HB1' HG23 ' A' ' 980' ' ' THR . . . -52.33 -48.46 65.44 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 122.973 0.509 . . . . 0.0 112.37 -175.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.682 ' O ' HG12 ' A' 1047 ' ' ILE . 13.4 ptt180 -64.27 -47.76 78.31 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.905 -178.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.6 ' HB2' ' CA ' ' A' ' 918' ' ' GLY . 47.5 tp -67.37 -36.57 81.63 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 120.461 -0.496 . . . . 0.0 111.221 178.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.661 ' O ' ' HB2' ' A' 1049 ' ' GLN . 1.3 tmtp? -64.84 -48.43 74.35 Favored 'General case' 0 C--O 1.211 -0.969 0 CA-C-O 121.577 0.703 . . . . 0.0 109.878 -179.493 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.575 ' SD ' ' HB2' ' A' ' 979' ' ' SER . 18.8 mmt -68.2 -34.7 76.75 Favored 'General case' 0 C--N 1.297 -1.698 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.74 -177.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.682 HG12 ' O ' ' A' 1043 ' ' ARG . 38.2 mm -60.47 -63.33 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.514 171.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . 0.678 ' O ' ' HD2' ' A' 1052 ' ' PRO . 67.2 m -136.63 52.89 1.93 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -172.623 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . 0.661 ' HB2' ' O ' ' A' 1045 ' ' LYS . 0.9 OUTLIER -54.42 -22.38 12.35 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 179.041 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 12.5 t -66.93 -6.33 16.18 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 111.613 0.227 . . . . 0.0 111.613 -177.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . 0.875 ' HB2' ' HD3' ' A' 1052 ' ' PRO . 19.5 mmm180 -118.5 -74.32 0.01 OUTLIER Pre-proline 0 CA--C 1.542 0.641 0 CA-C-O 119.076 -0.488 . . . . 0.0 111.452 172.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . 0.875 ' HD3' ' HB2' ' A' 1051 ' ' ARG . 93.7 Cg_endo -95.78 170.9 1.23 Allowed 'Trans proline' 0 C--N 1.357 1.018 0 C-N-CA 121.926 1.751 . . . . 0.0 113.338 179.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . . . . . . . . . 4.2 m-70 . . . . . 0 N--CA 1.465 0.28 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.845 175.138 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.702 0 N-CA-C 112.023 -0.431 . . . . 0.0 112.023 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 37.3 t -96.93 123.04 54.93 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-O 120.818 0.342 . . . . 0.0 110.487 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -84.72 0.14 9.1 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 122.851 2.367 . . . . 0.0 111.659 175.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -114.72 71.35 0.24 Allowed Glycine 0 N--CA 1.445 -0.736 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.048 -179.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 68.7 mt -83.45 106.36 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 178.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 13.1 t -91.27 110.85 22.15 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.462 -176.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 88.26 -80.27 1.64 Allowed Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.256 179.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 83.93 -32.64 3.19 Favored Glycine 0 CA--C 1.518 0.275 0 C-N-CA 121.155 -0.545 . . . . 0.0 112.541 178.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . 91.9 58.82 1.37 Allowed Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.068 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 917' ' ' GLY . . . . . 0.681 ' HA2' HD21 ' A' ' 922' ' ' ASN . . . -58.79 131.57 52.11 Favored Glycine 0 C--N 1.333 0.415 0 N-CA-C 111.735 -0.546 . . . . 0.0 111.735 177.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . 0.699 ' HA2' ' HD2' ' A' 1043 ' ' ARG . . . 162.61 169.23 25.7 Favored Glycine 0 C--O 1.225 -0.452 0 C-N-CA 120.162 -1.018 . . . . 0.0 112.791 -171.215 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 919' ' ' ILE . . . . . 0.923 ' HA ' ' CB ' ' A' 1040 ' ' ASP . 40.1 pt -57.99 44.77 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 N-CA-C 115.993 1.849 . . . . 0.0 115.993 -176.57 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . . . . . . . . . 39.7 ptt180 -140.11 11.73 2.4 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 121.553 -0.717 . . . . 0.0 111.109 179.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . 0.457 ' H ' ' CG ' ' A' 1040 ' ' ASP . 21.8 m 60.31 25.6 15.07 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 123.013 0.525 . . . . 0.0 111.325 177.174 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.681 HD21 ' HA2' ' A' ' 917' ' ' GLY . 5.6 m120 39.94 -147.14 0.02 OUTLIER 'General case' 0 C--O 1.233 0.22 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.809 178.117 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.753 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 5.9 p-10 -112.26 -60.2 1.9 Allowed 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.807 ' HB3' HG21 ' A' ' 968' ' ' THR . 11.2 tptm -72.34 -29.88 64.22 Favored 'General case' 0 C--N 1.31 -1.133 0 O-C-N 120.462 -1.399 . . . . 0.0 112.532 -164.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.577 HG12 ' HB ' ' A' ' 968' ' ' THR . 14.0 m -65.86 -31.74 55.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 CA-C-O 121.045 0.45 . . . . 0.0 110.421 177.173 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.753 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -77.14 -23.52 51.7 Favored 'General case' 0 CA--C 1.504 -0.797 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 174.525 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.78 -25.27 48.91 Favored 'General case' 0 C--N 1.301 -1.529 0 C-N-CA 120.067 -0.653 . . . . 0.0 111.542 173.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.586 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 3.2 m120 -77.16 -30.34 54.96 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 174.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.603 HG22 HD21 ' A' ' 932' ' ' LEU . 62.6 t -79.74 -29.52 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.766 175.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.488 ' O ' ' HB3' ' A' ' 934' ' ' LYS . 84.8 m -57.8 -39.97 78.81 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 119.127 0.876 . . . . 0.0 108.642 169.043 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -72.7 -52.52 9.63 Favored Glycine 0 CA--C 1.527 0.812 0 CA-C-N 114.978 -1.01 . . . . 0.0 113.775 177.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.603 HD21 HG22 ' A' ' 929' ' ' VAL . 2.1 pp -63.2 -45.43 91.76 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 117.745 0.772 . . . . 0.0 112.706 -176.062 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 61.5 t -65.56 -39.44 85.06 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 CA-C-O 121.253 0.549 . . . . 0.0 110.366 -178.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.488 ' HB3' ' O ' ' A' ' 930' ' ' THR . 1.4 tmtt? -61.08 -35.94 78.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.942 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 0.457 ' HB1' ' SD ' ' A' ' 954' ' ' MET . . . -64.61 -41.98 95.83 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 118.129 0.422 . . . . 0.0 110.801 177.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.86 HG22 ' HB1' ' A' 1025 ' ' ALA . 58.0 t -47.63 -73.84 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.974 -179.485 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.416 HG13 ' N ' ' A' ' 938' ' ' GLU . 25.6 pt -65.64 -41.38 90.46 Favored 'Isoleucine or valine' 0 C--O 1.244 0.813 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -177.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.538 ' HG2' ' HD2' ' A' ' 942' ' ' LYS . 36.2 tt0 -69.6 -51.89 31.01 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.588 -170.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . . . . . . . . . 23.8 mmt -73.71 -27.18 61.08 Favored 'General case' 0 N--CA 1.444 -0.736 0 C-N-CA 119.757 -0.777 . . . . 0.0 109.371 -174.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.577 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 59.9 p -54.74 -40.64 69.51 Favored 'General case' 0 C--N 1.343 0.288 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.429 -174.611 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 35.8 t -95.27 -15.54 23.1 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.046 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.538 ' HD2' ' HG2' ' A' ' 938' ' ' GLU . 51.2 mttm -83.03 -10.57 58.68 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 119.95 -0.7 . . . . 0.0 110.55 -178.242 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.496 HG13 ' N ' ' A' ' 944' ' ' GLN . 41.7 pt -41.88 -43.45 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 O-C-N 123.547 0.529 . . . . 0.0 112.104 167.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.496 ' N ' HG13 ' A' ' 943' ' ' ILE . 58.8 tp60 65.49 114.52 0.03 OUTLIER Pre-proline 0 N--CA 1.465 0.291 0 C-N-CA 123.458 0.703 . . . . 0.0 110.795 -176.039 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -72.72 69.84 3.55 Favored 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 122.665 2.244 . . . . 0.0 113.458 -176.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.87 ' HB3' ' HD3' ' A' ' 947' ' ' PRO . . . -170.47 -59.54 0.0 OUTLIER Pre-proline 0 CA--C 1.534 0.347 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.783 172.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.87 ' HD3' ' HB3' ' A' ' 946' ' ' ALA . 86.9 Cg_endo -93.13 141.48 1.9 Allowed 'Trans proline' 0 N--CA 1.451 -1.022 0 C-N-CA 122.397 2.064 . . . . 0.0 111.032 171.243 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.609 ' HA ' HG21 ' A' 1009 ' ' VAL . 11.7 Cg_exo -68.88 132.69 25.33 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 121.714 1.61 . . . . 0.0 112.589 -179.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.711 ' HB3' ' CD1' ' A' ' 951' ' ' TYR . 19.8 tt0 -61.22 -15.46 34.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.26 -0.882 . . . . 0.0 108.939 168.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.673 ' HB2' ' HG2' ' A' ' 953' ' ' PRO . 7.4 mm-40 74.84 -22.71 0.25 Allowed 'General case' 0 C--N 1.344 0.359 0 CA-C-N 114.756 -1.111 . . . . 0.0 109.647 -169.411 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.8 ' HB3' ' HG3' ' A' 1002 ' ' MET . 1.0 OUTLIER 62.5 -46.65 0.18 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.533 1.133 . . . . 0.0 112.936 174.441 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 0.615 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 23.8 t -53.41 -45.4 98.51 Favored Pre-proline 0 C--N 1.323 -0.563 0 C-N-CA 123.151 0.58 . . . . 0.0 111.608 171.047 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 0.673 ' HG2' ' HB2' ' A' ' 950' ' ' GLU . 38.4 Cg_exo -51.58 -39.42 65.52 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.186 1.924 . . . . 0.0 112.53 174.029 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.457 ' SD ' ' HB1' ' A' ' 935' ' ' ALA . 5.3 tpt -73.96 -36.41 64.59 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.762 175.073 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.605 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 71.2 t -52.67 -40.74 35.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.794 168.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.4 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 3.1 tmtm? -66.59 -33.02 74.73 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.597 175.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . 0.434 ' HB3' ' HA ' ' A' ' 954' ' ' MET . 7.0 tp10 -77.55 -45.81 24.24 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 121.002 0.429 . . . . 0.0 111.01 -174.278 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.498 HG11 HD21 ' A' ' 998' ' ' LEU . 14.6 p -87.05 -27.53 5.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.618 -178.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -63.82 -38.91 96.84 Favored Glycine 0 N--CA 1.447 -0.567 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 173.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . 0.467 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 17.0 tp -63.11 -38.26 90.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.279 -0.46 . . . . 0.0 109.893 174.264 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.463 ' HB1' ' HB3' ' A' ' 932' ' ' LEU . . . -70.3 -40.76 74.06 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.706 -176.154 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.596 HD13 HD12 ' A' ' 991' ' ' LEU . 0.2 OUTLIER -67.74 -44.16 78.23 Favored 'General case' 0 C--O 1.217 -0.644 0 CA-C-O 118.782 -0.627 . . . . 0.0 111.437 173.423 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.467 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 6.1 ptp180 -64.85 -31.68 73.03 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 120.187 1.358 . . . . 0.0 110.457 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . 0.483 HG22 ' ND2' ' A' ' 928' ' ' ASN . 30.4 m -69.33 -39.11 78.39 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 176.602 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 1.0 HD11 HD21 ' A' 1036 ' ' LEU . 37.5 tp -62.79 -44.11 97.04 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.559 -1.2 . . . . 0.0 109.949 175.179 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.745 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.5 tt -68.2 -35.22 77.66 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.318 -0.856 . . . . 0.0 109.119 -172.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -69.81 -43.48 71.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.815 178.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.807 HG21 ' HB3' ' A' ' 924' ' ' LYS . 4.6 m -64.41 -41.11 96.8 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 119.843 -0.743 . . . . 0.0 110.134 178.321 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.736 HG12 HG23 ' A' ' 984' ' ' ILE . 43.6 t -67.65 -38.09 79.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.178 173.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.675 ' HB2' HE22 ' A' ' 988' ' ' GLN . 19.2 t70 -66.73 -38.61 87.01 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 122.21 1.005 . . . . 0.0 108.696 -178.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.448 ' C ' ' HD2' ' A' ' 974' ' ' PRO . 28.1 tt0 -76.01 -21.94 56.34 Favored 'General case' 0 N--CA 1.437 -1.106 0 CA-C-N 113.964 -1.471 . . . . 0.0 110.128 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.588 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 52.7 m -72.08 -17.67 61.98 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.708 171.651 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.828 ' HA ' HD13 ' A' ' 984' ' ' ILE . 9.4 tt -66.04 -51.0 48.95 Favored Pre-proline 0 CA--C 1.53 0.176 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 179.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.536 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 95.0 Cg_endo -81.97 -2.44 11.3 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 120.964 1.109 . . . . 0.0 113.546 171.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.727 HG12 HD13 ' A' ' 976' ' ' LEU . 0.3 OUTLIER -73.06 -32.16 38.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.691 178.351 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.727 HD13 HG12 ' A' ' 975' ' ' VAL . 0.0 OUTLIER -108.91 158.26 34.67 Favored Pre-proline 0 CA--C 1.53 0.194 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 169.27 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -80.46 99.21 1.13 Allowed 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 122.866 2.377 . . . . 0.0 113.625 -176.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . 68.94 -77.58 0.05 Allowed 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 167.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.407 ' HB3' ' HB3' ' A' 1046 ' ' MET . 4.7 m -38.34 -55.31 1.36 Allowed 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 114.776 1.399 . . . . 0.0 114.776 -165.251 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.526 ' HB ' ' CD2' ' A' ' 976' ' ' LEU . 15.8 m -70.42 -8.53 51.61 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -172.369 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.656 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 0.3 OUTLIER -51.82 -34.85 42.12 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -175.542 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -82.22 -21.03 36.56 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.116 0.871 . . . . 0.0 111.94 -171.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.586 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 0.4 OUTLIER -77.77 -33.81 52.55 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.386 0.612 . . . . 0.0 109.723 169.615 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.838 HG12 HG12 ' A' 1039 ' ' ILE . 69.3 mt -70.8 -30.28 41.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 CA-C-N 114.889 -1.05 . . . . 0.0 108.469 179.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . 0.656 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 45.9 mt-10 -63.97 -54.47 34.01 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.302 174.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . 0.577 ' HA ' ' HD2' ' A' ' 989' ' ' LYS . 75.2 mtp -70.61 -41.52 72.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.789 -170.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.953 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -65.24 -50.81 64.38 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.19 -0.914 . . . . 0.0 112.167 -173.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.745 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 3.7 pt20 -61.83 -28.2 69.31 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 120.452 -0.499 . . . . 0.0 111.074 178.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . 0.662 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 55.9 mttm -70.0 -43.42 71.45 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.449 0.643 . . . . 0.0 111.182 173.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.708 HD23 ' HB3' ' A' 1035 ' ' LEU . 7.7 tp -50.52 -60.08 3.38 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 114.694 -1.139 . . . . 0.0 112.539 -176.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.625 ' HB2' ' CD2' ' A' 1035 ' ' LEU . 0.4 OUTLIER -63.9 -33.49 75.83 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 121.398 0.618 . . . . 0.0 109.401 179.643 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . 0.662 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 44.7 t-20 -52.44 -51.89 56.88 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.584 -1.189 . . . . 0.0 110.546 177.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . 0.489 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 32.7 t -75.01 -42.44 57.4 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.464 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.54 -36.31 80.23 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.971 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 0.639 ' HG ' HD23 ' A' ' 998' ' ' LEU . 8.1 tt -73.18 -19.75 61.04 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 122.198 -0.314 . . . . 0.0 110.617 172.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -75.0 -25.55 58.9 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 119.841 -0.744 . . . . 0.0 109.788 168.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.56 ' O ' ' HG2' ' A' 1001 ' ' LYS . 4.6 mm-40 -75.43 -40.16 57.98 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 172.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.826 HD13 ' HB2' ' A' 1025 ' ' ALA . 0.2 OUTLIER -56.18 -47.01 79.13 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.325 177.917 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.525 HG13 ' O ' ' A' ' 995' ' ' LEU . 95.8 mt -64.73 -42.12 94.1 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.575 -174.545 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 14.5 m-80 -59.49 -39.41 83.69 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.345 0.593 . . . . 0.0 111.856 -178.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.56 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 69.5 mmtt -77.96 -37.61 47.12 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 122.097 0.951 . . . . 0.0 108.739 -177.028 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.878 ' HB2' ' HG3' ' A' 1021 ' ' MET . 1.7 ttp -61.64 -28.71 69.57 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 114.061 -1.427 . . . . 0.0 109.179 175.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.47 ' O ' ' HG3' ' A' 1006 ' ' GLN . 2.9 tptm -73.76 -47.03 42.03 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.948 -167.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.872 HD13 ' HG3' ' A' 1007 ' ' GLN . 3.8 mm? -77.5 -13.56 59.89 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.102 179.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.834 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -75.38 -32.21 60.72 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 119.443 -0.903 . . . . 0.0 110.61 -177.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.719 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 5.2 pp0? -75.13 -33.27 61.54 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 118.867 -0.587 . . . . 0.0 110.961 165.406 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.872 ' HG3' HD13 ' A' 1004 ' ' LEU . 13.7 mm100 -48.33 -44.12 33.88 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.126 0.488 . . . . 0.0 110.497 176.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.884 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 28.6 m-85 -130.01 47.4 2.51 Favored 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 120.014 -0.674 . . . . 0.0 111.074 170.027 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 1.029 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 7.2 p -50.95 -24.47 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 CA-C-O 121.945 0.878 . . . . 0.0 109.599 167.293 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 16.4 mmt -48.68 -44.6 38.05 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 113.838 -1.528 . . . . 0.0 110.922 175.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 2.6 p -154.98 -101.9 0.04 OUTLIER 'General case' 0 C--O 1.251 1.182 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 -177.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 16.4 p -57.67 -64.02 1.04 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-N 114.552 -1.204 . . . . 0.0 112.881 -164.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.884 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 4.6 mp -45.99 -42.94 13.75 Favored 'General case' 0 CA--C 1.5 -0.98 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 1.029 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -55.03 -47.77 74.29 Favored 'General case' 0 N--CA 1.438 -1.042 0 O-C-N 123.866 0.729 . . . . 0.0 110.345 -168.499 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.614 ' O ' ' HD3' ' A' 1019 ' ' LYS . 97.8 mt-30 -69.37 -51.57 35.42 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.08 -177.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -64.35 -48.0 77.19 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.36 0.6 . . . . 0.0 111.188 -176.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.834 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 7.2 m-85 -68.24 -37.52 80.87 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.258 -0.883 . . . . 0.0 113.139 -173.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.6 ' HD3' ' CE2' ' A' ' 951' ' ' TYR . 47.1 tptt -80.96 -28.42 35.68 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.3 -176.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . 0.614 ' HD3' ' O ' ' A' 1015 ' ' GLN . 5.6 mptp? -73.32 -53.27 11.21 Favored 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 174.091 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . 0.478 ' HG2' ' HG3' ' A' 1001 ' ' LYS . 9.2 tt0 -50.56 -32.01 17.35 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.809 164.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.878 ' HG3' ' HB2' ' A' 1002 ' ' MET . 2.4 ttp -68.69 -50.66 49.18 Favored 'General case' 0 CA--C 1.514 -0.417 0 O-C-N 122.333 -0.23 . . . . 0.0 110.621 176.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . 0.762 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -84.9 -9.41 58.13 Favored 'General case' 0 C--O 1.219 -0.553 0 C-N-CA 119.629 -0.829 . . . . 0.0 110.317 -174.035 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 52.4 m -83.34 -34.8 25.57 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 171.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.53 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -78.28 -21.85 49.14 Favored 'General case' 0 C--O 1.223 -0.319 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 171.018 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.86 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -85.64 -23.38 27.52 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.176 170.187 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.582 ' O ' HG23 ' A' 1030 ' ' VAL . 46.9 t-80 -75.77 -24.58 56.03 Favored 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 165.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . 0.53 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -70.68 -38.88 73.78 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 123.53 0.732 . . . . 0.0 109.654 164.236 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.635 HD11 HD22 ' A' ' 998' ' ' LEU . 21.6 mt -60.95 -47.21 87.49 Favored 'General case' 0 C--N 1.314 -0.939 0 C-N-CA 120.191 -0.604 . . . . 0.0 109.495 169.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -57.74 -40.92 80.79 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 111.366 0.135 . . . . 0.0 111.366 173.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.582 HG23 ' O ' ' A' 1026 ' ' HIS . 16.1 t -70.18 -52.17 32.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-O 121.232 0.539 . . . . 0.0 110.711 -177.093 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.74 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 5.7 m-20 -77.27 -29.14 53.75 Favored 'General case' 0 C--O 1.214 -0.783 0 CA-C-N 115.441 -0.8 . . . . 0.0 112.746 -174.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.594 ' O ' ' HG ' ' A' 1036 ' ' LEU . . . -66.51 -32.68 74.18 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 170.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.503 ' HB3' ' O ' ' A' 1030 ' ' VAL . 22.9 tttm -64.96 -51.24 62.88 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 122.078 0.942 . . . . 0.0 109.098 168.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.74 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 32.4 t30 -61.58 -52.11 65.75 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 113.396 -1.729 . . . . 0.0 112.572 -173.399 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.953 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 1.5 pp -62.45 -37.95 87.89 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 118.941 -0.552 . . . . 0.0 110.23 -176.187 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 1.0 HD21 HD11 ' A' ' 965' ' ' LEU . 19.9 mt -66.95 -45.86 76.48 Favored 'General case' 0 C--O 1.224 -0.279 0 C-N-CA 116.809 -1.956 . . . . 0.0 108.785 176.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.484 ' HB3' ' O ' ' A' 1034 ' ' ASN . 28.3 t70 -50.19 -40.79 48.07 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 114.46 -1.245 . . . . 0.0 111.038 175.273 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.522 ' HB ' ' O ' ' A' 1035 ' ' LEU . 24.2 t -53.33 -51.09 43.84 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.692 0 CA-C-N 114.267 -1.333 . . . . 0.0 111.66 173.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.838 HG12 HG12 ' A' ' 984' ' ' ILE . 3.0 mp -72.4 -33.08 44.58 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.428 0 CA-C-N 118.917 0.78 . . . . 0.0 110.738 176.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.923 ' CB ' ' HA ' ' A' ' 919' ' ' ILE . 90.1 m-20 -52.88 -52.59 56.92 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 122.317 1.056 . . . . 0.0 109.343 173.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -75.61 -35.72 60.45 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.524 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.654 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -53.96 -50.05 67.37 Favored 'General case' 0 CA--C 1.499 -0.994 0 C-N-CA 123.465 0.706 . . . . 0.0 111.998 -178.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.703 ' HD3' ' N ' ' A' 1044 ' ' LEU . 0.1 OUTLIER -62.2 -41.09 98.04 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -177.394 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.703 ' N ' ' HD3' ' A' 1043 ' ' ARG . 50.7 tp -74.51 -39.17 62.58 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 121.52 0.676 . . . . 0.0 110.319 -177.559 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.446 ' N ' ' HD2' ' A' 1053 ' ' HIS . 28.7 tttt -64.56 -44.78 89.68 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 114.877 -1.056 . . . . 0.0 110.793 179.221 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.407 ' HB3' ' HB3' ' A' ' 979' ' ' SER . 14.2 mmt -66.87 -35.56 80.31 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.748 179.077 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.687 HG12 ' O ' ' A' 1043 ' ' ARG . 20.6 mm -51.38 -48.49 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.368 172.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 66.3 m -144.87 65.42 1.27 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 111.592 0.219 . . . . 0.0 111.592 -177.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -68.63 -21.44 64.48 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.651 178.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 5.2 m -77.23 4.04 11.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.289 0.566 . . . . 0.0 110.518 177.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . 0.466 ' HG3' ' HD2' ' A' 1052 ' ' PRO . 16.9 tpt180 -135.1 146.37 58.13 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 175.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . 0.466 ' HD2' ' HG3' ' A' 1051 ' ' ARG . 74.1 Cg_exo -49.69 115.88 2.05 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 121.963 1.775 . . . . 0.0 112.113 177.208 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . 0.446 ' HD2' ' N ' ' A' 1045 ' ' LYS . 8.0 t-80 . . . . . 0 C--N 1.333 -0.111 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.754 -178.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.699 0 N-CA-C 111.453 -0.659 . . . . 0.0 111.453 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 38.0 m 69.56 127.43 0.03 OUTLIER Pre-proline 0 CA--C 1.53 0.211 0 CA-C-O 121.26 0.552 . . . . 0.0 111.484 178.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.98 47.15 2.13 Favored 'Trans proline' 0 CA--C 1.53 0.315 0 C-N-CA 122.931 2.421 . . . . 0.0 112.128 178.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . 118.05 -116.5 3.46 Favored Glycine 0 N--CA 1.444 -0.817 0 N-CA-C 111.099 -0.8 . . . . 0.0 111.099 -176.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 44.5 mm 65.79 102.23 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.324 0 C-N-CA 122.89 0.476 . . . . 0.0 111.117 178.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 39.7 p 48.58 38.84 12.02 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.648 -178.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . -83.7 -0.61 89.92 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 121.111 -0.566 . . . . 0.0 112.536 -179.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . -109.42 143.89 16.54 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.071 178.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . 81.66 23.57 57.81 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 121.034 -0.603 . . . . 0.0 112.608 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . -124.44 117.64 3.14 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.283 -179.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . 0.62 ' CA ' ' HG ' ' A' 1044 ' ' LEU . . . 84.5 170.37 46.83 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.871 -0.68 . . . . 0.0 113.247 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 919' ' ' ILE . . . . . 0.626 HG23 ' HB3' ' A' 1040 ' ' ASP . 3.2 mp -61.19 118.01 3.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 C-N-CA 123.254 0.622 . . . . 0.0 109.968 175.265 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -171.29 46.2 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.702 -169.199 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 7.7 t -114.59 145.68 41.68 Favored 'General case' 0 C--N 1.321 -0.64 0 O-C-N 121.602 -0.687 . . . . 0.0 110.993 178.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -148.74 85.08 1.48 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.27 -0.877 . . . . 0.0 108.942 175.017 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.658 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 5.0 p-10 -125.31 -157.44 0.78 Allowed 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.336 -171.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.571 ' HB2' HG21 ' A' ' 968' ' ' THR . 68.2 mmtt -54.28 -31.72 54.48 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -174.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.61 ' O ' HG23 ' A' ' 929' ' ' VAL . 34.0 m -57.51 -32.52 41.99 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.36 0 CA-C-O 121.164 0.507 . . . . 0.0 110.494 175.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.658 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.1 OUTLIER -74.56 -41.72 60.04 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.337 -179.738 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . 0.475 ' HG2' ' HA ' ' A' ' 924' ' ' LYS . 10.8 pt-20 -76.59 -25.6 54.12 Favored 'General case' 0 C--N 1.317 -0.807 0 C-N-CA 119.175 -1.01 . . . . 0.0 111.342 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -66.17 -28.59 68.89 Favored 'General case' 0 C--N 1.319 -0.754 0 O-C-N 121.651 -0.655 . . . . 0.0 110.346 167.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.616 HG22 ' HB1' ' A' 1032 ' ' ALA . 69.2 t -79.23 -34.9 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.312 172.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.466 HG22 ' O ' ' A' ' 927' ' ' GLU . 1.3 t -67.99 -30.43 69.69 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 120.369 1.44 . . . . 0.0 108.275 173.151 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -73.17 -53.11 8.02 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-N 115.398 -0.819 . . . . 0.0 113.084 174.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.456 ' CD2' ' HA ' ' A' ' 929' ' ' VAL . 0.9 OUTLIER -65.79 -49.69 67.4 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -178.414 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.421 ' O ' ' HB ' ' A' ' 936' ' ' VAL . 72.6 t -68.59 -32.39 54.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 CA-C-O 121.185 0.517 . . . . 0.0 110.733 -174.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . . . . . . . . . 24.7 ttpt -61.99 -45.96 91.33 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.084 176.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 0.462 ' O ' ' HB2' ' A' ' 939' ' ' MET . . . -56.38 -35.33 67.59 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.464 0.173 . . . . 0.0 111.366 176.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.856 HG22 ' HB1' ' A' 1025 ' ' ALA . 57.8 t -52.79 -74.95 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.696 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 23.5 pt -74.74 -42.64 47.55 Favored 'Isoleucine or valine' 0 C--O 1.245 0.851 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -175.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.434 ' HG2' ' HD3' ' A' ' 942' ' ' LYS . 31.5 tt0 -64.9 -51.41 62.06 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.383 0.611 . . . . 0.0 109.99 -171.409 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.598 ' HA ' ' HG2' ' A' ' 942' ' ' LYS . 65.4 mtt -73.55 -25.49 60.41 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.254 -178.211 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.748 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 32.6 p -52.75 -38.73 61.37 Favored 'General case' 0 C--N 1.347 0.468 0 O-C-N 123.797 0.686 . . . . 0.0 111.346 -173.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 10.9 p -106.93 -24.98 11.84 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -176.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.598 ' HG2' ' HA ' ' A' ' 939' ' ' MET . 60.5 pttt -83.26 -45.38 13.89 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 119.012 -1.075 . . . . 0.0 112.625 -165.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 1.052 ' HB ' ' HG3' ' A' ' 949' ' ' GLU . 5.1 mt -78.52 -1.11 3.9 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 N-CA-C 112.713 0.634 . . . . 0.0 112.713 -175.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.439 ' HB3' ' HD3' ' A' ' 945' ' ' PRO . 34.7 tt0 -62.56 -43.68 84.82 Favored Pre-proline 0 CA--C 1.541 0.616 0 N-CA-C 113.496 0.924 . . . . 0.0 113.496 -175.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.561 ' HD2' ' O ' ' A' ' 942' ' ' LYS . 42.6 Cg_exo -58.63 -20.73 51.84 Favored 'Trans proline' 0 C--N 1.356 0.973 0 C-N-CA 121.994 1.796 . . . . 0.0 112.562 174.43 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.685 ' HB1' ' HD2' ' A' ' 947' ' ' PRO . . . -91.06 179.18 1.51 Allowed Pre-proline 0 C--N 1.322 -0.606 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 176.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.685 ' HD2' ' HB1' ' A' ' 946' ' ' ALA . 87.7 Cg_exo -43.96 131.73 8.28 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 121.975 1.783 . . . . 0.0 111.544 170.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 1.011 ' HG3' HG11 ' A' 1009 ' ' VAL . 32.5 Cg_exo -19.66 65.73 0.0 OUTLIER 'Trans proline' 0 C--N 1.357 1.019 1 C-N-CA 127.644 5.562 . . . . 0.0 116.561 -167.758 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 1.052 ' HG3' ' HB ' ' A' ' 943' ' ' ILE . 0.4 OUTLIER 47.57 -0.09 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -168.314 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.78 ' HB3' ' HG2' ' A' ' 953' ' ' PRO . 42.7 mt-10 45.51 63.25 1.85 Allowed 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 -158.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.959 ' HB3' ' HG3' ' A' 1002 ' ' MET . 20.2 m-85 -51.31 -50.8 58.67 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.509 -176.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 0.802 ' O ' ' HB ' ' A' ' 955' ' ' VAL . 25.3 t -63.49 -48.4 81.51 Favored Pre-proline 0 C--N 1.324 -0.511 0 O-C-N 122.49 -0.131 . . . . 0.0 110.863 178.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 0.78 ' HG2' ' HB3' ' A' ' 950' ' ' GLU . 25.7 Cg_exo -50.6 -40.0 55.47 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 121.928 1.752 . . . . 0.0 112.806 166.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.559 ' HE1' ' HG2' ' A' ' 949' ' ' GLU . 36.9 ttm -67.33 -31.92 72.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.034 0.445 . . . . 0.0 110.235 175.752 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.802 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 49.7 t -52.59 -39.12 28.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.087 168.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.632 ' HD3' ' HA ' ' A' ' 953' ' ' PRO . 12.8 mptt -64.82 -36.4 84.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.592 0.234 . . . . 0.0 111.293 172.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -78.87 -46.93 17.53 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.768 0.318 . . . . 0.0 111.773 -172.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.6 HG22 HD23 ' A' ' 962' ' ' LEU . 14.5 p -80.75 -32.01 12.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 179.214 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -59.72 -42.84 98.13 Favored Glycine 0 N--CA 1.446 -0.674 0 N-CA-C 110.719 -0.953 . . . . 0.0 110.719 174.134 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . 0.569 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 7.7 tt -67.39 -41.35 85.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.822 0.344 . . . . 0.0 110.305 177.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -66.97 -43.45 83.05 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.063 0.459 . . . . 0.0 111.689 -174.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.774 HD13 HD22 ' A' ' 995' ' ' LEU . 4.0 pp -84.94 -26.47 27.18 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.01 -178.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.613 ' HG3' ' N ' ' A' ' 964' ' ' THR . 8.6 ptt180 -66.82 -39.08 87.56 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 118.656 -1.218 . . . . 0.0 109.606 171.149 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . 0.613 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 12.5 m -64.67 -31.51 72.76 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.724 HD23 HD22 ' A' ' 991' ' ' LEU . 54.2 tp -63.44 -51.43 65.75 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 121.561 0.695 . . . . 0.0 109.541 173.436 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.758 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.3 tt -63.36 -37.81 88.73 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 114.52 -1.218 . . . . 0.0 109.081 -175.114 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . 0.493 ' HA ' ' HB3' ' A' ' 970' ' ' ASP . . . -74.37 -28.66 61.22 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.667 179.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.571 HG21 ' HB2' ' A' ' 924' ' ' LYS . 31.4 m -72.0 -32.53 67.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 119.19 0.905 . . . . 0.0 109.214 171.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.667 HG12 HG23 ' A' ' 984' ' ' ILE . 71.3 t -71.35 -40.1 72.79 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.166 171.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.654 ' HB2' HE22 ' A' ' 988' ' ' GLN . 24.8 t70 -69.23 -38.65 78.63 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 122.033 0.921 . . . . 0.0 108.572 -179.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.645 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 6.8 tp10 -63.78 -35.34 80.26 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.583 174.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.443 ' HB2' ' O ' ' A' ' 969' ' ' VAL . 64.8 m -64.9 -17.93 64.75 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.12 174.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.76 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 2.4 tm? -66.18 -53.07 34.78 Favored Pre-proline 0 CA--C 1.537 0.456 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -176.51 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.76 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 94.0 Cg_endo -91.31 -19.31 0.88 Allowed 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 121.236 1.291 . . . . 0.0 114.23 174.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . . . . . . . . . 3.4 t -60.26 -44.27 95.23 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 CA-C-N 118.019 0.372 . . . . 0.0 110.666 177.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.414 HD12 ' HD2' ' A' ' 977' ' ' PRO . 33.8 tp -97.47 106.76 34.85 Favored Pre-proline 0 N--CA 1.447 -0.579 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 173.495 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 0.414 ' HD2' HD12 ' A' ' 976' ' ' LEU . 72.6 Cg_endo -75.75 31.22 0.38 Allowed 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 123.214 2.609 . . . . 0.0 112.765 -176.341 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -109.13 174.66 5.77 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.951 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.665 ' HB2' ' SD ' ' A' 1046 ' ' MET . 7.2 m -76.53 15.82 0.57 Allowed 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.227 0.537 . . . . 0.0 111.32 -178.208 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.84 HG23 ' HB1' ' A' 1042 ' ' ALA . 55.1 m -60.35 -18.77 52.32 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 121.366 0.603 . . . . 0.0 110.1 173.209 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.499 ' HA ' HD12 ' A' ' 984' ' ' ILE . 0.3 OUTLIER -52.56 -25.7 11.23 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 114.816 -1.083 . . . . 0.0 113.825 -176.73 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . 0.669 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 0.0 OUTLIER -84.37 -20.16 32.42 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.396 -0.815 . . . . 0.0 111.6 -177.409 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.558 ' CB ' ' HB2' ' A' 1042 ' ' ALA . 0.3 OUTLIER -78.5 -34.96 47.04 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.808 0.813 . . . . 0.0 109.157 168.912 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.667 HG23 HG12 ' A' ' 969' ' ' VAL . 70.4 mt -69.58 -30.13 44.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 114.459 -1.246 . . . . 0.0 109.31 179.459 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . 0.669 ' HG3' ' O ' ' A' ' 982' ' ' ARG . 2.4 pp20? -70.37 -44.01 68.95 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 121.494 0.664 . . . . 0.0 109.923 179.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 24.9 ttt -72.09 -42.78 65.76 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.474 -173.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.95 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -74.44 -51.77 13.94 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.984 -1.007 . . . . 0.0 112.488 -170.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.758 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 4.2 pt20 -61.87 -23.15 66.11 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.277 177.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . 0.8 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 15.1 tttt -73.07 -37.24 66.87 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.887 171.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.632 HD23 ' OD1' ' A' 1031 ' ' ASP . 15.7 tp -60.37 -57.73 11.5 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 119.616 -0.833 . . . . 0.0 111.89 179.128 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.724 HD22 HD23 ' A' ' 965' ' ' LEU . 11.6 tp -53.42 -33.95 55.93 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.475 0.655 . . . . 0.0 110.162 175.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . 0.8 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 24.6 t-20 -50.04 -53.84 24.22 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.065 -1.425 . . . . 0.0 111.426 -179.417 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 20.0 m -79.57 -26.79 41.27 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 179.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.64 -44.03 75.02 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.569 -0.852 . . . . 0.0 111.011 178.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 0.774 HD22 HD13 ' A' ' 962' ' ' LEU . 0.8 OUTLIER -66.02 -21.93 66.42 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 123.179 0.591 . . . . 0.0 110.478 172.405 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -75.91 -26.16 56.7 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 119.171 -1.012 . . . . 0.0 110.009 171.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -75.38 -43.38 50.59 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 171.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.887 HD22 HD11 ' A' 1028 ' ' LEU . 0.1 OUTLIER -56.37 -48.1 77.54 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.316 -0.857 . . . . 0.0 111.742 -177.683 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.74 HD12 HG13 ' A' ' 955' ' ' VAL . 47.5 mm -69.65 -37.76 74.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.455 -175.018 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 11.7 m-80 -63.66 -36.1 82.73 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 121.126 0.489 . . . . 0.0 111.83 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.586 ' HD3' ' HB3' ' A' 1020 ' ' GLN . 35.2 mttp -82.47 -35.34 27.56 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.477 0.656 . . . . 0.0 110.453 -176.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.959 ' HG3' ' HB3' ' A' ' 951' ' ' TYR . 15.2 tpp -60.42 -29.45 69.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 122.423 1.106 . . . . 0.0 108.514 173.406 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . . . . . . . . . 2.7 tptm -73.69 -52.66 12.54 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 113.865 -1.516 . . . . 0.0 111.04 -167.02 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.733 ' HA ' ' HB2' ' A' 1007 ' ' GLN . 7.8 mp -76.8 -13.43 60.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.731 -178.393 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.737 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -69.12 -44.58 72.08 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 119.317 -0.953 . . . . 0.0 109.434 179.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.78 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 2.9 pp0? -71.86 -34.03 68.89 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 120.127 -0.629 . . . . 0.0 111.435 170.134 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.733 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 51.8 mt-30 -47.14 -48.95 23.19 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.993 0.425 . . . . 0.0 110.901 176.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.832 ' HB2' HD13 ' A' 1013 ' ' LEU . 89.0 m-85 -125.15 47.75 2.12 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.191 -0.603 . . . . 0.0 110.529 171.465 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 1.038 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 12.5 p -51.76 -22.04 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 115.087 -0.961 . . . . 0.0 110.434 171.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . 0.469 ' O ' HG23 ' A' 1011 ' ' THR . 22.7 mmt -41.67 -36.61 1.0 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.402 -1.272 . . . . 0.0 111.961 176.117 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . 0.469 HG23 ' O ' ' A' 1010 ' ' MET . 0.2 OUTLIER -167.7 -92.42 0.01 OUTLIER 'General case' 0 C--O 1.246 0.911 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 176.522 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 12.2 m -53.1 -64.62 0.76 Allowed 'General case' 0 C--O 1.237 0.408 0 CA-C-N 114.571 -1.195 . . . . 0.0 113.311 -164.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.832 HD13 ' HB2' ' A' 1008 ' ' TYR . 4.1 mp -52.7 -40.28 62.81 Favored 'General case' 0 CA--C 1.496 -1.099 0 O-C-N 123.25 0.343 . . . . 0.0 111.365 -177.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 1.038 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.09 -48.33 70.8 Favored 'General case' 0 N--CA 1.44 -0.93 0 O-C-N 123.639 0.587 . . . . 0.0 110.506 -168.206 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.539 ' O ' ' HD3' ' A' 1019 ' ' LYS . 25.1 mt-30 -71.39 -47.92 53.18 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 120.343 -0.543 . . . . 0.0 111.605 -179.076 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -67.5 -56.33 9.98 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.148 0.499 . . . . 0.0 111.25 -176.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.737 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 10.3 m-85 -56.46 -38.6 71.89 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.283 -177.148 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.915 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 22.9 tptm -80.01 -30.89 39.68 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 114.865 -1.061 . . . . 0.0 110.808 -177.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . 0.539 ' HD3' ' O ' ' A' 1015 ' ' GLN . 1.6 mptm? -70.87 -52.88 17.52 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 174.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . 0.586 ' HB3' ' HD3' ' A' 1001 ' ' LYS . 25.3 mt-30 -50.79 -32.86 21.21 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.107 164.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.49 ' SD ' HD12 ' A' ' 998' ' ' LEU . 10.7 tmm? -65.73 -50.73 63.74 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 177.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . 0.77 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -81.08 -5.01 57.14 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 119.301 -0.96 . . . . 0.0 109.707 -177.023 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 87.4 m -88.21 -35.9 17.08 Favored 'General case' 0 C--O 1.223 -0.306 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 173.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.555 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -77.76 -21.73 51.31 Favored 'General case' 0 C--O 1.22 -0.478 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 170.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.856 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -85.34 -24.09 27.77 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.368 169.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.614 ' O ' HG23 ' A' 1030 ' ' VAL . 28.4 t60 -76.97 -24.14 52.3 Favored 'General case' 0 C--O 1.215 -0.743 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 166.095 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . 0.459 ' HA ' ' HB ' ' A' 1030 ' ' VAL . . . -73.23 -39.81 65.18 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 123.88 0.872 . . . . 0.0 109.875 165.068 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.887 HD11 HD22 ' A' ' 998' ' ' LEU . 39.7 mt -59.68 -45.11 93.07 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 168.237 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -61.45 -34.88 76.17 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.592 0.234 . . . . 0.0 111.41 173.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.614 HG23 ' O ' ' A' 1026 ' ' HIS . 4.3 t -66.85 -50.33 66.16 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -179.49 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.773 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 34.2 t70 -74.55 -28.4 60.94 Favored 'General case' 0 C--O 1.206 -1.212 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.424 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.616 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -55.16 -45.59 75.71 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 171.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.426 ' O ' ' HB2' ' A' 1037 ' ' ASP . 78.0 tttt -67.82 -40.7 83.76 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.421 174.003 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.773 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 7.0 t30 -77.96 -56.1 4.76 Favored 'General case' 0 C--O 1.221 -0.444 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.176 -170.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.95 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 0.2 OUTLIER -61.37 -39.99 92.69 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 118.978 -0.534 . . . . 0.0 110.654 -175.025 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.653 HD13 ' N ' ' A' 1037 ' ' ASP . 0.0 OUTLIER -72.94 -29.57 63.2 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 116.029 -2.268 . . . . 0.0 109.644 -179.372 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.653 ' N ' HD13 ' A' 1036 ' ' LEU . 15.2 t70 -63.03 -41.92 99.65 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-O 122.116 0.96 . . . . 0.0 109.314 174.349 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' 1034 ' ' ASN . 36.3 t -59.95 -45.48 95.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 113.764 -1.562 . . . . 0.0 111.591 177.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.658 HD11 ' HA ' ' A' ' 984' ' ' ILE . 2.0 mp -72.79 -31.63 37.28 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 C-N-CA 119.972 -0.691 . . . . 0.0 110.917 174.064 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.626 ' HB3' HG23 ' A' ' 919' ' ' ILE . 1.7 t0 -58.54 -46.34 87.03 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.317 0.579 . . . . 0.0 109.746 170.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.486 ' HG3' ' O ' ' A' 1037 ' ' ASP . 78.2 mt-30 -60.36 -49.43 77.61 Favored 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 173.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.84 ' HB1' HG23 ' A' ' 980' ' ' THR . . . -54.2 -52.27 61.77 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 114.279 -1.328 . . . . 0.0 113.353 -173.146 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.703 ' O ' HG12 ' A' 1047 ' ' ILE . 0.0 OUTLIER -64.07 -41.24 97.4 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 -176.2 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.62 ' HG ' ' CA ' ' A' ' 918' ' ' GLY . 3.0 tm? -72.4 -43.35 64.04 Favored 'General case' 0 N--CA 1.44 -0.94 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 -177.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.635 ' HB3' ' HB2' ' A' 1053 ' ' HIS . 22.8 mttp -50.65 -41.39 55.25 Favored 'General case' 0 C--O 1.213 -0.853 0 CA-C-N 114.689 -1.141 . . . . 0.0 109.659 172.568 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.665 ' SD ' ' HB2' ' A' ' 979' ' ' SER . 10.3 mmt -84.17 -23.42 30.6 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -179.261 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.703 HG12 ' O ' ' A' 1043 ' ' ARG . 23.5 mm -59.69 -42.62 89.16 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.396 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 174.335 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 48.9 m -141.96 72.54 1.38 Allowed 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.994 176.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.13 157.45 22.79 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.865 179.202 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 5.0 t -164.83 -38.01 0.03 OUTLIER 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 -177.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . 0.451 ' HB2' ' HD3' ' A' 1052 ' ' PRO . 52.2 mtp180 -143.42 -58.31 0.02 OUTLIER Pre-proline 0 CA--C 1.537 0.467 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.711 175.295 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . 0.451 ' HD3' ' HB2' ' A' 1051 ' ' ARG . 13.1 Cg_endo -89.81 103.32 0.34 Allowed 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 122.251 1.967 . . . . 0.0 114.556 -168.02 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . 0.635 ' HB2' ' HB3' ' A' 1045 ' ' LYS . 33.5 t-80 . . . . . 0 N--CA 1.467 0.407 0 CA-C-N 115.417 -0.81 . . . . 0.0 108.932 169.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.749 0 N-CA-C 111.991 -0.444 . . . . 0.0 111.991 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 909' ' ' SER . . . . . 0.584 ' N ' ' HD2' ' A' ' 910' ' ' PRO . 14.1 m -52.66 -49.38 86.54 Favored Pre-proline 0 CA--C 1.538 0.494 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -177.151 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 910' ' ' PRO . . . . . 0.584 ' HD2' ' N ' ' A' ' 909' ' ' SER . 6.3 Cg_exo -39.7 -43.73 3.22 Favored 'Trans proline' 0 C--N 1.366 1.461 0 C-N-CA 123.616 2.877 . . . . 0.0 113.776 179.068 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . 151.36 72.22 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.013 -1.089 . . . . 0.0 113.614 176.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 30.1 pt -80.29 -13.67 13.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.323 0.582 . . . . 0.0 109.946 173.216 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 19.1 p -145.78 103.98 3.82 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.957 178.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . -152.67 -82.36 0.04 OUTLIER Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.83 -0.7 . . . . 0.0 111.91 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . -73.79 -59.79 3.91 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.691 -0.766 . . . . 0.0 111.623 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . 134.07 -81.8 0.3 Allowed Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.212 178.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . -176.93 -137.98 2.82 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 121.09 -0.576 . . . . 0.0 112.041 -179.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . 0.605 ' HA2' HD13 ' A' 1044 ' ' LEU . . . 82.05 144.86 4.93 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 121.017 -0.611 . . . . 0.0 111.639 -177.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 919' ' ' ILE . . . . . 0.506 ' HA ' ' HB3' ' A' 1040 ' ' ASP . 0.2 OUTLIER -73.54 99.68 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.409 -2.488 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 178.695 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.445 ' H ' ' CG ' ' A' 1040 ' ' ASP . 47.2 ttt180 -177.26 -35.67 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.341 -166.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 20.4 m -69.01 106.82 2.9 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.002 -172.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.452 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 7.0 t30 -63.58 -45.76 88.93 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.306 -177.096 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.713 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 8.5 m-20 48.2 176.74 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 175.384 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.488 ' HB2' HG21 ' A' ' 968' ' ' THR . 27.8 mmtp -56.04 -21.19 20.27 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.105 -1.407 . . . . 0.0 112.605 178.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.885 ' HA ' HD21 ' A' ' 928' ' ' ASN . 16.3 m -65.87 -28.76 44.86 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.394 0 CA-C-O 120.96 0.41 . . . . 0.0 110.575 178.237 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.713 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.1 OUTLIER -78.71 -31.76 46.64 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.814 172.326 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -77.08 -24.14 51.89 Favored 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 118.837 -1.145 . . . . 0.0 113.528 -177.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.885 HD21 ' HA ' ' A' ' 925' ' ' VAL . 8.8 p30 -70.75 -45.8 64.14 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 118.388 -1.325 . . . . 0.0 109.106 166.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.626 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 98.3 t -53.04 -33.84 20.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 N-CA-C 113.809 1.041 . . . . 0.0 113.809 171.031 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . . . . . . . . . 33.1 m -62.05 -43.42 98.88 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 119.884 1.22 . . . . 0.0 108.836 174.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -67.8 -51.73 33.49 Favored Glycine 0 CA--C 1.53 1.025 0 CA-C-N 114.65 -1.159 . . . . 0.0 113.574 175.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.626 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.8 pp -65.66 -49.13 69.76 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -174.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.455 HG23 HG13 ' A' ' 929' ' ' VAL . 53.3 t -65.89 -37.97 81.07 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.417 0 CA-C-O 121.101 0.477 . . . . 0.0 110.466 -176.007 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.55 ' HD2' ' C ' ' A' ' 934' ' ' LYS . 4.1 tmmm? -58.51 -41.01 84.44 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.99 178.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -67.45 -31.69 72.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.804 0.335 . . . . 0.0 111.498 -179.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.762 HG22 ' HB1' ' A' 1025 ' ' ALA . 80.2 t -54.45 -65.92 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.052 178.502 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 25.6 pt -70.24 -39.33 76.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.414 -178.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.458 ' HG2' ' HD3' ' A' ' 942' ' ' LYS . 40.1 tt0 -65.51 -52.21 54.34 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 120.194 -0.602 . . . . 0.0 110.451 -173.577 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.501 ' HB3' ' OE2' ' A' ' 949' ' ' GLU . 1.4 mpt? -70.52 -24.97 62.92 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.462 -176.286 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.548 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 28.7 p -58.63 -39.0 79.26 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.737 -171.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . 0.57 ' HA ' ' HG3' ' A' ' 944' ' ' GLN . 17.1 p -98.11 -8.78 26.98 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.561 -178.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.458 ' HD3' ' HG2' ' A' ' 938' ' ' GLU . 22.0 mtpp -81.78 -9.86 59.51 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 175.437 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.928 HG12 ' HG2' ' A' 1018 ' ' LYS . 2.5 pp -87.9 -9.73 10.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 C-N-CA 120.477 -0.489 . . . . 0.0 111.719 169.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.57 ' HG3' ' HA ' ' A' ' 941' ' ' SER . 40.2 mt-30 -63.56 -48.58 80.63 Favored Pre-proline 0 CA--C 1.531 0.235 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.087 178.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -65.22 118.36 5.37 Favored 'Trans proline' 0 C--N 1.351 0.705 0 N-CA-C 107.216 -1.879 . . . . 0.0 107.216 156.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . . . . . . . . . . . -107.95 65.3 0.25 Allowed Pre-proline 0 CA--C 1.535 0.383 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 -160.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -87.71 128.62 2.47 Favored 'Trans proline' 0 N--CA 1.449 -1.132 0 C-N-CA 121.774 1.649 . . . . 0.0 108.005 149.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.706 ' HB3' HG11 ' A' 1009 ' ' VAL . 38.8 Cg_exo -49.95 117.93 3.46 Favored 'Trans proline' 0 CA--C 1.513 -0.527 0 C-N-CA 121.98 1.787 . . . . 0.0 112.801 -172.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.554 ' C ' ' H ' ' A' ' 951' ' ' TYR . 30.3 tt0 -59.68 -22.27 61.72 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 172.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.64 ' HB2' ' HG2' ' A' ' 953' ' ' PRO . 35.0 mt-10 71.88 -14.77 0.49 Allowed 'General case' 0 C--N 1.344 0.357 0 CA-C-N 114.87 -1.059 . . . . 0.0 109.799 -173.493 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.827 ' HE1' HG21 ' A' ' 943' ' ' ILE . 30.9 m-85 55.13 -42.94 0.02 OUTLIER 'General case' 0 C--O 1.217 -0.617 0 C-N-CA 125.309 1.444 . . . . 0.0 114.544 175.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 0.601 ' HA ' ' CG2' ' A' ' 955' ' ' VAL . 46.9 t -53.15 -45.38 98.3 Favored Pre-proline 0 C--N 1.319 -0.737 0 C-N-CA 122.944 0.497 . . . . 0.0 111.256 170.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 0.64 ' HG2' ' HB2' ' A' ' 950' ' ' GLU . 48.8 Cg_exo -51.53 -38.31 64.32 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 122.071 1.847 . . . . 0.0 112.078 172.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.436 ' O ' HG12 ' A' ' 958' ' ' VAL . 7.0 tpt -77.45 -32.48 54.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.076 -0.966 . . . . 0.0 110.644 175.624 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.65 HG22 ' SD ' ' A' 1002 ' ' MET . 88.9 t -52.92 -38.71 29.42 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 167.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.546 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 12.4 tmtt? -66.87 -35.48 80.11 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.451 175.346 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 76.3 mm-40 -78.66 -46.79 18.36 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -177.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.527 ' O ' ' HG ' ' A' ' 962' ' ' LEU . 11.2 p -83.58 -30.36 7.92 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.365 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.299 -178.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -61.09 -38.89 96.31 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 110.617 -0.993 . . . . 0.0 110.617 174.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . 0.581 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 9.4 tt -70.15 -36.41 74.72 Favored 'General case' 0 C--O 1.223 -0.296 0 CA-C-O 120.935 0.397 . . . . 0.0 110.146 177.297 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.577 ' O ' ' HB2' ' A' ' 928' ' ' ASN . . . -72.68 -42.56 64.12 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.152 0.501 . . . . 0.0 111.523 -176.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 1.05 HD13 HD22 ' A' ' 995' ' ' LEU . 4.1 pp -81.5 -24.63 36.57 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.466 -179.167 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.581 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 4.9 ptp180 -73.73 -31.04 63.18 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 119.159 -1.017 . . . . 0.0 109.934 168.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . 0.402 HG22 ' HB3' ' A' ' 928' ' ' ASN . 93.1 m -62.86 -32.52 73.77 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 174.025 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.996 HD23 HD22 ' A' ' 991' ' ' LEU . 63.5 tp -65.46 -55.66 16.7 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.235 174.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.534 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 9.5 tt -55.54 -41.18 72.86 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 114.199 -1.364 . . . . 0.0 109.901 -175.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -72.43 -36.74 68.65 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.289 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.488 HG21 ' HB2' ' A' ' 924' ' ' LYS . 22.2 m -66.29 -42.04 88.95 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.446 176.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.733 HG12 HG23 ' A' ' 984' ' ' ILE . 18.0 t -73.22 -33.55 41.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.929 178.412 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.891 ' HB2' HE22 ' A' ' 988' ' ' GLN . 7.6 t70 -68.16 -42.46 80.02 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 122.087 0.946 . . . . 0.0 108.815 178.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.658 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 31.9 tt0 -69.82 -29.86 67.23 Favored 'General case' 0 N--CA 1.439 -0.983 0 CA-C-N 114.082 -1.417 . . . . 0.0 109.874 178.114 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 73.2 m -67.21 -17.66 64.91 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.664 174.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.701 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 10.2 tt -68.64 -51.69 21.14 Favored Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 121.064 -0.254 . . . . 0.0 110.39 -178.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.701 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 2.6 Cg_endo -84.95 -27.62 1.16 Allowed 'Trans proline' 0 C--N 1.359 1.08 0 C-N-CA 121.771 1.647 . . . . 0.0 114.206 174.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . . . . . . . . . 52.3 t -73.33 -40.69 57.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 O-C-N 122.155 -0.341 . . . . 0.0 111.376 -177.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.793 ' HB3' ' HD2' ' A' ' 977' ' ' PRO . 90.5 mt -82.2 178.92 2.15 Favored Pre-proline 0 C--N 1.325 -0.473 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 176.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 0.793 ' HD2' ' HB3' ' A' ' 976' ' ' LEU . 4.6 Cg_exo -41.34 127.38 3.06 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 122.692 2.261 . . . . 0.0 111.775 173.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -56.04 -36.51 68.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.632 -0.713 . . . . 0.0 112.29 -169.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.616 ' HB2' ' SD ' ' A' 1046 ' ' MET . 10.7 m -87.07 3.18 47.16 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 -175.349 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.7 HG23 ' HB1' ' A' 1042 ' ' ALA . 74.7 m -74.4 -10.33 59.47 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.595 0.712 . . . . 0.0 109.184 170.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.574 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 1.7 p80 -48.88 -35.28 14.4 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 114.214 -1.357 . . . . 0.0 114.563 -174.367 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . 0.402 ' HA ' ' OE2' ' A' ' 985' ' ' GLU . 3.8 ptp180 -78.96 -19.33 51.96 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 118.867 0.758 . . . . 0.0 111.062 -169.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.57 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 0.0 OUTLIER -76.52 -37.94 55.93 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 120.401 -0.52 . . . . 0.0 109.865 171.928 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.803 HG13 HG12 ' A' 1039 ' ' ILE . 3.6 mp -66.51 -35.75 75.63 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.486 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 175.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . 0.574 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 40.5 mt-10 -56.99 -52.88 63.51 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.598 178.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 89.9 mtp -70.57 -39.88 73.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.478 -174.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.997 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -76.9 -52.41 9.5 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.868 -1.06 . . . . 0.0 112.792 -169.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.891 HE22 ' HB2' ' A' ' 970' ' ' ASP . 3.7 pt20 -64.32 -24.88 67.8 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 121.6 0.714 . . . . 0.0 109.498 179.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . 0.798 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 31.7 tttm -73.39 -38.87 65.49 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.748 -1.115 . . . . 0.0 111.742 172.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.5 ' HG ' ' OD2' ' A' 1031 ' ' ASP . 17.1 tp -57.39 -58.27 9.02 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.423 -0.511 . . . . 0.0 112.275 178.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.996 HD22 HD23 ' A' ' 965' ' ' LEU . 13.6 tp -55.03 -34.45 63.52 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-O 121.365 0.602 . . . . 0.0 110.085 175.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . 0.798 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 24.7 t-20 -48.47 -53.21 18.8 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.197 -1.365 . . . . 0.0 111.606 -178.163 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 6.5 p -77.6 -29.95 52.2 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 120.591 -0.443 . . . . 0.0 112.131 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . 0.438 ' O ' ' HB2' ' A' ' 997' ' ' GLU . 0.9 OUTLIER -69.76 -39.04 76.95 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 119.646 -0.822 . . . . 0.0 110.741 -179.866 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 1.05 HD22 HD13 ' A' ' 962' ' ' LEU . 2.2 pp -68.41 -17.44 64.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.7 171.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -78.43 -24.38 46.18 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 119.523 -0.871 . . . . 0.0 110.259 168.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.654 ' O ' ' HG2' ' A' 1001 ' ' LYS . 71.6 mm-40 -72.08 -45.99 58.55 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 172.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.726 HD22 HD11 ' A' 1028 ' ' LEU . 0.2 OUTLIER -56.03 -46.76 78.74 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.752 -178.147 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.761 ' HA ' ' SD ' ' A' 1002 ' ' MET . 84.1 mt -66.99 -36.8 78.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.428 -173.392 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 19.9 m-80 -64.05 -35.36 80.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.124 0.488 . . . . 0.0 111.5 177.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.654 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 44.7 mmtm -77.4 -45.28 26.38 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.78 0.8 . . . . 0.0 109.792 -174.258 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 1.01 ' HB3' ' HG3' ' A' 1021 ' ' MET . 7.1 ptm -63.76 -25.92 68.41 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 122.165 0.983 . . . . 0.0 108.973 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.619 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 9.4 tptm -69.55 -52.66 24.26 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.439 -167.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.804 HD13 ' HG3' ' A' 1007 ' ' GLN . 4.0 mm? -75.33 -12.59 60.3 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.483 -0.781 . . . . 0.0 111.592 179.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.754 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -71.96 -37.78 69.87 Favored 'General case' 0 C--O 1.213 -0.828 0 C-N-CA 119.389 -0.924 . . . . 0.0 110.52 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.695 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.4 pp0? -76.3 -30.69 57.85 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 119.105 -0.474 . . . . 0.0 110.984 173.132 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.804 ' HG3' HD13 ' A' 1004 ' ' LEU . 17.2 mm-40 -48.3 -49.28 34.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.393 0.616 . . . . 0.0 109.989 175.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.504 ' HB2' HD12 ' A' 1013 ' ' LEU . 68.7 m-85 -129.09 55.04 1.76 Allowed 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 121.483 0.659 . . . . 0.0 110.419 170.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.995 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 4.7 p -56.51 -25.54 21.15 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.527 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.786 168.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 59.8 mtt -74.01 1.32 11.21 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 114.818 -1.083 . . . . 0.0 111.081 176.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . 0.593 HG22 ' H ' ' A' 1012 ' ' SER . 0.2 OUTLIER -151.63 -154.77 0.56 Allowed 'General case' 0 C--O 1.26 1.606 0 CA-C-O 122.9 1.333 . . . . 0.0 114.043 -176.357 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . 0.593 ' H ' HG22 ' A' 1011 ' ' THR . 15.1 m -59.06 -43.84 91.77 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 113.902 -1.499 . . . . 0.0 112.376 -170.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.669 ' O ' ' HB2' ' A' 1017 ' ' TYR . 13.2 mt -48.6 -43.23 35.94 Favored 'General case' 0 CA--C 1.494 -1.183 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.888 178.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 0.995 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.72 -54.08 46.56 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-O 121.521 0.677 . . . . 0.0 109.798 -171.374 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -67.01 -44.94 79.02 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 114.283 -1.326 . . . . 0.0 110.825 -174.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -65.67 -56.21 13.37 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.296 0.569 . . . . 0.0 111.799 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.754 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 6.7 m-85 -62.02 -34.52 76.37 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.988 -1.005 . . . . 0.0 113.149 -172.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.928 ' HG2' HG12 ' A' ' 943' ' ' ILE . 55.6 tptt -80.61 -30.72 36.77 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.74 -176.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -73.0 -49.79 26.88 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 174.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -54.65 -30.54 55.5 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 114.999 -1.001 . . . . 0.0 110.782 165.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 1.01 ' HG3' ' HB3' ' A' 1002 ' ' MET . 2.5 ttp -68.95 -48.16 63.89 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 175.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' 1022 ' ' LEU . 0.0 OUTLIER -79.13 -12.28 59.99 Favored 'General case' 0 C--O 1.216 -0.702 0 C-N-CA 119.835 -0.746 . . . . 0.0 109.977 -177.016 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 97.8 m -84.45 -36.07 22.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.111 175.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.52 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.73 -22.08 47.09 Favored 'General case' 0 C--O 1.222 -0.369 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 171.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.762 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -84.92 -21.98 29.45 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.877 -0.602 . . . . 0.0 109.887 169.069 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.509 ' O ' HG23 ' A' 1030 ' ' VAL . 8.5 t60 -76.0 -27.18 57.32 Favored 'General case' 0 C--O 1.217 -0.624 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 165.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . 0.448 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -69.27 -39.94 78.09 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 123.355 0.662 . . . . 0.0 110.09 164.045 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.726 HD11 HD22 ' A' ' 998' ' ' LEU . 26.0 mt -61.3 -44.61 96.92 Favored 'General case' 0 C--N 1.315 -0.921 0 C-N-CA 120.353 -0.539 . . . . 0.0 109.615 170.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -59.09 -40.28 84.81 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.529 0.204 . . . . 0.0 111.476 173.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.509 HG23 ' O ' ' A' 1026 ' ' HIS . 9.5 t -69.11 -46.31 78.41 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 CA-C-O 121.7 0.762 . . . . 0.0 110.179 -178.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.5 ' OD2' ' HG ' ' A' ' 990' ' ' LEU . 5.5 t70 -71.84 -42.54 66.81 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 114.339 -1.301 . . . . 0.0 110.187 -174.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.601 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -59.98 -36.27 76.8 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 174.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 36.4 tttm -66.14 -55.01 18.52 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.631 0.729 . . . . 0.0 110.001 173.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.47 ' O ' ' HB3' ' A' 1037 ' ' ASP . 9.6 t30 -64.91 -48.66 73.38 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 114.587 -1.188 . . . . 0.0 112.552 -172.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.997 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 2.0 pp -63.99 -40.67 96.89 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 119.401 -0.333 . . . . 0.0 110.108 -176.382 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.638 HD22 HG23 ' A' ' 925' ' ' VAL . 4.0 pp -70.59 -33.68 71.33 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 117.232 -1.787 . . . . 0.0 109.618 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.47 ' HB3' ' O ' ' A' 1034 ' ' ASN . 18.3 t70 -58.25 -44.36 88.27 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.654 173.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.46 ' HB ' ' O ' ' A' 1035 ' ' LEU . 24.8 t -55.09 -39.38 50.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 113.708 -1.587 . . . . 0.0 111.269 174.284 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.803 HG12 HG13 ' A' ' 984' ' ' ILE . 1.7 mp -80.45 -33.13 13.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.374 176.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.506 ' HB3' ' HA ' ' A' ' 919' ' ' ILE . 0.4 OUTLIER -55.61 -44.26 76.85 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 121.536 0.684 . . . . 0.0 109.482 170.874 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -70.06 -39.22 75.81 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.058 174.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.7 ' HB1' HG23 ' A' ' 980' ' ' THR . . . -55.62 -52.51 63.55 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -177.414 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.648 ' HG2' ' O ' ' A' 1039 ' ' ILE . 5.7 ptm180 -66.1 -41.14 91.02 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 -176.379 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.605 HD13 ' HA2' ' A' ' 918' ' ' GLY . 44.5 tp -61.71 -43.73 98.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.987 -0.552 . . . . 0.0 109.895 174.225 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.7 ' O ' ' HB2' ' A' 1049 ' ' GLN . 50.4 mtpt -67.15 -22.37 65.78 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.13 -177.529 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.64 ' HA ' ' CE ' ' A' 1046 ' ' MET . 2.6 mmt -93.52 -24.29 18.04 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 172.019 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.577 HD11 ' HG3' ' A' ' 977' ' ' PRO . 44.6 mm -91.97 -64.58 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.895 0.379 . . . . 0.0 110.659 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . 0.543 ' HB3' ' NE2' ' A' 1049 ' ' GLN . 9.8 t -59.94 -34.37 73.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.654 0.74 . . . . 0.0 110.611 -179.611 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . 0.7 ' HB2' ' O ' ' A' 1045 ' ' LYS . 1.4 mp0 -96.12 155.4 16.77 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.543 -174.401 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 16.1 m -118.61 11.54 12.86 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.507 177.118 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . 0.743 ' HB3' ' HD3' ' A' 1052 ' ' PRO . 12.3 ttm180 -165.04 -54.35 0.01 OUTLIER Pre-proline 0 CA--C 1.538 0.496 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -178.068 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . 0.743 ' HD3' ' HB3' ' A' 1051 ' ' ARG . 31.6 Cg_exo -61.33 87.34 0.09 OUTLIER 'Trans proline' 0 C--N 1.359 1.108 0 C-N-CA 122.751 2.301 . . . . 0.0 113.822 -179.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . 0.689 ' HA ' ' HE2' ' A' 1045 ' ' LYS . 35.5 t-80 . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.359 172.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.82 0 N-CA-C 111.813 -0.515 . . . . 0.0 111.813 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 4.9 p -158.49 107.9 1.66 Allowed Pre-proline 0 C--N 1.324 -0.519 0 CA-C-O 120.643 0.258 . . . . 0.0 110.747 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -65.64 -19.44 59.98 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 123.469 2.78 . . . . 0.0 113.132 -176.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -69.66 -21.99 76.56 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.976 -0.63 . . . . 0.0 112.587 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 47.0 mm -72.96 129.9 35.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 120.596 0.236 . . . . 0.0 110.452 -179.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 44.1 m -56.76 113.11 1.51 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.348 0.594 . . . . 0.0 111.225 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 119.74 -25.07 7.74 Favored Glycine 0 N--CA 1.444 -0.773 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.712 -178.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 98.3 -29.32 11.59 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.484 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . 134.88 -148.33 19.5 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 121.067 -0.587 . . . . 0.0 111.806 179.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . 99.74 -172.06 24.47 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.206 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . 101.2 -130.57 10.27 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.296 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 919' ' ' ILE . . . . . 0.619 ' HA ' ' HB3' ' A' 1040 ' ' ASP . 0.1 OUTLIER -75.77 127.01 37.12 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.835 0 C-N-CA 123.217 0.607 . . . . 0.0 110.0 -177.009 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 920' ' ' ARG . 14.7 ptt180 -163.69 -15.69 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 113.646 0.98 . . . . 0.0 113.646 -178.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 25.7 p -153.37 101.16 2.5 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 119.548 -0.861 . . . . 0.0 112.561 -172.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.597 ' CG ' HD11 ' A' 1036 ' ' LEU . 1.4 p-10 -138.88 133.7 32.3 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.222 177.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.418 ' O ' ' CD1' ' A' ' 926' ' ' TYR . 7.3 m-20 -103.12 -75.64 0.6 Allowed 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -177.053 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.717 ' HB2' HG21 ' A' ' 968' ' ' THR . 0.0 OUTLIER -70.52 -53.52 15.85 Favored 'General case' 0 C--N 1.311 -1.068 0 N-CA-C 114.444 1.276 . . . . 0.0 114.444 -170.5 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.683 ' H ' ' HD2' ' A' ' 924' ' ' LYS . 4.1 t -53.62 -40.57 42.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 CA-C-N 119.148 0.886 . . . . 0.0 111.895 -169.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.418 ' CD1' ' O ' ' A' ' 923' ' ' ASP . 0.7 OUTLIER -80.03 -20.94 44.17 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.084 -179.777 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . 0.587 ' HG2' ' O ' ' A' ' 924' ' ' LYS . 9.3 pt-20 -76.71 -24.17 53.11 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 120.173 1.351 . . . . 0.0 109.542 169.286 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.55 ' OD1' ' HA ' ' A' ' 925' ' ' VAL . 1.1 m120 -68.57 -29.7 68.31 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 170.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.578 ' HA ' ' CD2' ' A' ' 932' ' ' LEU . 44.3 t -80.5 -30.24 12.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 114.726 -1.125 . . . . 0.0 109.841 175.258 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.457 ' OG1' ' HA ' ' A' ' 927' ' ' GLU . 31.1 m -57.36 -43.4 83.47 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 168.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -66.55 -52.35 35.43 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-N 114.518 -1.219 . . . . 0.0 114.106 176.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.578 ' CD2' ' HA ' ' A' ' 929' ' ' VAL . 2.2 pp -65.29 -49.32 69.96 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -175.269 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.456 HG22 ' CB ' ' A' 1029 ' ' ALA . 76.7 t -62.1 -42.17 94.0 Favored 'Isoleucine or valine' 0 C--O 1.242 0.68 0 CA-C-O 121.399 0.619 . . . . 0.0 110.312 -176.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.472 ' O ' ' HB2' ' A' ' 938' ' ' GLU . 4.7 tmmm? -58.52 -39.04 79.02 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.612 -1.176 . . . . 0.0 109.906 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 0.56 ' HA ' ' SD ' ' A' ' 939' ' ' MET . . . -66.75 -35.41 80.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.569 0.223 . . . . 0.0 111.169 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.673 HG22 ' HB1' ' A' 1025 ' ' ALA . 59.8 t -53.24 -77.12 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.687 -179.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.511 ' O ' ' HB2' ' A' ' 940' ' ' SER . 27.1 pt -67.43 -42.57 87.4 Favored 'Isoleucine or valine' 0 C--O 1.249 1.062 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -174.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.472 ' HB2' ' O ' ' A' ' 934' ' ' LYS . 7.5 mm-40 -66.49 -46.5 76.1 Favored 'General case' 0 C--N 1.315 -0.929 0 C-N-CA 120.932 -0.307 . . . . 0.0 110.928 -170.149 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.56 ' SD ' ' HA ' ' A' ' 935' ' ' ALA . 1.0 OUTLIER -69.84 -28.33 65.6 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.174 178.032 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.751 ' HA ' ' NZ ' ' A' 1018 ' ' LYS . 4.6 m -51.79 -45.02 63.66 Favored 'General case' 0 CA--C 1.514 -0.434 0 O-C-N 123.542 0.526 . . . . 0.0 112.355 -171.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 18.1 m -106.63 -22.5 12.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.109 -177.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.437 ' C ' ' HD3' ' A' ' 942' ' ' LYS . 7.6 tmtm? -84.01 -58.72 2.66 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 119.445 -0.902 . . . . 0.0 110.87 -169.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.864 HG23 ' HG2' ' A' ' 949' ' ' GLU . 10.5 tp -77.81 0.92 2.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 121.163 0.506 . . . . 0.0 110.62 -178.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.544 ' HB2' ' OE2' ' A' ' 949' ' ' GLU . 18.3 tt0 -106.41 77.56 0.47 Allowed Pre-proline 0 CA--C 1.541 0.608 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.469 176.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.681 ' HD3' ' O ' ' A' ' 943' ' ' ILE . 11.3 Cg_endo -93.84 -69.26 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 123.157 2.571 . . . . 0.0 111.845 177.392 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.842 ' H ' ' HD2' ' A' ' 947' ' ' PRO . . . -135.92 -48.31 0.02 OUTLIER Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.031 176.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.842 ' HD2' ' H ' ' A' ' 946' ' ' ALA . 60.6 Cg_endo -73.35 162.36 40.51 Favored 'Trans proline' 0 C--N 1.356 0.941 0 C-N-CA 121.852 1.701 . . . . 0.0 111.114 169.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.561 ' HA ' HG21 ' A' 1009 ' ' VAL . 29.9 Cg_endo -64.04 155.79 62.55 Favored 'Trans proline' 0 N--CA 1.464 -0.244 0 C-N-CA 122.183 1.922 . . . . 0.0 112.597 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.864 ' HG2' HG23 ' A' ' 943' ' ' ILE . 51.1 mt-10 -74.99 7.11 3.45 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-N 115.204 -0.907 . . . . 0.0 111.331 178.43 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.601 ' HB3' ' HG2' ' A' ' 953' ' ' PRO . 1.0 OUTLIER 50.09 64.37 1.81 Allowed 'General case' 0 N--CA 1.44 -0.964 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -163.899 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 1.029 ' HB3' ' HG3' ' A' 1002 ' ' MET . 16.5 m-85 -52.62 -51.75 58.61 Favored 'General case' 0 C--O 1.214 -0.79 0 CA-C-N 114.557 -1.201 . . . . 0.0 113.175 -174.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 0.784 ' O ' HG12 ' A' ' 955' ' ' VAL . 66.6 t -53.82 -54.06 50.81 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 117.949 0.34 . . . . 0.0 111.142 174.079 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 0.721 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 12.8 Cg_exo -48.3 -43.82 30.88 Favored 'Trans proline' 0 CA--C 1.545 1.071 0 C-N-CA 121.703 1.602 . . . . 0.0 113.413 170.588 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.417 ' HE1' ' HB1' ' A' ' 935' ' ' ALA . 5.2 tpt -71.12 -48.21 53.56 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.547 0.739 . . . . 0.0 112.023 -179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.784 HG12 ' O ' ' A' ' 952' ' ' VAL . 0.3 OUTLIER -54.27 -29.65 19.8 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.772 169.059 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.531 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 9.5 tmtt? -68.64 -31.61 70.87 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.585 0.231 . . . . 0.0 111.296 169.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . 0.673 ' HG2' ' O ' ' A' ' 953' ' ' PRO . 18.6 mm-40 -77.76 -44.69 26.84 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.395 0.617 . . . . 0.0 110.247 -176.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.458 HG12 ' HA ' ' A' ' 955' ' ' VAL . 7.3 p -77.01 -27.38 16.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.283 178.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . 0.508 ' HA2' HD11 ' A' ' 995' ' ' LEU . . . -65.44 -34.96 90.69 Favored Glycine 0 N--CA 1.448 -0.529 0 N-CA-C 110.293 -1.123 . . . . 0.0 110.293 170.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . 0.593 HD12 ' HD3' ' A' ' 963' ' ' ARG . 25.8 tp -63.67 -32.66 74.21 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.022 -0.589 . . . . 0.0 110.526 174.405 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.472 ' HB1' ' HB3' ' A' ' 932' ' ' LEU . . . -75.58 -58.19 3.43 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 121.137 -0.225 . . . . 0.0 110.612 -178.324 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.608 HD13 HD12 ' A' ' 991' ' ' LEU . 0.4 OUTLIER -42.82 -50.7 5.64 Favored 'General case' 0 C--O 1.212 -0.918 0 N-CA-C 112.748 0.648 . . . . 0.0 112.748 168.827 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.593 ' HD3' HD12 ' A' ' 960' ' ' LEU . 3.5 ptm180 -65.82 -28.51 69.04 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 119.654 1.116 . . . . 0.0 110.745 -177.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 38.8 m -68.78 -39.26 80.28 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 173.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.521 HD21 HD21 ' A' 1035 ' ' LEU . 0.1 OUTLIER -66.36 -38.96 88.79 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.389 -1.278 . . . . 0.0 110.66 177.287 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.837 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 9.9 tt -76.48 -38.79 54.76 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 115.415 -0.811 . . . . 0.0 108.92 -172.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -71.13 -31.66 68.0 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.304 177.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.717 HG21 ' HB2' ' A' ' 924' ' ' LYS . 11.8 p -68.77 -39.98 79.94 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 118.654 0.661 . . . . 0.0 110.29 175.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.893 HG12 HG23 ' A' ' 984' ' ' ILE . 97.7 t -71.14 -40.73 75.38 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.045 173.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.855 ' HB2' HE22 ' A' ' 988' ' ' GLN . 19.4 t70 -64.79 -42.98 94.62 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 122.003 0.906 . . . . 0.0 108.691 -179.103 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.687 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 11.2 tp10 -61.48 -38.13 86.16 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 114.032 -1.44 . . . . 0.0 109.415 177.123 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.716 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 58.8 m -64.42 -18.94 65.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.772 179.053 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.841 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 8.8 tt -66.89 -53.24 27.77 Favored Pre-proline 0 CA--C 1.536 0.434 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 -179.618 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.841 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 4.8 Cg_exo -80.83 -17.61 9.54 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 121.71 1.606 . . . . 0.0 113.78 172.063 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.716 ' HB ' ' HA ' ' A' ' 972' ' ' SER . 3.5 t -57.99 -67.67 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -178.14 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.679 ' HB2' ' HD3' ' A' ' 977' ' ' PRO . 64.7 mt -145.79 -59.27 0.02 OUTLIER Pre-proline 0 N--CA 1.468 0.436 0 C-N-CA 119.067 -1.053 . . . . 0.0 113.238 -172.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 0.679 ' HD3' ' HB2' ' A' ' 976' ' ' LEU . 51.5 Cg_exo -54.61 99.37 0.06 OUTLIER 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.399 2.066 . . . . 0.0 113.446 -171.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . 0.467 ' C ' ' H ' ' A' ' 980' ' ' THR . . . -75.34 128.11 34.65 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.796 -178.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.516 ' HB2' ' SD ' ' A' 1046 ' ' MET . 20.1 m 62.45 -0.22 0.55 Allowed 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.973 -177.238 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.759 HG23 ' HB1' ' A' 1042 ' ' ALA . 67.4 m -73.12 -14.67 61.43 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 165.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.557 ' HA ' HD12 ' A' ' 984' ' ' ILE . 2.0 p-80 -52.04 -23.33 5.07 Favored 'General case' 0 C--O 1.216 -0.669 0 CA-C-N 113.971 -1.468 . . . . 0.0 113.403 179.03 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -82.56 -21.42 35.3 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 119.081 0.855 . . . . 0.0 110.755 178.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.73 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 0.2 OUTLIER -78.63 -33.98 46.87 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 168.454 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.893 HG23 HG12 ' A' ' 969' ' ' VAL . 53.5 mt -70.15 -30.65 44.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 114.766 -1.106 . . . . 0.0 108.055 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . 0.518 ' O ' ' HG3' ' A' ' 989' ' ' LYS . 9.6 mm-40 -64.1 -55.35 22.67 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.783 174.417 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 65.3 mtt -71.11 -44.78 64.95 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.131 -0.94 . . . . 0.0 111.619 -168.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 1.021 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -66.6 -49.38 66.49 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.069 -0.968 . . . . 0.0 112.288 -173.352 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.855 HE22 ' HB2' ' A' ' 970' ' ' ASP . 3.2 pt20 -61.76 -29.92 70.45 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 119.817 -0.753 . . . . 0.0 111.26 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . 0.743 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 50.9 mttm -70.5 -39.16 74.31 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.616 0.722 . . . . 0.0 111.396 174.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.622 HD23 ' HB3' ' A' 1035 ' ' LEU . 15.8 tp -49.94 -60.49 2.87 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.447 -178.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.724 HD21 ' HA ' ' A' 1028 ' ' LEU . 0.3 OUTLIER -67.99 -28.55 67.53 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-O 121.522 0.677 . . . . 0.0 109.788 -179.885 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . 0.743 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 22.7 t-20 -52.27 -55.44 21.31 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.346 -1.297 . . . . 0.0 111.023 178.278 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 30.8 t -76.41 -34.75 58.82 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.383 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . 0.464 ' O ' ' HB3' ' A' ' 997' ' ' GLU . 0.7 OUTLIER -65.27 -37.04 85.97 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.6 -0.44 . . . . 0.0 112.162 179.306 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 1.035 ' HG ' HD23 ' A' ' 998' ' ' LEU . 6.8 tt -72.0 -17.49 62.04 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 122.32 -0.238 . . . . 0.0 110.546 172.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -72.8 -25.73 61.25 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 119.446 -0.901 . . . . 0.0 110.032 166.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.464 ' HB3' ' O ' ' A' ' 994' ' ' ASP . 12.1 tp10 -74.97 -38.4 61.68 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 173.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 1.035 HD23 ' HG ' ' A' ' 995' ' ' LEU . 0.1 OUTLIER -56.38 -46.39 80.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.039 178.629 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.589 ' O ' ' HB2' ' A' 1003 ' ' LYS . 76.2 mt -60.7 -46.11 96.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.679 -175.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -58.04 -39.87 79.49 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -175.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.554 ' O ' ' HB3' ' A' 1017 ' ' TYR . 32.7 mmtp -84.15 -37.05 22.42 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.721 0.772 . . . . 0.0 110.119 -175.551 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 1.029 ' HG3' ' HB3' ' A' ' 951' ' ' TYR . 34.3 tpp -57.97 -32.54 67.96 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.731 -1.122 . . . . 0.0 108.821 172.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.589 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 13.4 tptp -70.39 -53.7 15.46 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 113.808 -1.542 . . . . 0.0 111.369 -167.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.65 HD13 ' HG3' ' A' 1007 ' ' GLN . 4.1 mm? -76.9 -13.16 60.02 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.681 -177.383 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.629 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -68.45 -47.98 65.73 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 119.664 -0.814 . . . . 0.0 109.762 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.906 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 8.4 pt20 -70.87 -36.16 72.69 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 119.941 -0.704 . . . . 0.0 111.898 171.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.65 ' HG3' HD13 ' A' 1004 ' ' LEU . 12.4 mm100 -43.13 -51.55 5.86 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.108 0.48 . . . . 0.0 110.734 177.086 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.688 ' HB2' ' HG ' ' A' 1013 ' ' LEU . 66.4 m-85 -123.71 52.3 1.45 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.52 0.676 . . . . 0.0 110.088 169.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.983 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 13.0 p -53.73 -18.05 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.423 0 CA-C-N 114.576 -1.193 . . . . 0.0 110.288 169.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . 0.418 ' C ' ' HG1' ' A' 1011 ' ' THR . 16.4 ptp -62.31 81.17 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.078 166.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . 0.418 ' HG1' ' C ' ' A' 1010 ' ' MET . 45.8 p 68.0 -89.08 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 126.231 1.812 . . . . 0.0 114.589 175.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 37.6 m -45.98 -79.38 0.01 OUTLIER 'General case' 0 C--O 1.241 0.638 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 -165.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.688 ' HG ' ' HB2' ' A' 1008 ' ' TYR . 13.3 mt -54.57 -35.17 63.02 Favored 'General case' 0 CA--C 1.501 -0.92 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 -174.784 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 0.983 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.39 -48.61 71.36 Favored 'General case' 0 N--CA 1.445 -0.718 0 O-C-N 123.646 0.591 . . . . 0.0 110.912 -167.78 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.403 ' O ' ' HD3' ' A' 1019 ' ' LYS . 3.2 pt20 -75.17 -41.06 58.88 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.565 -176.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -72.64 -46.74 52.5 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.203 0.525 . . . . 0.0 111.042 -176.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.629 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 6.9 m-85 -67.87 -36.5 80.39 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.48 -176.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.789 ' HE2' ' CE ' ' A' 1021 ' ' MET . 9.5 tptm -79.86 -26.61 40.3 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.587 -175.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . 0.403 ' HD3' ' O ' ' A' 1015 ' ' GLN . 1.1 mptm? -74.18 -42.16 60.3 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 174.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 48.8 mt-30 -57.34 -35.04 69.41 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.191 163.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.789 ' CE ' ' HE2' ' A' 1018 ' ' LYS . 6.6 tmm? -66.41 -53.6 33.94 Favored 'General case' 0 C--O 1.219 -0.505 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 -179.039 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . 0.522 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -78.98 -8.53 58.99 Favored 'General case' 0 C--O 1.22 -0.46 0 C-N-CA 119.367 -0.933 . . . . 0.0 109.852 -171.472 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 82.6 m -88.15 -35.27 17.51 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.944 174.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.488 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -79.0 -22.72 45.12 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-O 121.222 0.534 . . . . 0.0 109.582 171.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.673 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -86.18 -23.92 26.33 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.927 170.213 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.525 ' O ' HG23 ' A' 1030 ' ' VAL . 63.8 t60 -75.96 -22.58 55.76 Favored 'General case' 0 C--O 1.214 -0.777 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 164.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . 0.488 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -73.2 -39.11 65.83 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 123.282 0.633 . . . . 0.0 109.386 165.231 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.724 ' HA ' HD21 ' A' ' 991' ' ' LEU . 14.4 mt -59.87 -48.15 82.85 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 168.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . 0.456 ' CB ' HG22 ' A' ' 933' ' ' VAL . . . -57.73 -42.72 84.44 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.867 -0.151 . . . . 0.0 111.358 175.234 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.525 HG23 ' O ' ' A' 1026 ' ' HIS . 8.0 t -69.19 -51.79 39.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.318 0.58 . . . . 0.0 110.877 -176.623 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.537 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 12.4 m-20 -77.15 -29.38 54.56 Favored 'General case' 0 C--O 1.214 -0.779 0 CA-C-N 115.338 -0.847 . . . . 0.0 112.661 -174.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.426 ' HA ' ' CD2' ' A' 1035 ' ' LEU . . . -70.32 -31.24 68.46 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 172.224 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.55 ' O ' ' HE2' ' A' 1033 ' ' LYS . 1.0 OUTLIER -63.83 -49.95 70.81 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 168.892 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.537 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 42.2 t30 -64.13 -53.94 41.66 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-N 113.921 -1.49 . . . . 0.0 112.474 -175.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 1.021 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 2.3 pp -60.47 -41.27 93.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 119.638 -0.22 . . . . 0.0 110.551 -172.242 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.597 HD11 ' CG ' ' A' ' 922' ' ' ASN . 1.0 OUTLIER -68.77 -43.95 74.69 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 117.974 -1.491 . . . . 0.0 109.142 179.12 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.524 ' HB3' ' O ' ' A' 1034 ' ' ASN . 12.1 t70 -49.28 -42.91 42.54 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 114.801 -1.091 . . . . 0.0 110.22 173.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.611 ' CG1' ' HG3' ' A' ' 983' ' ' GLU . 21.2 t -56.82 -48.7 80.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 113.488 -1.687 . . . . 0.0 111.966 176.064 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.731 ' O ' ' HG2' ' A' 1043 ' ' ARG . 2.0 mp -70.68 -31.48 46.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 118.761 0.709 . . . . 0.0 111.435 177.039 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.619 ' HB3' ' HA ' ' A' ' 919' ' ' ILE . 0.2 OUTLIER -63.38 -47.41 82.18 Favored 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.559 174.204 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.423 ' O ' ' HB2' ' A' 1045 ' ' LYS . 39.0 mt-30 -61.58 -43.87 98.06 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.006 0.432 . . . . 0.0 109.863 172.204 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.759 ' HB1' HG23 ' A' ' 980' ' ' THR . . . -54.1 -50.99 65.58 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -176.399 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.731 ' HG2' ' O ' ' A' 1039 ' ' ILE . 1.3 ptp180 -63.7 -46.94 83.2 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.477 -174.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.649 HD13 HD12 ' A' 1047 ' ' ILE . 3.7 mm? -74.82 -21.37 59.32 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.764 0.316 . . . . 0.0 111.016 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.491 ' O ' ' HG2' ' A' 1049 ' ' GLN . 2.5 tmtm? -80.65 -34.81 34.61 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 179.109 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.636 ' SD ' ' HA ' ' A' 1052 ' ' PRO . 4.4 mmm -63.23 -30.94 71.99 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 120.231 -0.587 . . . . 0.0 110.0 171.39 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.649 HD12 HD13 ' A' 1044 ' ' LEU . 53.5 mt -79.5 -21.62 12.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.357 0.599 . . . . 0.0 110.139 175.246 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . 0.432 ' HB3' ' HA ' ' A' 1045 ' ' LYS . 33.7 t -90.58 -1.0 57.88 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.387 -175.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . 0.491 ' HG2' ' O ' ' A' 1045 ' ' LYS . 14.7 mm100 -116.84 -178.4 3.42 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.081 0.467 . . . . 0.0 110.835 -178.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 10.4 t -125.17 17.95 8.38 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 169.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 72.0 ttt180 -147.9 141.78 15.93 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 114.055 -1.43 . . . . 0.0 107.699 -174.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . 0.636 ' HA ' ' SD ' ' A' 1046 ' ' MET . 71.4 Cg_exo -49.47 90.89 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 123.248 2.632 . . . . 0.0 114.416 -175.142 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . 0.442 ' CD2' ' HA ' ' A' 1042 ' ' ALA . 54.5 t-80 . . . . . 0 CA--C 1.536 0.424 0 CA-C-N 114.755 -1.111 . . . . 0.0 112.053 178.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.706 0 N-CA-C 112.229 -0.348 . . . . 0.0 112.229 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 909' ' ' SER . . . . . 0.769 ' HB3' ' HD3' ' A' ' 910' ' ' PRO . 9.1 t -105.22 -56.75 0.08 OUTLIER Pre-proline 0 CA--C 1.538 0.498 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 176.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 910' ' ' PRO . . . . . 0.769 ' HD3' ' HB3' ' A' ' 909' ' ' SER . 3.8 Cg_exo -77.39 25.63 0.48 Allowed 'Trans proline' 0 C--N 1.362 1.26 0 C-N-CA 122.737 2.291 . . . . 0.0 111.827 177.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 911' ' ' GLY . . . . . 0.405 ' H ' ' C ' ' A' ' 909' ' ' SER . . . -144.63 146.73 17.45 Favored Glycine 0 N--CA 1.44 -1.034 0 N-CA-C 110.455 -1.058 . . . . 0.0 110.455 177.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 912' ' ' ILE . . . . . 0.505 HG13 ' H ' ' A' ' 914' ' ' GLY . 8.6 tp -78.62 112.78 17.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.483 0.658 . . . . 0.0 111.045 -176.28 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 50.7 m -98.36 18.31 16.77 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.704 179.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 914' ' ' GLY . . . . . 0.505 ' H ' HG13 ' A' ' 912' ' ' ILE . . . 115.02 114.09 2.97 Favored Glycine 0 N--CA 1.445 -0.74 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.45 -177.107 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 915' ' ' GLY . . . . . 0.528 ' O ' ' HA ' ' A' ' 921' ' ' SER . . . -99.92 169.26 21.88 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.896 -0.668 . . . . 0.0 112.09 -177.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . 169.98 -60.64 0.18 Allowed Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.089 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . 67.85 95.2 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 N-CA-C 111.385 -0.686 . . . . 0.0 111.385 -176.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . 0.513 ' O ' ' HB2' ' A' 1044 ' ' LEU . . . 83.32 -96.41 1.92 Allowed Glycine 0 N--CA 1.442 -0.935 0 C-N-CA 119.896 -1.145 . . . . 0.0 111.136 -170.475 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 919' ' ' ILE . . . . . 0.762 ' HA ' ' O ' ' A' 1040 ' ' ASP . 29.2 pt -60.96 -179.84 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.922 0 C-N-CA 124.035 0.934 . . . . 0.0 112.843 179.069 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.952 ' HA ' ' HG2' ' A' 1043 ' ' ARG . 0.2 OUTLIER -67.95 -61.71 1.74 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.973 -1.012 . . . . 0.0 113.138 -163.007 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . 0.528 ' HA ' ' O ' ' A' ' 915' ' ' GLY . 49.7 m -153.91 -56.53 0.11 Allowed 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 121.302 0.573 . . . . 0.0 109.855 -177.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.477 ' CG ' ' H ' ' A' ' 923' ' ' ASP . 23.7 p-10 -152.33 -76.66 0.13 Allowed 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.372 172.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.811 ' HB3' ' CD1' ' A' ' 926' ' ' TYR . 9.4 m-20 -168.1 17.06 0.03 OUTLIER 'General case' 0 C--O 1.21 -0.992 0 C-N-CA 122.444 0.298 . . . . 0.0 111.071 -171.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.48 ' O ' ' HG2' ' A' ' 927' ' ' GLU . 4.9 tptp -58.16 -41.26 83.44 Favored 'General case' 0 C--N 1.319 -0.732 0 O-C-N 120.932 -1.105 . . . . 0.0 112.858 -165.256 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.825 HG13 ' HB2' ' A' 1036 ' ' LEU . 1.5 p -62.45 -28.81 45.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 CA-C-O 121.291 0.567 . . . . 0.0 110.83 177.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.811 ' CD1' ' HB3' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -68.09 -30.02 69.1 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.498 0.719 . . . . 0.0 111.555 174.986 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 924' ' ' LYS . 3.6 pt-20 -74.97 -23.22 58.25 Favored 'General case' 0 C--N 1.315 -0.935 0 C-N-CA 118.661 -1.215 . . . . 0.0 109.636 -179.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.419 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 1.6 m120 -75.48 -30.98 60.07 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 172.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.656 HG22 HD21 ' A' ' 932' ' ' LEU . 83.3 t -81.68 -30.41 10.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.745 178.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.466 HG22 ' O ' ' A' ' 927' ' ' GLU . 3.1 t -65.37 -26.69 68.12 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 170.139 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -72.03 -52.87 10.21 Favored Glycine 0 CA--C 1.531 1.044 0 CA-C-N 115.047 -0.978 . . . . 0.0 113.379 172.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.656 HD21 HG22 ' A' ' 929' ' ' VAL . 3.2 pp -65.8 -47.43 75.15 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 -177.617 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 95.6 t -64.37 -34.39 69.0 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 CA-C-O 121.375 0.607 . . . . 0.0 110.237 -177.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.494 ' O ' ' HB3' ' A' ' 938' ' ' GLU . 37.9 tptt -62.48 -34.03 76.03 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.516 176.131 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -68.62 -40.31 80.4 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.316 -0.554 . . . . 0.0 110.644 174.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.834 HG22 ' HB1' ' A' 1025 ' ' ALA . 88.3 t -47.38 -78.92 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 123.417 0.687 . . . . 0.0 112.511 -178.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 19.2 pt -70.49 -41.94 78.22 Favored 'Isoleucine or valine' 0 C--O 1.249 1.028 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -175.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.677 ' O ' ' HB2' ' A' ' 942' ' ' LYS . 5.2 tp10 -70.46 -48.08 57.54 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.426 -168.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.651 ' HG3' HG13 ' A' ' 943' ' ' ILE . 16.2 ttt -74.49 -27.27 60.49 Favored 'General case' 0 C--N 1.308 -1.219 0 C-N-CA 119.276 -0.97 . . . . 0.0 110.05 -178.395 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.699 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 26.3 t -51.64 -55.68 17.95 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.512 -171.534 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 50.5 m -103.74 -21.1 13.75 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.398 -175.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.677 ' HB2' ' O ' ' A' ' 938' ' ' GLU . 11.8 mptt -85.35 -59.24 2.38 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 119.27 -0.972 . . . . 0.0 111.94 -167.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.651 HG13 ' HG3' ' A' ' 939' ' ' MET . 46.2 mm -56.26 -66.05 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 O-C-N 123.324 0.39 . . . . 0.0 111.711 -177.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.558 ' OE1' ' HA ' ' A' ' 949' ' ' GLU . 43.5 mt-30 -155.28 101.3 2.26 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-O 120.929 0.395 . . . . 0.0 111.23 -178.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.431 ' HD2' ' HD2' ' A' ' 947' ' ' PRO . 38.1 Cg_endo -85.47 -77.36 0.0 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.853 0 C-N-CA 122.568 2.179 . . . . 0.0 112.555 176.629 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.653 ' HB3' ' HD3' ' A' ' 947' ' ' PRO . . . -69.69 -49.42 21.17 Favored Pre-proline 0 CA--C 1.532 0.288 0 N-CA-C 111.532 0.197 . . . . 0.0 111.532 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.653 ' HD3' ' HB3' ' A' ' 946' ' ' ALA . 16.9 Cg_exo -68.44 137.32 39.27 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 121.328 1.352 . . . . 0.0 109.596 169.243 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.85 ' HB3' HG11 ' A' 1009 ' ' VAL . 10.0 Cg_endo -58.08 111.05 0.73 Allowed 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 121.747 1.631 . . . . 0.0 113.255 -175.318 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.655 ' HB3' ' CD1' ' A' ' 951' ' ' TYR . 28.7 tt0 -59.1 -16.12 17.67 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.412 -1.267 . . . . 0.0 108.558 165.098 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.717 ' HB3' ' HG2' ' A' ' 953' ' ' PRO . 30.2 tt0 74.92 -12.36 0.95 Allowed 'General case' 0 C--N 1.348 0.524 0 CA-C-N 114.526 -1.215 . . . . 0.0 108.572 -166.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 1.004 ' HB3' ' HG2' ' A' 1002 ' ' MET . 20.5 m-30 54.04 -50.09 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.475 1.51 . . . . 0.0 114.255 177.572 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 0.549 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 45.6 t -48.1 -44.69 62.07 Favored Pre-proline 0 CA--C 1.541 0.597 0 C-N-CA 122.849 0.46 . . . . 0.0 112.058 172.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 0.717 ' HG2' ' HB3' ' A' ' 950' ' ' GLU . 19.0 Cg_exo -47.62 -44.13 26.6 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 122.572 2.181 . . . . 0.0 113.185 173.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.779 ' HB3' ' HE1' ' A' 1002 ' ' MET . 14.1 ttt -71.76 -37.55 70.5 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 120.897 0.379 . . . . 0.0 110.227 175.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.519 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 86.2 t -52.96 -40.62 37.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.809 170.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.509 ' HE2' ' OE2' ' A' ' 957' ' ' GLU . 0.8 OUTLIER -62.7 -34.03 76.3 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.788 174.376 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . 0.509 ' OE2' ' HE2' ' A' ' 956' ' ' LYS . 69.7 mm-40 -77.87 -44.83 26.0 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.195 0.522 . . . . 0.0 111.111 -179.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.451 HG23 ' HB2' ' A' ' 932' ' ' LEU . 14.6 p -78.79 -29.37 14.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.928 -177.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -69.62 -35.52 74.6 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 110.549 -1.02 . . . . 0.0 110.549 172.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . 0.455 ' O ' ' HG2' ' A' ' 963' ' ' ARG . 8.6 tt -62.77 -41.22 99.13 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 174.121 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.422 ' CB ' ' HB3' ' A' ' 932' ' ' LEU . . . -69.32 -57.99 4.6 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 121.132 -0.227 . . . . 0.0 110.966 -179.593 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.597 ' HB2' HD22 ' A' ' 991' ' ' LEU . 0.1 OUTLIER -42.86 -49.22 5.85 Favored 'General case' 0 C--O 1.217 -0.642 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 169.763 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.466 ' N ' ' HG ' ' A' ' 962' ' ' LEU . 11.2 ptm180 -67.89 -28.77 67.8 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 120.108 1.322 . . . . 0.0 111.064 -179.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 28.0 m -68.3 -35.53 77.97 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 173.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.719 HD22 HD13 ' A' ' 991' ' ' LEU . 0.0 OUTLIER -66.57 -38.64 87.48 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 114.523 -1.217 . . . . 0.0 109.467 174.686 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . . . . . . . . . 10.3 tt -65.92 -40.36 91.36 Favored 'General case' 0 N--CA 1.436 -1.164 0 CA-C-N 114.314 -1.312 . . . . 0.0 108.271 -177.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -65.29 -44.69 87.16 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.397 -0.82 . . . . 0.0 112.249 178.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 13.8 p -64.81 -41.02 96.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 118.858 0.753 . . . . 0.0 110.412 179.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.724 HG12 HG23 ' A' ' 984' ' ' ILE . 87.3 t -72.96 -41.85 60.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.021 176.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.76 ' HB2' HE22 ' A' ' 988' ' ' GLN . 14.0 t70 -67.03 -38.83 86.62 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 -177.57 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.625 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 14.2 tt0 -60.83 -33.85 73.66 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.012 -0.995 . . . . 0.0 109.773 174.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.506 ' HB2' ' O ' ' A' ' 969' ' ' VAL . 64.2 m -65.57 -18.29 65.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.085 177.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.727 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 10.5 tt -70.61 -52.02 11.45 Favored Pre-proline 0 CA--C 1.537 0.48 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.256 -178.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.727 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 2.2 Cg_endo -88.01 -4.7 6.95 Favored 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 121.758 1.639 . . . . 0.0 113.94 173.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 971' ' ' GLU . 15.9 t -74.71 -41.07 47.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 120.157 -0.617 . . . . 0.0 109.766 171.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.402 HD22 HG12 ' A' ' 975' ' ' VAL . 3.3 mm? -95.31 108.09 36.78 Favored Pre-proline 0 C--N 1.328 -0.362 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 172.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -50.78 101.1 0.04 OUTLIER 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 123.552 2.835 . . . . 0.0 114.418 -171.1 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . 69.78 -67.82 0.22 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.033 -0.985 . . . . 0.0 113.573 172.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.443 ' HB2' ' CE ' ' A' 1046 ' ' MET . 5.7 p -48.93 -50.64 34.39 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 114.464 1.283 . . . . 0.0 114.464 -166.388 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.603 HG22 ' CD1' ' A' ' 984' ' ' ILE . 32.5 m -70.61 -5.1 26.84 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -172.1 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.689 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 2.5 p80 -50.13 -34.52 22.45 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -175.352 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -82.66 -20.79 35.55 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -168.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.59 -37.65 41.93 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.316 0.579 . . . . 0.0 109.684 172.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.779 HG13 HG12 ' A' 1039 ' ' ILE . 2.5 mp -65.68 -29.74 47.94 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.524 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 176.005 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . 0.689 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 42.3 mt-10 -63.79 -52.45 60.2 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-O 121.36 0.6 . . . . 0.0 110.579 176.164 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 58.7 mtt -70.06 -46.34 65.17 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 114.978 -1.01 . . . . 0.0 111.424 -169.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.466 ' HA ' HD12 ' A' ' 990' ' ' LEU . . . -75.09 -51.11 14.29 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.719 -1.128 . . . . 0.0 112.776 -169.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.76 HE22 ' HB2' ' A' ' 970' ' ' ASP . 2.2 pt20 -63.29 -20.95 65.93 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 119.406 -0.918 . . . . 0.0 109.209 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . 0.62 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 9.1 ttmm -73.94 -42.43 60.58 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.042 -0.981 . . . . 0.0 112.591 170.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.498 HD13 HD11 ' A' 1035 ' ' LEU . 1.2 mt -56.29 -54.05 49.96 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -178.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.719 HD13 HD22 ' A' ' 965' ' ' LEU . 1.2 tt -65.22 -32.21 73.77 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 175.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . 0.677 ' HB2' ' O ' ' A' ' 988' ' ' GLN . 47.3 t-20 -53.95 -56.88 13.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.932 179.003 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 20.7 t -79.32 -33.88 42.77 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -177.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . 0.502 ' O ' ' HB3' ' A' ' 997' ' ' GLU . 0.2 OUTLIER -69.0 -33.41 73.63 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.17 -0.612 . . . . 0.0 111.705 178.946 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 0.611 ' N ' HD21 ' A' 1028 ' ' LEU . 2.9 tm? -69.33 -19.63 63.87 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 169.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -76.08 -21.76 56.36 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 119.434 -0.906 . . . . 0.0 110.415 167.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.594 ' HA ' ' ND2' ' A' 1000 ' ' ASN . 7.7 tp10 -75.25 -42.41 55.19 Favored 'General case' 0 C--O 1.239 0.528 0 C-N-CA 122.367 0.267 . . . . 0.0 110.532 173.228 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.961 HD12 ' HB2' ' A' 1025 ' ' ALA . 1.6 tt -56.53 -44.21 80.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.725 0.298 . . . . 0.0 110.366 177.518 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.546 HG13 ' O ' ' A' ' 995' ' ' LEU . 88.5 mt -66.46 -46.87 85.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 CA-C-N 115.868 -0.605 . . . . 0.0 112.274 -172.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . 0.594 ' ND2' ' HA ' ' A' ' 997' ' ' GLU . 10.2 p30 -63.21 -37.51 87.54 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.438 0.637 . . . . 0.0 111.374 -172.147 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.599 ' HD3' ' HB3' ' A' 1020 ' ' GLN . 49.9 mttp -83.96 -34.15 24.48 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.086 -178.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 1.004 ' HG2' ' HB3' ' A' ' 951' ' ' TYR . 12.7 ttt -62.48 -27.23 68.99 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 122.054 0.93 . . . . 0.0 109.013 175.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.55 ' O ' ' HG3' ' A' 1007 ' ' GLN . 10.3 tptp -72.91 -55.28 6.84 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-N 113.724 -1.58 . . . . 0.0 110.224 -170.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.417 HD23 ' CD ' ' A' 1007 ' ' GLN . 90.5 mt -66.24 -13.53 60.52 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.615 179.435 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.726 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -72.88 -51.76 17.4 Favored 'General case' 0 C--O 1.212 -0.898 0 C-N-CA 119.634 -0.827 . . . . 0.0 110.147 178.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.971 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -68.86 -32.39 72.02 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 118.332 0.515 . . . . 0.0 111.94 174.272 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.55 ' HG3' ' O ' ' A' 1003 ' ' LYS . 19.4 mt-30 -51.79 -40.86 61.11 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.18 0.514 . . . . 0.0 111.282 175.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.514 ' HB2' ' HG ' ' A' 1013 ' ' LEU . 54.9 m-85 -126.49 39.06 4.01 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.333 173.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 1.008 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 12.9 p -54.28 -22.14 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 CA-C-O 121.692 0.758 . . . . 0.0 110.332 177.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . 0.497 ' O ' HG23 ' A' 1011 ' ' THR . 59.1 mtt -50.03 -29.32 8.47 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.355 -1.293 . . . . 0.0 111.831 177.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . 0.497 HG23 ' O ' ' A' 1010 ' ' MET . 0.6 OUTLIER -163.79 -99.51 0.02 OUTLIER 'General case' 0 C--O 1.253 1.275 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 177.311 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 4.7 p -56.92 -65.24 0.65 Allowed 'General case' 0 C--O 1.237 0.438 0 CA-C-N 114.267 -1.333 . . . . 0.0 113.57 -163.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.609 ' HB3' ' CD2' ' A' 1017 ' ' TYR . 8.9 mt -52.1 -37.01 52.64 Favored 'General case' 0 CA--C 1.501 -0.913 0 N-CA-C 111.558 0.207 . . . . 0.0 111.558 -177.395 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 1.008 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.35 -52.72 60.69 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-O 121.202 0.525 . . . . 0.0 110.974 -168.998 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.691 ' O ' ' HB3' ' A' 1019 ' ' LYS . 4.6 pp0? -71.42 -36.83 71.44 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.261 -174.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . 0.472 ' HA ' ' HD2' ' A' 1019 ' ' LYS . 17.3 tt0 -73.2 -51.64 17.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.8 0.809 . . . . 0.0 111.015 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.726 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 12.2 m-85 -66.85 -37.79 85.14 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -174.587 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.544 ' HE3' ' HA ' ' A' ' 940' ' ' SER . 45.7 tptt -79.99 -29.31 39.49 Favored 'General case' 0 N--CA 1.461 0.094 0 CA-C-N 115.056 -0.974 . . . . 0.0 109.967 -177.574 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . 0.691 ' HB3' ' O ' ' A' 1015 ' ' GLN . 0.0 OUTLIER -74.29 -40.41 62.29 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 175.778 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . 0.599 ' HB3' ' HD3' ' A' 1001 ' ' LYS . 48.0 mt-30 -60.86 -33.28 72.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.526 162.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.553 ' HG3' ' CG ' ' A' 1002 ' ' MET . 11.5 tmm? -65.19 -51.27 62.07 Favored 'General case' 0 CA--C 1.506 -0.723 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 -178.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . 0.862 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.1 OUTLIER -84.39 -2.67 57.52 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 119.231 -0.988 . . . . 0.0 109.76 -174.485 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 53.1 m -89.0 -34.07 16.96 Favored 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 171.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.529 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.76 -21.31 48.11 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 169.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.961 ' HB2' HD12 ' A' ' 998' ' ' LEU . . . -85.55 -24.4 27.26 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.785 169.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.583 ' O ' HG23 ' A' 1030 ' ' VAL . 53.6 t-80 -75.84 -23.09 55.71 Favored 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 164.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -73.04 -40.47 65.08 Favored 'General case' 0 C--N 1.318 -0.8 0 C-N-CA 123.345 0.658 . . . . 0.0 109.419 165.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.611 HD21 ' N ' ' A' ' 995' ' ' LEU . 26.3 mt -61.3 -43.92 98.08 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 170.288 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -59.5 -42.78 92.95 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 111.429 0.159 . . . . 0.0 111.429 173.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' 1026 ' ' HIS . 10.5 t -66.42 -50.58 66.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.237 0 CA-C-O 121.61 0.719 . . . . 0.0 110.346 -178.276 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -72.24 -39.54 68.4 Favored 'General case' 0 C--O 1.204 -1.308 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.113 -176.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.508 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -63.83 -35.44 80.63 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.917 -0.313 . . . . 0.0 110.235 176.429 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 8.0 tmtm? -61.57 -44.23 97.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.607 0.718 . . . . 0.0 109.624 172.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.511 ' O ' HG23 ' A' 1038 ' ' VAL . 40.5 t30 -70.8 -53.57 14.88 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 114.868 -1.06 . . . . 0.0 111.165 -177.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.634 HD23 ' HB2' ' A' ' 991' ' ' LEU . 0.0 OUTLIER -59.0 -42.17 89.43 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.192 -173.375 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.825 ' HB2' HG13 ' A' ' 925' ' ' VAL . 3.9 pp -62.9 -48.59 78.29 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 118.372 -1.331 . . . . 0.0 109.762 178.411 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.44 ' N ' HD12 ' A' 1036 ' ' LEU . 24.0 t70 -52.21 -38.61 58.45 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 114.165 -1.38 . . . . 0.0 110.784 175.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' 1034 ' ' ASN . 25.3 t -62.46 -50.62 79.14 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.916 0 CA-C-N 113.96 -1.473 . . . . 0.0 112.827 -179.383 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.779 HG12 HG13 ' A' ' 984' ' ' ILE . 1.5 mp -76.36 -29.33 18.79 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 CA-C-N 119.881 1.219 . . . . 0.0 111.666 -177.185 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.762 ' O ' ' HA ' ' A' ' 919' ' ' ILE . 1.2 m-20 -55.87 -51.16 68.53 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.278 167.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.619 ' O ' ' HB3' ' A' 1044 ' ' LEU . 36.2 mt-30 -77.1 -23.29 51.85 Favored 'General case' 0 C--N 1.312 -1.036 0 O-C-N 121.911 -0.493 . . . . 0.0 111.552 177.028 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.627 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -55.53 -52.94 62.01 Favored 'General case' 0 CA--C 1.495 -1.161 0 CA-C-O 121.577 0.703 . . . . 0.0 111.011 176.372 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.952 ' HG2' ' HA ' ' A' ' 920' ' ' ARG . 0.0 OUTLIER -63.55 -35.53 80.79 Favored 'General case' 0 N--CA 1.432 -1.365 0 CA-C-N 114.775 -1.102 . . . . 0.0 108.401 -179.536 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.941 ' HG ' ' HB3' ' A' 1053 ' ' HIS . 6.7 tt -59.0 -51.16 71.26 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.407 175.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.713 ' O ' ' HB2' ' A' 1049 ' ' GLN . 4.9 tmmm? -71.82 -32.42 67.54 Favored 'General case' 0 N--CA 1.438 -1.03 0 CA-C-N 114.779 -1.101 . . . . 0.0 110.981 -171.326 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.552 ' HG3' ' HA ' ' A' ' 980' ' ' THR . 71.3 mmm -73.62 -44.35 57.23 Favored 'General case' 0 C--N 1.311 -1.078 0 O-C-N 121.342 -0.849 . . . . 0.0 111.38 177.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.604 HG12 ' O ' ' A' 1043 ' ' ARG . 43.8 mm -58.75 -52.25 62.34 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.301 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 173.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . 0.941 ' HB2' ' HB2' ' A' 1053 ' ' HIS . 70.7 m -140.28 79.9 1.73 Allowed 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.461 -179.161 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . 0.713 ' HB2' ' O ' ' A' 1045 ' ' LYS . 21.9 tm0? -82.54 -38.46 23.71 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.235 167.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 19.1 t -59.96 -40.05 87.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.098 0.475 . . . . 0.0 110.724 -176.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -127.0 139.85 36.2 Favored Pre-proline 0 C--N 1.32 -0.69 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 173.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -61.42 109.21 0.7 Allowed 'Trans proline' 0 N--CA 1.463 -0.32 0 C-N-CA 121.639 1.559 . . . . 0.0 111.967 -173.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . 0.941 ' HB2' ' HB2' ' A' 1048 ' ' SER . 1.2 t60 . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.447 -178.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.692 0 N-CA-C 111.796 -0.522 . . . . 0.0 111.796 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 66.3 m -155.08 89.15 3.1 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-O 120.815 0.34 . . . . 0.0 110.477 178.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -63.12 -47.22 8.6 Favored 'Trans proline' 0 C--N 1.343 0.268 0 C-N-CA 122.804 2.336 . . . . 0.0 112.44 -178.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -153.87 78.9 0.2 Allowed Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.765 -0.731 . . . . 0.0 111.929 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 912' ' ' ILE . . . . . 0.41 ' H ' HG13 ' A' ' 912' ' ' ILE . 2.4 pp -92.7 16.62 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.995 0.426 . . . . 0.0 111.432 -178.708 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 35.2 t -82.97 148.13 27.8 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.098 -0.501 . . . . 0.0 109.994 178.302 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . -133.52 53.77 0.79 Allowed Glycine 0 N--CA 1.443 -0.896 0 N-CA-C 111.434 -0.666 . . . . 0.0 111.434 178.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . -119.91 22.93 8.44 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.711 -178.302 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 916' ' ' GLY . . . . . 0.486 ' O ' ' HA ' ' A' ' 921' ' ' SER . . . 169.3 142.11 3.43 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.314 -179.34 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . 133.77 160.67 9.41 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.88 -0.676 . . . . 0.0 112.085 178.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -107.43 -79.66 1.22 Allowed Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 121.03 -0.605 . . . . 0.0 112.315 177.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 919' ' ' ILE . . . . . 0.72 ' HB ' ' C ' ' A' 1040 ' ' ASP . 21.2 mm -80.77 15.44 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.917 0.865 . . . . 0.0 111.419 177.367 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.914 ' HG3' ' H ' ' A' ' 921' ' ' SER . 22.6 tpt180 -177.7 -156.29 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 174.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . 0.914 ' H ' ' HG3' ' A' ' 920' ' ' ARG . 20.8 m -145.32 85.13 1.72 Allowed 'General case' 0 N--CA 1.443 -0.813 0 CA-C-O 121.207 0.527 . . . . 0.0 111.235 -175.591 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.436 ' HB3' ' CD1' ' A' 1036 ' ' LEU . 32.4 t30 -111.41 133.57 53.62 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 168.162 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.69 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 6.9 p-10 -111.45 -35.79 5.72 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -161.411 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.416 ' HB3' HG21 ' A' ' 968' ' ' THR . 65.3 mmtt -60.75 -19.67 59.59 Favored 'General case' 0 C--N 1.318 -0.763 0 O-C-N 121.378 -0.826 . . . . 0.0 112.545 -172.523 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.782 HG11 HD13 ' A' 1036 ' ' LEU . 0.2 OUTLIER -70.72 -29.88 39.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 172.899 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.69 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.1 OUTLIER -79.02 -21.0 47.58 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 178.566 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -73.15 -43.43 61.56 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 114.602 -1.181 . . . . 0.0 109.893 171.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.697 ' OD1' ' HB ' ' A' ' 964' ' ' THR . 69.7 m-80 -74.95 -27.32 60.14 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 119.159 0.89 . . . . 0.0 111.581 174.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.604 HG13 HG21 ' A' ' 933' ' ' VAL . 42.8 t -65.78 -33.31 62.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.194 167.245 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.679 ' O ' ' HB2' ' A' ' 934' ' ' LYS . 98.8 m -65.58 -42.68 91.46 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 119.372 0.987 . . . . 0.0 109.778 174.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -73.41 -53.9 7.21 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 120.603 -0.808 . . . . 0.0 113.621 179.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.503 ' O ' HG23 ' A' ' 936' ' ' VAL . 1.5 pp -64.47 -47.62 78.33 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -176.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.604 HG21 HG13 ' A' ' 929' ' ' VAL . 72.8 t -67.49 -36.61 76.87 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 CA-C-O 121.073 0.463 . . . . 0.0 111.028 -175.208 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.679 ' HB2' ' O ' ' A' ' 930' ' ' THR . 4.1 mmtp -62.75 -42.81 99.85 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.149 -179.642 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 0.511 ' HA ' ' SD ' ' A' ' 939' ' ' MET . . . -59.31 -35.47 73.86 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.717 0.294 . . . . 0.0 111.36 177.204 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.77 ' O ' ' HB2' ' A' ' 940' ' ' SER . 66.8 t -54.55 -74.87 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.729 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 21.1 pt -71.61 -42.5 71.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -174.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -64.42 -53.31 50.36 Favored 'General case' 0 C--O 1.243 0.738 0 CA-C-O 121.521 0.676 . . . . 0.0 110.634 -172.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.511 ' SD ' ' HA ' ' A' ' 935' ' ' ALA . 1.8 mpt? -71.21 -24.67 62.25 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 119.439 -0.904 . . . . 0.0 109.131 -178.545 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.77 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 5.0 t -55.87 -34.91 65.91 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 121.824 0.821 . . . . 0.0 110.867 -175.456 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 12.3 m -97.52 -13.82 21.44 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 114.874 -1.057 . . . . 0.0 110.63 -176.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . . . . . . . . . 8.2 tmtt? -83.19 -25.65 31.58 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 176.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.857 HG22 ' HB2' ' A' ' 949' ' ' GLU . 2.7 pp -71.75 -8.24 10.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -178.63 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.41 ' HB3' ' HD3' ' A' ' 945' ' ' PRO . 35.6 tt0 -90.12 -57.49 0.26 Allowed Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -177.507 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.41 ' HD3' ' HB3' ' A' ' 944' ' ' GLN . 42.9 Cg_endo -68.11 -28.02 35.06 Favored 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 121.75 1.633 . . . . 0.0 112.027 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.528 ' HB1' ' HD2' ' A' ' 947' ' ' PRO . . . -92.35 167.07 15.62 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.348 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.528 ' HD2' ' HB1' ' A' ' 946' ' ' ALA . 28.5 Cg_endo -63.27 170.0 8.57 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.508 2.139 . . . . 0.0 111.305 172.526 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.867 ' HB3' HG11 ' A' 1009 ' ' VAL . 4.7 Cg_exo -40.45 125.94 2.04 Favored 'Trans proline' 0 CA--C 1.507 -0.858 0 C-N-CA 123.423 2.749 . . . . 0.0 113.121 177.54 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.857 ' HB2' HG22 ' A' ' 943' ' ' ILE . 12.1 tp10 -63.21 -21.13 66.02 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 114.743 -1.117 . . . . 0.0 109.116 171.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.464 ' HB3' ' CD ' ' A' ' 953' ' ' PRO . 28.1 tt0 73.58 -12.88 0.78 Allowed 'General case' 0 C--N 1.346 0.426 0 O-C-N 124.106 0.879 . . . . 0.0 109.084 -167.612 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.728 ' HE1' HG21 ' A' ' 943' ' ' ILE . 23.1 m-85 53.67 -37.45 0.02 OUTLIER 'General case' 0 C--O 1.216 -0.69 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 178.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 0.754 ' HA ' ' CG2' ' A' ' 955' ' ' VAL . 43.4 t -56.13 -44.71 99.83 Favored Pre-proline 0 C--N 1.323 -0.57 0 C-N-CA 123.005 0.522 . . . . 0.0 111.322 171.014 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 0.593 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 47.0 Cg_exo -52.34 -36.36 68.31 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 121.843 1.696 . . . . 0.0 111.915 170.169 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.571 ' HE3' ' HG2' ' A' ' 949' ' ' GLU . 32.3 ttm -76.69 -31.01 56.95 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.123 176.001 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.754 ' CG2' ' HA ' ' A' ' 952' ' ' VAL . 85.4 t -53.26 -39.36 34.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 168.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.58 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 0.7 OUTLIER -63.8 -39.64 94.74 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.124 175.104 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -76.18 -46.7 27.23 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.442 -171.277 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.662 HG22 HD23 ' A' ' 962' ' ' LEU . 11.7 p -87.8 -28.45 5.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.347 -178.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . 0.505 ' O ' ' HG2' ' A' ' 963' ' ' ARG . . . -61.99 -46.93 93.05 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.471 -0.871 . . . . 0.0 111.2 176.379 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . 0.467 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 9.5 tt -64.62 -34.27 77.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.039 0.447 . . . . 0.0 110.206 177.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.413 ' O ' ' HB3' ' A' ' 928' ' ' ASN . . . -72.5 -46.78 53.12 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -178.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.881 HD13 HD22 ' A' ' 995' ' ' LEU . 4.0 pp -84.55 -18.07 36.86 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 119.345 -0.36 . . . . 0.0 111.482 -176.37 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.506 ' HG3' ' N ' ' A' ' 964' ' ' THR . 8.5 ptp180 -70.31 -37.9 74.84 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 118.829 -1.148 . . . . 0.0 110.091 166.673 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . 0.697 ' HB ' ' OD1' ' A' ' 928' ' ' ASN . 10.5 m -71.13 -26.46 63.02 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.491 ' CD1' HG23 ' A' ' 925' ' ' VAL . 9.7 tp -63.27 -46.36 87.19 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.618 169.145 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.796 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 9.7 tt -66.62 -33.25 75.24 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -177.437 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . 0.55 ' HA ' ' HB3' ' A' ' 970' ' ' ASP . . . -75.24 -32.95 61.26 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 115.342 -0.845 . . . . 0.0 112.224 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.416 HG21 ' HB3' ' A' ' 924' ' ' LYS . 2.4 p -71.53 -35.26 70.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.173 0.511 . . . . 0.0 110.157 176.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.76 HG12 HG23 ' A' ' 984' ' ' ILE . 48.6 t -74.45 -34.92 37.41 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.731 170.345 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.648 ' HB2' HE22 ' A' ' 988' ' ' GLN . 12.8 t70 -66.66 -41.57 87.97 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 122.422 1.106 . . . . 0.0 108.77 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.681 ' O ' HG23 ' A' ' 975' ' ' VAL . 36.0 tt0 -66.23 -29.11 69.29 Favored 'General case' 0 N--CA 1.436 -1.171 0 CA-C-N 113.818 -1.537 . . . . 0.0 110.308 178.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 69.0 m -69.62 -19.09 63.64 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.643 175.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.93 ' HA ' HD13 ' A' ' 984' ' ' ILE . 5.8 tt -66.09 -51.14 47.58 Favored Pre-proline 0 N--CA 1.454 -0.272 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.333 -177.747 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.677 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 1.1 Cg_endo -85.7 0.18 8.53 Favored 'Trans proline' 0 C--N 1.357 1.01 0 C-N-CA 121.85 1.7 . . . . 0.0 113.416 173.191 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.681 HG23 ' O ' ' A' ' 971' ' ' GLU . 11.6 t -64.89 -43.1 96.33 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.045 171.768 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.441 HD22 ' OG1' ' A' ' 980' ' ' THR . 5.3 mp -99.31 127.18 35.29 Favored Pre-proline 0 C--N 1.324 -0.516 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.172 175.25 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 976' ' ' LEU . 4.9 Cg_exo -36.34 -78.54 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 125.21 3.94 . . . . 0.0 115.202 -170.449 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -153.13 91.18 1.5 Allowed 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 111.733 0.272 . . . . 0.0 111.733 -175.368 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . . . . . . . . . 14.1 p 173.83 -57.51 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.315 0 O-C-N 123.841 0.713 . . . . 0.0 109.936 178.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.698 HG23 ' HB1' ' A' 1042 ' ' ALA . 14.4 m -61.8 -14.75 35.78 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.939 -179.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.656 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 16.1 m-70 -50.25 -39.1 43.95 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.048 -0.524 . . . . 0.0 112.013 -177.714 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 14.9 ptm180 -82.1 -18.56 42.59 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.675 -0.239 . . . . 0.0 111.121 -170.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.889 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 1.3 tp10 -75.19 -43.02 54.38 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 172.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.93 HD13 ' HA ' ' A' ' 973' ' ' LEU . 3.2 mp -65.54 -32.63 59.06 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 177.227 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . 0.656 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 34.6 mt-10 -55.25 -52.4 63.51 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.305 0.574 . . . . 0.0 110.262 174.417 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 45.8 ttm -72.71 -40.39 66.21 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 114.979 -1.01 . . . . 0.0 111.261 -173.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.867 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -75.02 -50.93 14.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.524 -1.216 . . . . 0.0 112.71 -172.189 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.796 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 3.1 pt20 -62.88 -21.99 66.39 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 120.074 -0.651 . . . . 0.0 109.803 175.443 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . 0.722 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 59.2 tttt -74.91 -39.97 61.14 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.491 170.625 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.432 ' HB3' ' O ' ' A' ' 987' ' ' ALA . 18.0 tp -52.54 -59.22 4.71 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.665 177.576 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.56 ' HB3' ' CD1' ' A' 1035 ' ' LEU . 2.4 pp -59.8 -34.84 73.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.771 0.796 . . . . 0.0 109.481 177.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . 0.722 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 24.6 t-20 -52.85 -54.03 40.27 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 113.747 -1.569 . . . . 0.0 112.08 -178.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 6.0 m -78.83 -30.32 45.22 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 112.054 0.391 . . . . 0.0 112.054 -179.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.12 -42.76 88.74 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 119.488 -0.885 . . . . 0.0 111.488 176.33 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 0.881 HD22 HD13 ' A' ' 962' ' ' LEU . 1.2 pp -62.62 -23.26 66.97 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 122.717 0.407 . . . . 0.0 110.223 170.549 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -78.45 -27.23 46.39 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 119.456 -0.898 . . . . 0.0 110.406 174.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -73.99 -45.71 48.29 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 170.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.853 HD21 ' HE2' ' A' 1021 ' ' MET . 0.7 OUTLIER -56.7 -42.97 80.05 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.559 -1.2 . . . . 0.0 111.184 -178.508 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.606 ' HA ' ' CE ' ' A' 1002 ' ' MET . 69.0 mt -65.37 -43.99 94.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 O-C-N 122.458 -0.151 . . . . 0.0 111.255 -179.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 23.6 m-80 -60.4 -36.02 77.12 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.233 0.54 . . . . 0.0 111.446 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.465 ' O ' ' HB3' ' A' 1017 ' ' TYR . 13.5 mptt -73.56 -47.18 42.63 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.729 -174.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 1.044 ' HB3' ' HG3' ' A' 1021 ' ' MET . 16.1 ptt? -65.1 -23.79 67.25 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.841 0.829 . . . . 0.0 109.577 179.139 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.528 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 8.7 tptm -70.99 -44.99 64.8 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.162 -165.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.566 ' HB2' ' CD1' ' A' 1017 ' ' TYR . 6.7 mp -83.02 -13.09 56.57 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.913 178.62 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.641 ' HB2' ' CB ' ' A' 1017 ' ' TYR . . . -70.47 -37.41 74.25 Favored 'General case' 0 C--O 1.211 -0.951 0 C-N-CA 118.904 -1.118 . . . . 0.0 109.532 178.202 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.799 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 3.9 pp0? -75.47 -40.12 57.81 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 119.151 -0.452 . . . . 0.0 111.874 171.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.585 ' HG3' ' CD2' ' A' 1008 ' ' TYR . 5.6 pt20 -53.68 -37.97 63.73 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 121.32 0.581 . . . . 0.0 110.349 -175.747 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.8 ' HB2' HD22 ' A' 1013 ' ' LEU . 73.4 m-85 -128.99 43.18 3.19 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.364 169.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 1.071 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 14.7 p -48.99 -21.91 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.702 169.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . 0.427 ' O ' HG23 ' A' 1011 ' ' THR . 65.3 mtt -31.8 -55.97 0.29 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.111 -1.404 . . . . 0.0 111.548 172.062 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . 0.427 HG23 ' O ' ' A' 1010 ' ' MET . 1.7 p -159.25 -91.04 0.03 OUTLIER 'General case' 0 C--O 1.249 1.062 0 N-CA-C 113.332 0.864 . . . . 0.0 113.332 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 32.4 t -51.27 -65.57 0.53 Allowed 'General case' 0 C--O 1.237 0.41 0 CA-C-N 114.411 -1.268 . . . . 0.0 112.399 -166.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.8 HD22 ' HB2' ' A' 1008 ' ' TYR . 8.0 mp -47.88 -43.26 28.46 Favored 'General case' 0 CA--C 1.507 -0.674 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -179.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 1.071 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -57.08 -47.79 80.17 Favored 'General case' 0 C--N 1.319 -0.753 0 O-C-N 123.299 0.374 . . . . 0.0 111.509 -167.724 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.737 ' O ' ' HB3' ' A' 1019 ' ' LYS . 15.0 mm100 -72.46 -37.98 68.37 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-O 120.93 0.395 . . . . 0.0 111.13 -176.651 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -69.33 -55.28 10.91 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.631 0.729 . . . . 0.0 110.828 -179.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.708 ' CE2' ' HG ' ' A' 1013 ' ' LEU . 13.6 m-85 -65.49 -39.57 92.07 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.758 -1.11 . . . . 0.0 113.779 -174.489 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.59 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 25.5 tptp -79.9 -28.91 39.8 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-N 114.643 -1.162 . . . . 0.0 110.501 -176.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . 0.737 ' HB3' ' O ' ' A' 1015 ' ' GLN . 0.0 OUTLIER -73.23 -45.32 56.77 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 175.072 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . 0.42 ' HB3' ' HG2' ' A' 1001 ' ' LYS . 46.6 mt-30 -54.91 -35.34 64.05 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.822 162.437 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 1.044 ' HG3' ' HB3' ' A' 1002 ' ' MET . 1.9 tmt? -64.71 -51.92 59.85 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 110.275 -0.268 . . . . 0.0 110.275 -179.021 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' 1022 ' ' LEU . 0.0 OUTLIER -78.69 -8.61 58.86 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 119.511 -0.876 . . . . 0.0 109.778 -175.613 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 91.8 m -86.09 -36.88 19.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.08 174.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.553 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -79.28 -22.76 44.22 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-O 121.412 0.625 . . . . 0.0 109.415 173.743 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.728 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -86.27 -24.83 25.81 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.193 169.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.556 ' O ' HG23 ' A' 1030 ' ' VAL . 53.3 t60 -69.21 -36.28 77.09 Favored 'General case' 0 C--O 1.211 -0.947 0 N-CA-C 108.569 -0.901 . . . . 0.0 108.569 164.104 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . 0.553 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -58.4 -45.43 88.37 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 123.453 0.701 . . . . 0.0 111.204 162.043 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.637 HD21 ' N ' ' A' ' 995' ' ' LEU . 31.4 mt -56.96 -46.57 82.07 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 118.706 0.684 . . . . 0.0 109.64 173.642 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -59.33 -43.64 92.69 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 173.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' 1026 ' ' HIS . 17.0 t -66.15 -50.68 67.01 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 CA-C-O 121.854 0.835 . . . . 0.0 110.721 -177.104 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.78 ' O ' HD13 ' A' 1035 ' ' LEU . 17.3 m-20 -75.96 -31.05 58.85 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.139 -175.137 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.6 ' HA ' ' CD1' ' A' 1035 ' ' LEU . . . -69.13 -34.02 74.36 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 171.684 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.556 ' HB3' ' O ' ' A' 1030 ' ' VAL . 0.0 OUTLIER -58.63 -37.4 75.85 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 167.63 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.454 ' O ' ' HB3' ' A' 1037 ' ' ASP . 53.2 t30 -79.35 -51.41 9.44 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 114.334 -1.303 . . . . 0.0 112.702 -173.057 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.867 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 0.0 OUTLIER -59.8 -31.39 69.66 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 119.142 0.883 . . . . 0.0 111.485 -174.137 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.782 HD13 HG11 ' A' ' 925' ' ' VAL . 9.9 tp -68.82 -51.24 42.8 Favored 'General case' 0 C--N 1.344 0.338 0 C-N-CA 117.262 -1.775 . . . . 0.0 109.41 175.148 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.454 ' HB3' ' O ' ' A' 1034 ' ' ASN . 25.3 t70 -45.03 -42.32 8.3 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 114.856 -1.066 . . . . 0.0 111.251 173.181 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.491 ' CG1' ' HG3' ' A' ' 983' ' ' GLU . 45.6 t -61.7 -40.6 87.34 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.489 0 CA-C-N 114.559 -1.201 . . . . 0.0 112.476 177.635 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.789 HG12 HG13 ' A' ' 984' ' ' ILE . 1.9 mp -83.31 -25.0 7.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-N 118.589 0.632 . . . . 0.0 110.522 177.327 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.761 ' O ' ' HG3' ' A' 1043 ' ' ARG . 68.9 m-20 -61.2 -45.1 95.97 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 164.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.491 ' HG2' HG13 ' A' ' 919' ' ' ILE . 43.0 mt-30 -62.04 -48.89 78.25 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.653 173.375 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.889 ' HB2' ' HG2' ' A' ' 983' ' ' GLU . . . -54.98 -45.86 75.03 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.61 -176.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.761 ' HG3' ' O ' ' A' 1040 ' ' ASP . 0.0 OUTLIER -59.9 -42.76 94.54 Favored 'General case' 0 N--CA 1.441 -0.875 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.906 -174.799 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.408 ' N ' ' HD3' ' A' 1043 ' ' ARG . 43.0 tp -80.66 -34.72 34.59 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 121.13 0.49 . . . . 0.0 110.582 -178.684 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.564 ' HB2' ' HB2' ' A' 1053 ' ' HIS . 61.5 tttt -62.93 -49.8 73.35 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.016 -178.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.463 ' HG2' ' O ' ' A' 1042 ' ' ALA . 25.4 mmt -64.78 -36.91 85.85 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.676 -176.714 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.615 HG12 ' O ' ' A' 1043 ' ' ARG . 24.7 mm -52.88 -54.94 14.02 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.827 172.576 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 50.0 m -133.01 63.51 1.63 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.457 0.646 . . . . 0.0 111.805 -177.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -81.26 99.75 8.78 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.724 171.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . 0.477 ' O ' ' HB2' ' A' 1051 ' ' ARG . 44.1 m -92.68 -1.78 56.59 Favored 'General case' 0 C--N 1.308 -1.236 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 173.037 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . 1.082 ' HB3' ' HD3' ' A' 1052 ' ' PRO . 44.8 ttp180 164.38 -68.34 0.0 OUTLIER Pre-proline 0 CA--C 1.538 0.494 0 CA-C-N 113.91 -1.495 . . . . 0.0 108.564 -177.204 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . 1.082 ' HD3' ' HB3' ' A' 1051 ' ' ARG . 67.4 Cg_endo -108.16 -152.33 0.02 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.173 0 C-N-CA 122.909 2.406 . . . . 0.0 112.028 177.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . 0.564 ' HB2' ' HB2' ' A' 1045 ' ' LYS . 21.6 t-80 . . . . . 0 C--N 1.326 -0.421 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 171.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.747 0 N-CA-C 111.741 -0.544 . . . . 0.0 111.741 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 32.5 m -88.63 118.26 69.2 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-O 120.905 0.384 . . . . 0.0 111.125 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -92.05 25.55 0.46 Allowed 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 123.158 2.572 . . . . 0.0 110.995 174.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . 150.69 -155.65 26.28 Favored Glycine 0 N--CA 1.444 -0.801 0 N-CA-C 109.856 -1.298 . . . . 0.0 109.856 -175.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 9.5 tp -149.5 126.31 2.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 117.42 0.61 . . . . 0.0 110.568 176.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 8.3 p -172.02 -28.55 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.777 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 139.05 -27.35 2.67 Favored Glycine 0 N--CA 1.447 -0.613 0 N-CA-C 111.168 -0.773 . . . . 0.0 111.168 -176.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 82.89 -155.38 33.23 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.315 178.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . -82.87 60.09 4.91 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.985 -0.626 . . . . 0.0 112.661 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . -164.13 117.04 0.74 Allowed Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.031 178.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . 0.446 ' HA2' ' HD2' ' A' 1043 ' ' ARG . . . 171.88 150.84 7.41 Favored Glycine 0 C--O 1.226 -0.399 0 C-N-CA 120.862 -0.685 . . . . 0.0 111.792 179.257 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 919' ' ' ILE . . . . . 0.984 ' HA ' ' HB3' ' A' 1040 ' ' ASP . 38.7 pt -61.44 -175.78 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.344 0.336 0 CA-C-N 117.459 0.63 . . . . 0.0 111.675 -178.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.783 ' HG2' HG13 ' A' ' 919' ' ' ILE . 34.7 mmt180 71.33 20.5 4.96 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.745 174.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . 0.422 ' HA ' ' OD2' ' A' 1040 ' ' ASP . 23.0 t 77.05 105.97 0.08 Allowed 'General case' 0 CA--C 1.513 -0.474 0 O-C-N 124.155 0.91 . . . . 0.0 110.293 -178.571 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -61.41 172.1 1.25 Allowed 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 114.675 -1.148 . . . . 0.0 108.968 173.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.682 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 38.8 t70 -83.99 -87.22 0.11 Allowed 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -159.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.434 ' HA ' ' HG2' ' A' ' 927' ' ' GLU . 35.0 mmtp -56.74 -27.96 60.27 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -171.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.656 HG23 HD22 ' A' 1036 ' ' LEU . 32.2 m -62.93 -30.95 50.82 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-O 121.365 0.602 . . . . 0.0 110.322 178.325 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.682 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -77.38 -30.69 53.84 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.696 178.479 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . 0.61 ' O ' HG22 ' A' ' 930' ' ' THR . 7.7 pt-20 -76.4 -24.0 54.06 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 119.096 -1.042 . . . . 0.0 110.785 176.582 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -71.41 -29.94 65.49 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 171.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.539 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 86.9 t -80.35 -30.07 12.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.236 175.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.61 HG22 ' O ' ' A' ' 927' ' ' GLU . 2.8 t -65.81 -33.73 76.54 Favored 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 118.215 -1.394 . . . . 0.0 108.257 171.24 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -74.01 -53.51 7.02 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-N 115.366 -0.834 . . . . 0.0 113.572 176.341 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.539 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.2 pp -64.38 -48.37 75.75 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -177.16 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.464 HG23 HG13 ' A' ' 929' ' ' VAL . 54.6 t -69.35 -31.78 50.86 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.319 0 CA-C-O 120.755 0.312 . . . . 0.0 110.852 -175.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.561 ' HD2' ' C ' ' A' ' 934' ' ' LYS . 2.1 tmmm? -56.26 -50.3 71.73 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 175.44 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -57.88 -36.26 72.12 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.154 0.284 . . . . 0.0 111.29 -178.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.821 HG22 ' HB1' ' A' 1025 ' ' ALA . 86.1 t -50.82 -73.9 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.583 178.083 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 28.4 pt -67.25 -35.83 75.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -177.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -67.49 -55.73 12.38 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.733 0.778 . . . . 0.0 110.77 -174.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.557 ' HA ' ' HD2' ' A' ' 942' ' ' LYS . 1.3 mpt? -73.47 -23.9 60.13 Favored 'General case' 0 N--CA 1.438 -1.067 0 C-N-CA 119.776 -0.77 . . . . 0.0 108.969 -176.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.608 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 44.5 t -53.16 -46.45 68.89 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.617 -178.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 5.7 m -86.82 -4.01 59.13 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 114.996 -1.002 . . . . 0.0 109.813 -175.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.7 ' O ' ' HD2' ' A' ' 945' ' ' PRO . 33.5 mttp -81.01 -0.77 41.08 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 167.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.793 HD11 ' HA ' ' A' 1015 ' ' GLN . 9.6 tt -57.27 -16.58 4.94 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.116 162.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.725 ' HB3' ' HD3' ' A' ' 945' ' ' PRO . 34.3 tt0 -61.82 -52.75 66.3 Favored Pre-proline 0 CA--C 1.542 0.639 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -175.517 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.725 ' HD3' ' HB3' ' A' ' 944' ' ' GLN . 50.7 Cg_exo -55.21 121.18 9.44 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 122.085 1.856 . . . . 0.0 112.181 172.281 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.479 ' HB3' ' HD3' ' A' ' 947' ' ' PRO . . . -61.49 -47.4 93.35 Favored Pre-proline 0 CA--C 1.539 0.528 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -176.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.479 ' HD3' ' HB3' ' A' ' 946' ' ' ALA . 52.7 Cg_exo -57.16 132.63 52.47 Favored 'Trans proline' 0 C--N 1.357 1.003 0 C-N-CA 121.823 1.682 . . . . 0.0 111.692 176.404 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.845 ' HB3' HG11 ' A' 1009 ' ' VAL . 1.9 Cg_endo -46.15 131.61 14.43 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 123.51 2.807 . . . . 0.0 114.384 -173.157 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.487 ' C ' ' H ' ' A' ' 951' ' ' TYR . 4.6 tt0 -70.26 -12.55 61.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.115 -0.948 . . . . 0.0 108.865 168.148 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.602 ' HB2' ' HG2' ' A' ' 953' ' ' PRO . 45.8 mm-40 75.98 -22.85 0.26 Allowed 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 114.364 -1.289 . . . . 0.0 109.772 -172.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.739 ' HB3' ' HG3' ' A' 1002 ' ' MET . 21.0 m-85 55.86 -54.91 0.02 OUTLIER 'General case' 0 C--O 1.221 -0.396 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 178.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 0.889 HG13 ' HD3' ' A' ' 953' ' ' PRO . 3.4 p -52.22 -36.81 36.05 Favored Pre-proline 0 CA--C 1.55 0.959 0 CA-C-N 118.506 0.594 . . . . 0.0 112.557 175.045 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 0.889 ' HD3' HG13 ' A' ' 952' ' ' VAL . 37.3 Cg_exo -53.47 -40.01 80.11 Favored 'Trans proline' 0 C--N 1.358 1.045 0 C-N-CA 121.699 1.599 . . . . 0.0 112.208 169.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.658 ' O ' HG23 ' A' ' 958' ' ' VAL . 8.5 ttt -76.33 -48.86 18.56 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.005 177.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.695 HG12 ' HA ' ' A' ' 952' ' ' VAL . 0.4 OUTLIER -54.05 -31.42 21.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.545 173.736 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 5.5 tttm -65.52 -40.97 93.61 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.064 170.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . 0.573 ' HG2' ' O ' ' A' ' 954' ' ' MET . 14.5 pt-20 -79.38 -42.95 24.4 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 120.393 -0.523 . . . . 0.0 111.023 -176.2 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.658 HG23 ' O ' ' A' ' 954' ' ' MET . 2.2 t -66.26 -38.26 81.49 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.821 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 173.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . 0.429 ' O ' ' HG2' ' A' ' 963' ' ' ARG . . . -58.49 -38.88 92.16 Favored Glycine 0 N--CA 1.434 -1.462 0 N-CA-C 110.813 -0.915 . . . . 0.0 110.813 176.15 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . 0.636 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 25.3 tp -69.14 -35.82 76.77 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 120.766 0.317 . . . . 0.0 110.818 174.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -72.29 -43.31 64.43 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.135 0.493 . . . . 0.0 111.643 -176.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.88 HD11 ' HG ' ' A' ' 995' ' ' LEU . 4.4 pp -86.33 -16.7 36.61 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.968 -176.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.636 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 0.5 OUTLIER -75.42 -32.79 60.83 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 119.064 -1.054 . . . . 0.0 109.939 164.239 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . 0.562 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 59.1 m -64.55 -34.44 78.25 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 175.169 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.516 HD21 HD21 ' A' 1035 ' ' LEU . 26.9 tp -62.78 -41.51 99.28 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.776 173.328 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.744 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.0 tt -70.06 -36.68 75.16 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.049 -175.327 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -72.45 -38.13 68.37 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.306 178.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 7.9 p -66.07 -41.01 91.33 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 118.644 0.656 . . . . 0.0 110.005 175.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.564 HG12 HG23 ' A' ' 984' ' ' ILE . 74.4 t -68.25 -39.11 80.58 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.526 173.631 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.855 ' HB2' HE22 ' A' ' 988' ' ' GLN . 13.1 t70 -66.53 -39.68 88.75 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 122.228 1.014 . . . . 0.0 108.77 -177.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.569 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 28.7 tt0 -70.69 -30.58 67.19 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 114.488 -1.233 . . . . 0.0 110.335 178.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 70.2 m -66.26 -17.74 64.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.272 173.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.615 ' HA ' HD13 ' A' ' 984' ' ' ILE . 10.5 tt -69.41 -51.81 16.17 Favored Pre-proline 0 CA--C 1.53 0.187 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.776 -176.085 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.582 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 94.9 Cg_endo -87.42 2.04 6.9 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 121.178 1.252 . . . . 0.0 113.45 174.426 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' ' 971' ' ' GLU . 25.1 t -85.79 -42.27 15.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.253 172.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -106.67 111.75 63.82 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.249 -178.247 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -78.37 -141.93 0.02 OUTLIER 'Trans proline' 0 CA--C 1.532 0.382 0 C-N-CA 123.422 2.748 . . . . 0.0 111.967 178.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . 0.724 ' O ' ' HB3' ' A' 1046 ' ' MET . . . 67.74 16.13 9.72 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.881 173.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.431 ' HB2' ' O ' ' A' ' 978' ' ' ALA . 48.5 m 78.18 11.24 1.88 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.328 0.651 . . . . 0.0 112.471 179.534 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.629 ' OG1' ' HA ' ' A' 1043 ' ' ARG . 85.5 m -64.66 -21.94 66.85 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.147 0.499 . . . . 0.0 110.778 177.58 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -50.79 -27.36 7.11 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 178.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . 0.511 ' HA ' ' HG2' ' A' ' 985' ' ' GLU . 0.0 OUTLIER -83.11 -21.87 33.55 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 119.481 1.037 . . . . 0.0 111.149 -176.127 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.458 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 1.4 mp0 -77.03 -38.7 52.32 Favored 'General case' 0 CA--C 1.499 -0.981 0 CA-C-O 121.764 0.792 . . . . 0.0 109.143 168.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.847 HG12 HG12 ' A' 1039 ' ' ILE . 73.8 mt -68.17 -36.28 74.63 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.18 0 CA-C-N 114.145 -1.389 . . . . 0.0 109.503 -176.354 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . 0.78 ' O ' ' HD3' ' A' ' 989' ' ' LYS . 13.3 pt-20 -74.29 -40.8 62.03 Favored 'General case' 0 N--CA 1.439 -0.988 0 C-N-CA 118.159 -1.416 . . . . 0.0 109.426 -178.557 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . 0.53 ' O ' ' HB2' ' A' ' 989' ' ' LYS . 2.1 tmt? -68.63 -40.0 80.5 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.56 -174.428 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.973 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -71.88 -45.78 60.09 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.571 -174.104 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.855 HE22 ' HB2' ' A' ' 970' ' ' ASP . 4.4 pt20 -60.31 -23.89 64.56 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.808 175.284 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . 0.799 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 2.6 mptp? -72.55 -39.05 67.78 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.986 0.898 . . . . 0.0 111.05 171.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.591 ' HB3' ' O ' ' A' ' 987' ' ' ALA . 18.6 tp -54.32 -59.66 4.38 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.414 -1.267 . . . . 0.0 111.853 179.135 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.528 ' HB2' HD13 ' A' 1035 ' ' LEU . 0.4 OUTLIER -59.96 -33.06 71.41 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.745 0.783 . . . . 0.0 109.417 177.722 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . 0.799 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 22.7 t-20 -52.03 -52.57 50.01 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 113.911 -1.495 . . . . 0.0 111.438 179.569 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 2.6 p -77.59 -31.61 53.12 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.673 0.619 . . . . 0.0 112.673 -178.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -68.47 -40.51 80.99 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 119.729 -0.789 . . . . 0.0 111.189 176.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 0.88 ' HG ' HD11 ' A' ' 962' ' ' LEU . 0.9 OUTLIER -57.09 -36.65 70.84 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.066 0.546 . . . . 0.0 109.935 166.843 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -66.65 -30.39 70.63 Favored 'General case' 0 C--N 1.312 -1.052 0 C-N-CA 118.985 -1.086 . . . . 0.0 110.903 174.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -75.42 -38.33 59.86 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.853 -0.53 . . . . 0.0 110.678 174.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.882 HD13 ' HB2' ' A' 1025 ' ' ALA . 1.7 tp -56.23 -44.85 80.0 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 120.968 0.413 . . . . 0.0 110.843 178.546 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.51 ' O ' ' HB2' ' A' 1003 ' ' LYS . 77.8 mt -61.21 -43.97 97.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.084 -176.493 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 32.0 m-80 -58.64 -37.49 76.06 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.251 0.548 . . . . 0.0 111.915 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.492 ' O ' ' HB3' ' A' 1017 ' ' TYR . 33.6 mmtp -79.1 -40.92 29.88 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 122.291 1.043 . . . . 0.0 108.656 -176.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.739 ' HG3' ' HB3' ' A' ' 951' ' ' TYR . 9.0 tpp -61.15 -30.09 70.18 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 113.693 -1.594 . . . . 0.0 109.461 176.635 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.563 ' O ' ' HG3' ' A' 1006 ' ' GLN . 4.8 tptm -75.41 -53.54 8.54 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 114.928 -1.033 . . . . 0.0 111.696 -166.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.752 ' HB3' HD23 ' A' 1013 ' ' LEU . 7.3 mp -76.61 -12.43 60.01 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.149 -178.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.677 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -67.91 -42.63 80.81 Favored 'General case' 0 C--O 1.212 -0.874 0 C-N-CA 119.525 -0.87 . . . . 0.0 109.153 177.034 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.879 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -74.77 -33.16 62.25 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 119.024 -0.512 . . . . 0.0 111.668 170.3 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.656 ' HA ' HE21 ' A' 1007 ' ' GLN . 0.0 OUTLIER -47.53 -53.37 14.62 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.116 0.484 . . . . 0.0 110.388 175.609 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.916 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 40.1 m-85 -119.6 40.35 3.4 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.277 -0.569 . . . . 0.0 110.407 175.249 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 1.074 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 14.8 p -51.62 -22.29 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 121.382 0.611 . . . . 0.0 110.632 173.733 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 20.0 mmt -41.16 -38.18 1.03 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.242 -1.345 . . . . 0.0 111.706 175.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -174.47 -81.77 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 174.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 16.6 p -53.43 -73.52 0.04 OUTLIER 'General case' 0 C--O 1.241 0.649 0 CA-C-N 115.12 -0.945 . . . . 0.0 113.051 -166.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.916 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 3.2 mp -46.1 -42.17 13.27 Favored 'General case' 0 CA--C 1.501 -0.921 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -179.502 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 1.074 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -57.33 -46.37 83.33 Favored 'General case' 0 N--CA 1.438 -1.035 0 O-C-N 123.753 0.658 . . . . 0.0 111.616 -166.552 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.793 ' HA ' HD11 ' A' ' 943' ' ' ILE . 47.2 mt-30 -72.52 -34.46 67.6 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 121.013 0.435 . . . . 0.0 110.103 -174.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -71.17 -53.25 15.11 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.856 0.836 . . . . 0.0 110.466 176.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.717 ' CE2' ' HG ' ' A' 1013 ' ' LEU . 7.1 m-85 -67.77 -38.82 83.92 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.618 -1.174 . . . . 0.0 113.95 -172.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.513 ' HD2' ' SD ' ' A' 1021 ' ' MET . 24.0 tptm -80.03 -29.88 39.42 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.91 -176.216 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . 0.716 ' HB3' ' O ' ' A' 1015 ' ' GLN . 1.5 tmtt? -76.21 -40.32 52.51 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.73 176.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . 0.419 ' N ' ' HD3' ' A' 1019 ' ' LYS . 25.4 mt-30 -63.9 -28.48 69.86 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.731 162.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.733 ' HG2' HD12 ' A' ' 998' ' ' LEU . 1.6 ttp -65.61 -47.11 76.77 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 176.622 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . 0.701 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -79.19 -8.96 59.42 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 119.165 -1.014 . . . . 0.0 109.767 -179.249 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 92.2 m -77.0 -44.03 32.5 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 172.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.47 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -78.88 -21.1 47.96 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-O 121.383 0.611 . . . . 0.0 109.659 175.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.882 ' HB2' HD13 ' A' ' 998' ' ' LEU . . . -83.94 -24.01 30.88 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.128 170.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.539 ' HB2' ' O ' ' A' 1022 ' ' LEU . 1.9 t60 -77.96 -22.66 49.15 Favored 'General case' 0 C--O 1.216 -0.658 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 165.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . 0.47 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -69.6 -42.39 74.47 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 123.094 0.558 . . . . 0.0 109.768 162.378 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.66 HD21 ' N ' ' A' ' 995' ' ' LEU . 34.7 mt -57.25 -49.48 75.93 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 169.696 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -58.05 -43.23 86.77 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 174.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.469 ' O ' ' HB2' ' A' 1033 ' ' LYS . 2.8 t -67.72 -51.01 55.23 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.234 0 CA-C-O 121.287 0.565 . . . . 0.0 110.394 -176.1 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.635 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 18.0 m-20 -76.6 -27.31 55.73 Favored 'General case' 0 C--O 1.213 -0.821 0 CA-C-N 115.475 -0.784 . . . . 0.0 112.024 -176.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.652 ' HA ' HD22 ' A' 1035 ' ' LEU . . . -61.47 -40.7 95.47 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 167.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.469 ' HB2' ' O ' ' A' 1030 ' ' VAL . 94.3 mttt -62.86 -39.72 95.27 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.444 0.64 . . . . 0.0 109.72 171.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.635 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 46.6 t30 -76.26 -54.67 6.45 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.856 -170.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.973 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 0.6 OUTLIER -61.71 -42.99 99.69 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 118.782 -0.628 . . . . 0.0 110.953 -173.307 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.656 HD22 HG23 ' A' ' 925' ' ' VAL . 4.6 pp -70.04 -39.87 75.46 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 116.472 -2.091 . . . . 0.0 109.628 -178.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.51 ' N ' HD12 ' A' 1036 ' ' LEU . 38.2 t70 -53.23 -43.33 67.21 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 122.098 0.951 . . . . 0.0 110.83 173.249 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.559 ' HB ' ' O ' ' A' 1035 ' ' LEU . 9.7 t -50.83 -48.82 27.99 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.585 0 CA-C-N 114.061 -1.427 . . . . 0.0 111.299 172.29 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.847 HG12 HG12 ' A' ' 984' ' ' ILE . 2.7 mp -74.95 -34.05 31.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 118.45 0.568 . . . . 0.0 110.912 178.36 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.984 ' HB3' ' HA ' ' A' ' 919' ' ' ILE . 83.5 m-20 -51.39 -53.9 31.94 Favored 'General case' 0 C--O 1.246 0.88 0 CA-C-O 122.403 1.097 . . . . 0.0 109.237 172.165 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.405 ' HB3' ' NE2' ' A' 1053 ' ' HIS . 50.0 mt-30 -76.78 -32.14 57.48 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 115.122 -0.945 . . . . 0.0 110.9 -179.723 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.661 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -54.82 -50.84 67.6 Favored 'General case' 0 CA--C 1.501 -0.922 0 C-N-CA 123.389 0.676 . . . . 0.0 111.62 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.67 ' O ' HG12 ' A' 1047 ' ' ILE . 0.0 OUTLIER -61.94 -37.66 85.54 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.723 -176.622 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.663 ' N ' ' HD3' ' A' 1043 ' ' ARG . 15.4 mt -76.02 -41.95 49.4 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.967 178.316 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.574 ' N ' ' HD2' ' A' 1053 ' ' HIS . 31.9 ttpt -55.53 -49.61 72.18 Favored 'General case' 0 C--O 1.215 -0.743 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.091 179.226 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.724 ' HB3' ' O ' ' A' ' 978' ' ' ALA . 18.0 mmt -64.85 -37.02 86.24 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.841 -0.618 . . . . 0.0 112.105 -176.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.67 HG12 ' O ' ' A' 1043 ' ' ARG . 24.8 mm -48.34 -44.32 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.727 172.32 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 48.8 m -148.71 63.28 1.07 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.053 -176.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -64.35 -15.71 60.89 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -174.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 20.3 p -77.41 1.84 17.83 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 120.657 0.265 . . . . 0.0 111.38 177.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 -152.06 138.21 11.65 Favored Pre-proline 0 C--N 1.331 -0.197 0 CA-C-O 120.829 0.347 . . . . 0.0 110.51 174.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -64.25 117.63 4.65 Favored 'Trans proline' 0 CA--C 1.528 0.193 0 C-N-CA 122.517 2.145 . . . . 0.0 112.434 -178.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . 0.574 ' HD2' ' N ' ' A' 1045 ' ' LYS . 0.7 OUTLIER . . . . . 0 N--CA 1.466 0.359 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.578 178.393 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.681 0 N-CA-C 111.951 -0.459 . . . . 0.0 111.951 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 20.4 m -77.94 121.13 83.65 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-O 120.543 0.211 . . . . 0.0 110.728 179.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_exo -67.84 105.36 1.12 Allowed 'Trans proline' 0 N--CA 1.46 -0.441 0 C-N-CA 122.738 2.292 . . . . 0.0 111.34 175.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -83.15 160.44 38.48 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.637 -178.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 2.7 pp -121.37 156.84 25.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 120.262 0.077 . . . . 0.0 110.992 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 10.0 t 56.64 80.62 0.15 Allowed 'General case' 0 C--O 1.233 0.217 0 O-C-N 123.923 0.764 . . . . 0.0 110.893 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 78.69 11.86 84.82 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.511 -176.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . -89.79 134.72 12.53 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.033 -178.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . 81.69 9.92 84.95 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.633 177.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . 134.16 -109.7 0.81 Allowed Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.246 179.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . 0.714 ' H ' HD22 ' A' 1044 ' ' LEU . . . 64.61 -124.5 29.27 Favored Glycine 0 CA--C 1.521 0.413 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.849 -177.223 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 919' ' ' ILE . . . . . 0.539 ' HA ' ' HB3' ' A' 1040 ' ' ASP . 0.1 OUTLIER -75.16 122.97 29.94 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.49 0 C-N-CA 124.035 0.934 . . . . 0.0 111.058 -176.165 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . . . . . . . . . 36.1 ttp180 -173.13 -28.28 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 15.1 t -139.06 78.1 1.65 Allowed 'General case' 0 C--O 1.237 0.407 0 N-CA-C 113.588 0.959 . . . . 0.0 113.588 -167.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.528 ' O ' HG22 ' A' ' 925' ' ' VAL . 41.1 t-20 -179.48 56.55 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 168.816 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.649 ' HB2' ' CE1' ' A' ' 926' ' ' TYR . 2.0 p30 -72.37 14.77 0.21 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 114.217 1.192 . . . . 0.0 114.217 -174.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.573 ' HB3' HG21 ' A' ' 968' ' ' THR . 51.2 mmtt -76.74 -42.49 40.92 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 120.556 -1.34 . . . . 0.0 111.249 172.393 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.67 ' CG2' ' HB2' ' A' 1036 ' ' LEU . 17.0 m -62.04 -35.06 66.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.365 0.602 . . . . 0.0 110.8 -178.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.649 ' CE1' ' HB2' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -77.5 -27.16 51.78 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 118.598 -0.715 . . . . 0.0 111.863 177.383 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . 0.484 ' O ' HG22 ' A' ' 930' ' ' THR . 6.6 pt-20 -75.75 -23.81 56.03 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 120.482 1.492 . . . . 0.0 109.784 178.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -76.36 -29.14 57.07 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 121.347 0.594 . . . . 0.0 110.19 172.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.636 HG21 HD23 ' A' 1036 ' ' LEU . 82.0 t -82.15 -31.99 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.729 175.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.484 HG22 ' O ' ' A' ' 927' ' ' GLU . 5.8 t -62.47 -29.34 70.46 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 120.349 1.432 . . . . 0.0 107.873 171.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -70.32 -52.22 18.41 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-N 114.452 -1.249 . . . . 0.0 113.17 171.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.461 HD21 HG22 ' A' ' 929' ' ' VAL . 2.0 pp -62.16 -48.31 80.66 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 117.648 0.724 . . . . 0.0 112.792 -178.03 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.701 ' O ' HG22 ' A' ' 936' ' ' VAL . 56.7 t -60.81 -41.83 90.06 Favored 'Isoleucine or valine' 0 C--O 1.239 0.535 0 CA-C-O 121.777 0.799 . . . . 0.0 109.703 -177.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -53.72 -43.3 68.92 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.7 -1.136 . . . . 0.0 110.322 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -67.89 -31.64 71.57 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -176.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.701 HG22 ' O ' ' A' ' 933' ' ' VAL . 2.9 m -61.59 -56.95 14.45 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.271 0 C-N-CA 121.004 -0.278 . . . . 0.0 111.048 -174.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.431 ' N ' HG23 ' A' ' 936' ' ' VAL . 7.1 pt -78.52 -40.32 24.3 Favored 'Isoleucine or valine' 0 C--O 1.25 1.118 0 CA-C-O 121.12 0.486 . . . . 0.0 111.257 -178.478 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -65.55 -49.21 69.75 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.696 -171.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.704 ' O ' HG22 ' A' ' 943' ' ' ILE . 26.2 mmt -71.92 -26.18 62.2 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.6 -179.074 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . . . . . . . . . 5.2 m -50.86 -43.13 59.33 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-O 121.218 0.533 . . . . 0.0 111.421 -176.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . 0.602 ' HA ' ' HG3' ' A' ' 945' ' ' PRO . 42.6 m -105.59 -15.11 15.07 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 178.73 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . . . . . . . . . 6.6 tmtm? -85.18 -53.61 5.14 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 120.161 -0.616 . . . . 0.0 111.696 -172.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.704 HG22 ' O ' ' A' ' 939' ' ' MET . 10.8 tp -62.71 -0.14 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.924 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 178.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.72 ' HB3' ' HD2' ' A' ' 947' ' ' PRO . 47.4 mt-30 99.49 100.28 0.01 OUTLIER Pre-proline 0 N--CA 1.477 0.915 0 C-N-CA 124.927 1.291 . . . . 0.0 112.559 166.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.602 ' HG3' ' HA ' ' A' ' 941' ' ' SER . 80.8 Cg_endo -91.09 40.26 0.35 Allowed 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 123.784 2.989 . . . . 0.0 111.942 178.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.842 ' HB3' ' HD3' ' A' ' 947' ' ' PRO . . . -136.24 -51.83 0.02 OUTLIER Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.519 177.625 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.842 ' HD3' ' HB3' ' A' ' 946' ' ' ALA . 1.0 OUTLIER -85.95 171.39 8.1 Favored 'Trans proline' 0 N--CA 1.454 -0.811 0 C-N-CA 122.262 1.974 . . . . 0.0 108.62 160.87 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.804 ' HA ' HG21 ' A' 1009 ' ' VAL . 13.9 Cg_endo -64.21 116.21 3.6 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 120.91 1.074 . . . . 0.0 112.755 177.634 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.522 ' HG2' HG23 ' A' ' 943' ' ' ILE . 50.7 mt-10 -57.75 -19.61 28.95 Favored 'General case' 0 C--N 1.333 -0.127 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 165.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.69 ' HB3' ' HG2' ' A' ' 953' ' ' PRO . 21.2 tp10 73.12 -10.86 0.95 Allowed 'General case' 0 C--N 1.345 0.401 0 CA-C-N 114.302 -1.317 . . . . 0.0 108.85 -170.478 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.794 ' CE1' ' HD3' ' A' 1018 ' ' LYS . 39.0 m-85 53.01 -54.11 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 125.632 1.573 . . . . 0.0 114.397 -178.223 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 0.628 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 22.3 t -43.66 -48.45 19.72 Favored Pre-proline 0 C--N 1.322 -0.606 0 C-N-CA 122.793 0.437 . . . . 0.0 111.98 174.291 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 0.69 ' HG2' ' HB3' ' A' ' 950' ' ' GLU . 13.8 Cg_exo -47.6 -49.26 13.71 Favored 'Trans proline' 0 C--N 1.353 0.809 0 C-N-CA 122.861 2.374 . . . . 0.0 113.995 178.303 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.621 ' HG3' ' O ' ' A' ' 951' ' ' TYR . 4.5 ppp? -76.43 -32.26 58.35 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.212 0.529 . . . . 0.0 110.54 179.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.51 ' HA ' HG12 ' A' ' 958' ' ' VAL . 78.5 t -57.42 -35.3 49.0 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.374 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.327 168.156 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.493 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 9.9 tmtt? -65.71 -32.25 73.7 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.626 0.25 . . . . 0.0 111.122 173.489 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -77.99 -45.45 23.74 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.831 0.348 . . . . 0.0 110.993 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.51 HG12 ' HA ' ' A' ' 955' ' ' VAL . 13.3 p -76.4 -31.95 21.21 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.19 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.069 178.386 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . 0.469 ' O ' ' HG2' ' A' ' 963' ' ' ARG . . . -61.21 -38.39 95.57 Favored Glycine 0 N--CA 1.446 -0.685 0 N-CA-C 110.867 -0.893 . . . . 0.0 110.867 173.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . 0.492 HD12 HH11 ' A' ' 963' ' ' ARG . 15.5 tp -64.26 -42.79 96.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.929 0.395 . . . . 0.0 110.506 175.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -73.28 -34.61 65.87 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.087 0.47 . . . . 0.0 111.936 -176.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.863 HD11 HD22 ' A' ' 995' ' ' LEU . 3.6 pp -80.83 -30.34 35.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.83 -179.092 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.492 HH11 HD12 ' A' ' 960' ' ' LEU . 9.8 ptp85 -72.71 -33.8 66.68 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 119.629 -0.828 . . . . 0.0 110.943 170.538 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . 0.455 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 17.6 m -66.57 -33.52 75.85 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 119.603 -0.839 . . . . 0.0 108.974 176.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.487 ' O ' HG23 ' A' ' 969' ' ' VAL . 17.2 tp -60.84 -49.45 77.44 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.558 0.694 . . . . 0.0 109.612 170.306 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.573 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.4 tt -55.26 -45.34 76.1 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 114.459 -1.246 . . . . 0.0 109.735 -178.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -66.42 -42.01 88.39 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.007 -0.997 . . . . 0.0 112.131 178.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.573 HG21 ' HB3' ' A' ' 924' ' ' LYS . 0.8 OUTLIER -61.85 -34.91 76.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 119.193 0.906 . . . . 0.0 110.817 175.838 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.976 HG12 HG23 ' A' ' 984' ' ' ILE . 52.7 t -73.38 -42.03 57.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.916 175.54 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.983 ' HB2' HE22 ' A' ' 988' ' ' GLN . 31.4 t70 -69.9 -40.02 75.86 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 122.111 0.957 . . . . 0.0 109.228 -175.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.608 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 9.1 tp10 -66.69 -31.89 72.84 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.63 -1.168 . . . . 0.0 109.483 177.036 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.65 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 27.3 m -68.76 -17.35 64.02 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.256 174.681 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.753 ' HB2' HG21 ' A' ' 984' ' ' ILE . 9.0 tt -64.39 -51.94 57.07 Favored Pre-proline 0 C--O 1.226 -0.134 0 C-N-CA 120.451 -0.499 . . . . 0.0 109.969 -178.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.741 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 6.3 Cg_exo -80.99 -4.0 12.5 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 121.515 1.477 . . . . 0.0 113.262 171.571 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.65 ' HB ' ' HA ' ' A' ' 972' ' ' SER . 24.6 t -73.07 -49.76 36.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 C-N-CA 120.449 -0.5 . . . . 0.0 110.204 172.206 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.523 ' HA ' ' HD3' ' A' ' 977' ' ' PRO . 3.9 mm? -80.81 125.51 80.04 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.254 -178.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 0.523 ' HD3' ' HA ' ' A' ' 976' ' ' LEU . 2.2 Cg_endo -83.38 0.31 9.54 Favored 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 123.452 2.768 . . . . 0.0 112.164 179.02 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -99.13 -174.92 2.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.431 179.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.613 ' HB2' ' SD ' ' A' 1046 ' ' MET . 27.4 m -77.5 20.95 0.29 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.895 0.332 . . . . 0.0 111.895 -178.276 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.512 HG23 ' CB ' ' A' 1042 ' ' ALA . 20.6 m -64.08 -14.2 52.88 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 121.382 0.611 . . . . 0.0 110.308 177.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.623 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 11.6 m170 -50.88 -39.71 54.63 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 115.061 -0.972 . . . . 0.0 111.722 177.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . 0.428 ' HE ' ' HB3' ' A' ' 982' ' ' ARG . 5.6 ptp180 -83.41 -20.71 33.67 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.629 -0.428 . . . . 0.0 112.116 -173.03 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.708 ' CG ' ' HB2' ' A' 1053 ' ' HIS . 1.3 mp0 -71.44 -34.7 70.51 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-O 121.614 0.721 . . . . 0.0 109.275 167.58 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.976 HG23 HG12 ' A' ' 969' ' ' VAL . 58.1 mt -72.24 -30.52 35.84 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-N 114.662 -1.154 . . . . 0.0 108.895 179.282 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . 0.623 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 35.5 mt-10 -65.41 -52.46 53.22 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.569 174.199 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 51.9 tpp -70.83 -42.52 70.09 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.913 -171.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.65 ' HB1' ' HB3' ' A' 1035 ' ' LEU . . . -74.21 -50.69 18.09 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.45 -172.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.983 HE22 ' HB2' ' A' ' 970' ' ' ASP . 2.7 pt20 -65.48 -22.2 66.71 Favored 'General case' 0 C--O 1.226 -0.151 0 CA-C-O 121.617 0.723 . . . . 0.0 109.204 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . 0.723 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 9.0 ttmm -73.47 -44.42 58.01 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 114.786 -1.097 . . . . 0.0 112.018 171.214 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.67 ' HB3' HD21 ' A' 1035 ' ' LEU . 15.6 tp -57.39 -58.36 8.62 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 119.569 -0.852 . . . . 0.0 111.705 -179.173 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.525 ' HB3' HD23 ' A' 1035 ' ' LEU . 3.2 pp -57.86 -29.62 65.15 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.38 0.609 . . . . 0.0 110.358 177.82 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . 0.723 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 44.9 t-20 -55.55 -55.91 26.41 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.637 -1.165 . . . . 0.0 110.986 175.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 46.2 m -73.01 -32.98 65.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.997 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . 0.718 ' C ' HD22 ' A' ' 998' ' ' LEU . 2.6 m-20 -55.08 -62.5 1.62 Allowed 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.903 174.412 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 0.863 HD22 HD11 ' A' ' 962' ' ' LEU . 18.0 tp -48.2 -30.06 4.32 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 123.291 0.37 . . . . 0.0 111.165 175.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -69.74 -37.87 76.63 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 119.556 -0.858 . . . . 0.0 111.764 178.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -78.26 -39.55 39.81 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.523 0.677 . . . . 0.0 109.937 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 1.041 HD23 ' HG ' ' A' 1028 ' ' LEU . 0.0 OUTLIER -58.18 -34.18 70.05 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.086 179.746 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.693 ' O ' ' HG3' ' A' 1002 ' ' MET . 44.1 mt -67.1 -37.74 79.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 CA-C-N 115.11 -0.95 . . . . 0.0 111.78 172.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.56 -34.77 74.64 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.365 0.602 . . . . 0.0 111.668 179.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.723 ' HD2' ' OE1' ' A' 1020 ' ' GLN . 42.8 mmtm -82.61 -41.34 19.63 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.418 0.628 . . . . 0.0 110.904 -175.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.693 ' HG3' ' O ' ' A' ' 999' ' ' ILE . 0.0 OUTLIER -61.25 -25.95 67.43 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 122.248 1.023 . . . . 0.0 108.642 175.326 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.603 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 26.8 tptt -71.83 -54.07 11.29 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 113.913 -1.494 . . . . 0.0 110.458 -167.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.806 ' HB3' HD23 ' A' 1013 ' ' LEU . 8.7 mp -73.65 -13.48 61.0 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.671 -179.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.772 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -68.97 -44.98 71.82 Favored 'General case' 0 C--N 1.319 -0.747 0 C-N-CA 119.533 -0.867 . . . . 0.0 109.983 178.087 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.82 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 1.0 OUTLIER -74.44 -28.57 61.11 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 121.891 -0.506 . . . . 0.0 111.265 173.406 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.969 ' HA ' HE21 ' A' 1007 ' ' GLN . 0.0 OUTLIER -50.16 -57.54 7.51 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.277 0.56 . . . . 0.0 110.25 173.995 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 1.073 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 24.2 m-85 -107.16 35.06 3.17 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.984 175.355 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 1.047 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 11.2 p -45.39 -29.11 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.512 -0.494 0 O-C-N 123.536 0.522 . . . . 0.0 110.954 174.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 25.8 ttp -40.47 -45.78 2.31 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.52 -1.218 . . . . 0.0 111.599 178.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 28.1 m -161.53 -82.37 0.04 OUTLIER 'General case' 0 C--O 1.245 0.853 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 176.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 11.2 p -55.75 -71.64 0.08 Allowed 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.067 -0.97 . . . . 0.0 113.115 -164.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 1.073 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 6.5 mp -51.84 -38.0 54.18 Favored 'General case' 0 CA--C 1.506 -0.736 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -178.207 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 1.047 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -55.19 -53.54 54.76 Favored 'General case' 0 N--CA 1.442 -0.837 0 O-C-N 123.423 0.452 . . . . 0.0 111.599 -168.264 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.45 HE21 ' HB3' ' A' 1015 ' ' GLN . 1.3 pt20 -73.45 -36.55 65.91 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.569 -175.677 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . 0.466 ' HG2' ' NE2' ' A' 1020 ' ' GLN . 36.5 tt0 -68.27 -57.63 5.67 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.566 178.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.772 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 7.3 m-85 -62.03 -33.15 73.82 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 113.696 0.999 . . . . 0.0 113.696 -176.324 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.794 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 35.0 tptt -80.24 -32.12 38.43 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 114.466 -1.243 . . . . 0.0 110.582 -176.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . 0.445 ' HA ' ' HD2' ' A' 1019 ' ' LYS . 0.2 OUTLIER -74.59 -35.37 63.0 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 176.347 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . 0.723 ' OE1' ' HD2' ' A' 1001 ' ' LYS . 77.5 mt-30 -56.59 -41.16 76.52 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.718 158.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.567 ' HG3' ' HB3' ' A' 1002 ' ' MET . 1.5 tmt? -65.99 -51.8 55.12 Favored 'General case' 0 C--O 1.219 -0.544 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -172.468 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.84 -18.5 53.91 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 119.676 -0.81 . . . . 0.0 110.394 -172.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 34.6 m -84.17 -27.02 28.36 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 175.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.754 ' HB1' ' CD1' ' A' ' 998' ' ' LEU . . . -81.36 -28.14 34.59 Favored 'General case' 0 C--O 1.212 -0.904 0 CA-C-N 115.454 -0.793 . . . . 0.0 109.596 172.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.484 ' HA ' ' HB2' ' A' 1028 ' ' LEU . . . -83.38 -19.6 35.76 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 169.399 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.522 ' O ' HG23 ' A' 1030 ' ' VAL . 32.7 t-80 -75.12 -21.75 58.65 Favored 'General case' 0 C--O 1.213 -0.863 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 161.522 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . 0.681 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -74.32 -39.46 62.84 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.33 0.652 . . . . 0.0 110.098 166.464 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 1.041 ' HG ' HD23 ' A' ' 998' ' ' LEU . 23.0 mt -55.92 -49.59 73.03 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 164.037 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . 0.514 ' CB ' HG22 ' A' ' 933' ' ' VAL . . . -60.21 -38.79 84.4 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 112.64 0.607 . . . . 0.0 112.64 177.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.522 HG23 ' O ' ' A' 1026 ' ' HIS . 11.3 t -75.89 -51.46 20.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.358 0.599 . . . . 0.0 110.995 -175.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.591 ' O ' HD22 ' A' 1035 ' ' LEU . 6.6 m-20 -75.39 -33.59 61.02 Favored 'General case' 0 C--O 1.212 -0.907 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.149 -176.384 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.432 ' HB1' HD22 ' A' ' 965' ' ' LEU . . . -70.88 -24.99 62.6 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.559 -0.456 . . . . 0.0 109.938 174.333 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.501 ' HB3' ' O ' ' A' 1030 ' ' VAL . 50.6 tttm -63.38 -52.2 62.64 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 167.4 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.48 ' O ' HG23 ' A' 1038 ' ' VAL . 52.5 t30 -63.51 -50.12 70.84 Favored 'General case' 0 C--O 1.209 -1.038 0 CA-C-N 114.599 -1.182 . . . . 0.0 111.48 -177.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.67 HD21 ' HB3' ' A' ' 990' ' ' LEU . 0.0 OUTLIER -59.29 -42.07 90.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 119.395 -0.336 . . . . 0.0 110.498 -178.067 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.67 ' HB2' ' CG2' ' A' ' 925' ' ' VAL . 3.2 pp -69.69 -41.26 75.66 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 117.549 -1.66 . . . . 0.0 109.295 179.712 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 14.1 t70 -56.3 -40.0 73.64 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 114.37 -1.287 . . . . 0.0 109.786 175.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.542 ' HB ' ' O ' ' A' 1035 ' ' LEU . 6.6 t -53.47 -48.34 58.0 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.091 0 CA-C-N 113.822 -1.536 . . . . 0.0 111.053 174.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.601 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 2.0 mp -74.27 -33.96 35.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 118.792 0.723 . . . . 0.0 111.044 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.539 ' HB3' ' HA ' ' A' ' 919' ' ' ILE . 0.5 OUTLIER -62.06 -49.87 74.23 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.21 0.529 . . . . 0.0 110.084 174.353 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.467 ' HB2' ' NE2' ' A' 1053 ' ' HIS . 36.7 mt-30 -63.7 -40.71 97.47 Favored 'General case' 0 C--O 1.213 -0.862 0 C-N-CA 120.334 -0.546 . . . . 0.0 109.612 172.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.601 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -53.3 -52.83 57.85 Favored 'General case' 0 CA--C 1.494 -1.205 0 C-N-CA 123.619 0.768 . . . . 0.0 112.115 -175.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.689 ' O ' HG12 ' A' 1047 ' ' ILE . 0.1 OUTLIER -61.93 -44.12 97.42 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.034 -174.83 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.714 HD22 ' H ' ' A' ' 918' ' ' GLY . 3.7 tt -80.07 -27.78 39.27 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-O 121.484 0.659 . . . . 0.0 110.291 -175.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.629 ' HG2' ' HG3' ' A' 1049 ' ' GLN . 0.3 OUTLIER -77.39 -41.24 40.84 Favored 'General case' 0 C--O 1.215 -0.73 0 N-CA-C 108.598 -0.889 . . . . 0.0 108.598 -179.964 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.613 ' SD ' ' HB2' ' A' ' 979' ' ' SER . 7.1 mmt -65.07 -31.52 72.77 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.207 175.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.689 HG12 ' O ' ' A' 1043 ' ' ARG . 19.0 mm -52.94 -50.7 42.8 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.935 168.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 34.5 t -132.45 64.51 1.6 Allowed 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 119.851 -0.74 . . . . 0.0 112.18 -177.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . 0.629 ' HG3' ' HG2' ' A' 1045 ' ' LYS . 10.9 mm100 -149.34 -170.63 3.68 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 114.819 -1.082 . . . . 0.0 109.47 167.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 8.2 t -144.58 25.0 1.52 Allowed 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 171.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 77.7 mtp180 -140.79 147.21 47.51 Favored Pre-proline 0 N--CA 1.453 -0.285 0 CA-C-N 114.747 -1.115 . . . . 0.0 109.618 -177.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . 0.418 ' HA ' ' HZ3' ' A' 1045 ' ' LYS . 57.7 Cg_endo -73.52 168.28 25.15 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 122.047 1.831 . . . . 0.0 111.224 173.128 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . 0.708 ' HB2' ' CG ' ' A' ' 983' ' ' GLU . 3.2 t-80 . . . . . 0 C--N 1.324 -0.527 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.043 -167.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.748 0 N-CA-C 111.944 -0.463 . . . . 0.0 111.944 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 909' ' ' SER . . . . . 0.644 ' O ' ' HB2' ' A' ' 913' ' ' SER . 16.2 m -109.75 136.51 20.33 Favored Pre-proline 0 C--N 1.322 -0.588 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 -178.33 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -48.43 -45.09 27.96 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 123.839 3.026 . . . . 0.0 113.058 -176.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -62.25 115.54 8.13 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.722 -0.752 . . . . 0.0 111.733 175.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 912' ' ' ILE . . . . . 0.451 HG22 ' O ' ' A' ' 912' ' ' ILE . 20.2 mt 67.86 25.98 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-O 121.695 0.759 . . . . 0.0 110.586 -178.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 913' ' ' SER . . . . . 0.644 ' HB2' ' O ' ' A' ' 909' ' ' SER . 27.1 t -81.8 -23.45 36.54 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.261 0.553 . . . . 0.0 110.515 176.524 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 162.65 84.43 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.978 -0.63 . . . . 0.0 111.534 -178.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . -76.24 115.78 4.55 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.563 -0.827 . . . . 0.0 111.53 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . -79.04 59.8 4.25 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 121.022 -0.609 . . . . 0.0 111.79 -179.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . 92.04 -165.79 29.44 Favored Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 121.186 -0.531 . . . . 0.0 112.057 -178.158 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -94.76 -70.48 1.09 Allowed Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.539 -0.838 . . . . 0.0 111.945 178.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 919' ' ' ILE . . . . . 0.688 HG22 HD12 ' A' 1044 ' ' LEU . 0.1 OUTLIER -65.8 151.5 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.419 -1.996 0 C-N-CA 123.51 0.724 . . . . 0.0 111.584 178.838 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.587 ' H ' ' CG ' ' A' 1040 ' ' ASP . 22.2 ptt180 45.3 71.5 0.27 Allowed 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 126.237 1.815 . . . . 0.0 112.328 -167.424 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 15.9 t -136.52 3.14 2.76 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.417 -1.265 . . . . 0.0 109.289 173.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -142.31 61.99 1.43 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.349 -177.761 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.695 ' O ' ' HD2' ' A' ' 926' ' ' TYR . 4.3 m-20 -70.65 -2.06 13.21 Favored 'General case' 0 C--O 1.217 -0.655 0 N-CA-C 113.702 1.001 . . . . 0.0 113.702 -169.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . . . . . . . . . 2.0 tppp? -57.68 -33.75 68.67 Favored 'General case' 0 C--N 1.316 -0.855 0 O-C-N 121.19 -0.944 . . . . 0.0 111.38 -175.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.726 HG21 HD23 ' A' 1036 ' ' LEU . 26.9 m -64.15 -29.34 47.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.316 0.579 . . . . 0.0 111.092 176.043 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.695 ' HD2' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -70.51 -32.93 70.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.441 -178.628 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . 0.691 ' HA ' ' HB ' ' A' ' 930' ' ' THR . 10.8 pt-20 -76.91 -24.22 52.47 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 118.951 -1.1 . . . . 0.0 111.004 176.059 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -69.14 -31.08 69.5 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 172.316 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.587 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 43.7 t -80.45 -30.76 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.516 173.174 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.691 ' HB ' ' HA ' ' A' ' 927' ' ' GLU . 6.2 m -56.09 -43.32 77.94 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 166.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -69.54 -52.9 18.91 Favored Glycine 0 CA--C 1.531 1.074 0 CA-C-N 114.744 -1.116 . . . . 0.0 113.941 175.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.587 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.9 pp -65.78 -45.88 80.83 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 117.508 0.654 . . . . 0.0 112.763 -174.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 56.0 t -66.05 -36.43 77.45 Favored 'Isoleucine or valine' 0 C--O 1.239 0.509 0 CA-C-O 121.21 0.529 . . . . 0.0 110.636 -177.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.519 ' O ' ' HB3' ' A' ' 938' ' ' GLU . 60.9 tttt -63.79 -31.88 73.2 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.574 179.15 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 0.608 ' O ' ' HB2' ' A' ' 939' ' ' MET . . . -66.27 -40.88 90.43 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 121.946 -0.472 . . . . 0.0 110.724 175.124 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.847 HG22 ' HB1' ' A' 1025 ' ' ALA . 54.1 t -50.38 -76.73 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.342 -177.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.442 HG13 ' N ' ' A' ' 938' ' ' GLU . 25.0 pt -80.35 -45.29 22.15 Favored 'Isoleucine or valine' 0 C--O 1.244 0.776 0 CA-C-O 121.191 0.52 . . . . 0.0 112.188 -173.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.519 ' HB3' ' O ' ' A' ' 934' ' ' LYS . 31.7 tt0 -67.92 -47.36 68.97 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-O 121.267 0.556 . . . . 0.0 109.665 -169.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.608 ' HB2' ' O ' ' A' ' 935' ' ' ALA . 63.6 mtt -74.46 -23.94 58.97 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.814 178.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.659 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 29.1 p -50.61 -40.85 53.87 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.578 0.704 . . . . 0.0 110.512 -176.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 8.8 m -104.67 -21.27 13.42 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.641 -179.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.469 ' O ' ' HD3' ' A' ' 945' ' ' PRO . 45.6 tttp -83.85 -48.3 10.19 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -167.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.58 HG12 ' O ' ' A' ' 939' ' ' MET . 24.9 pt -73.77 1.5 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 N-CA-C 113.774 1.028 . . . . 0.0 113.774 178.347 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.443 ' N ' ' CD ' ' A' ' 945' ' ' PRO . 23.1 tp60 -83.19 -1.16 0.05 OUTLIER Pre-proline 0 CA--C 1.576 1.944 0 N-CA-C 116.276 1.954 . . . . 0.0 116.276 -174.153 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.469 ' HD3' ' O ' ' A' ' 942' ' ' LYS . 39.9 Cg_exo -60.75 -25.21 80.63 Favored 'Trans proline' 0 C--N 1.369 1.63 0 CA-C-N 123.131 2.154 . . . . 0.0 112.561 174.562 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . . . . . . . . . . . -73.96 165.66 51.28 Favored Pre-proline 0 C--N 1.326 -0.419 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 173.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.974 ' HB2' ' HD3' ' A' ' 948' ' ' PRO . 52.6 Cg_exo -49.87 -57.77 2.12 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 121.418 1.412 . . . . 0.0 111.446 177.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.974 ' HD3' ' HB2' ' A' ' 947' ' ' PRO . 90.9 Cg_endo -106.36 166.1 0.13 Allowed 'Trans proline' 0 N--CA 1.443 -1.458 0 C-N-CA 122.32 2.013 . . . . 0.0 112.038 165.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.525 ' HB2' ' CE1' ' A' ' 951' ' ' TYR . 55.3 mt-10 -72.92 -5.21 36.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.605 0.717 . . . . 0.0 109.695 169.761 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.851 ' HB3' ' HG2' ' A' ' 953' ' ' PRO . 32.2 mt-10 62.88 58.87 1.45 Allowed 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 114.179 -1.373 . . . . 0.0 108.388 -172.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.996 ' HB3' ' HG2' ' A' 1002 ' ' MET . 24.9 m-85 -52.75 -43.3 65.66 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 113.336 -1.756 . . . . 0.0 113.424 -178.708 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 0.716 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 64.4 t -60.54 -53.14 67.46 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 110.466 -0.198 . . . . 0.0 110.466 175.398 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 0.851 ' HG2' ' HB3' ' A' ' 950' ' ' GLU . 17.3 Cg_exo -48.55 -34.5 26.61 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 122.315 2.01 . . . . 0.0 113.03 167.169 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.49 ' O ' HG12 ' A' ' 958' ' ' VAL . 34.3 tpp -73.26 -31.99 64.42 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.145 177.049 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.549 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 89.0 t -52.33 -39.53 28.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 169.62 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.513 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 8.0 tttt -67.31 -37.36 83.21 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.692 174.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -78.68 -46.82 18.24 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 111.992 0.368 . . . . 0.0 111.992 -173.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.535 HG11 HD21 ' A' ' 998' ' ' LEU . 12.5 p -86.63 -24.87 6.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 -178.206 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -65.25 -27.13 72.05 Favored Glycine 0 N--CA 1.445 -0.754 0 N-CA-C 110.24 -1.144 . . . . 0.0 110.24 171.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . 0.571 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 10.3 tt -76.92 -35.14 57.54 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.253 -0.473 . . . . 0.0 109.957 175.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.417 ' HB1' ' HB3' ' A' ' 932' ' ' LEU . . . -71.17 -42.09 69.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.306 -175.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.855 HD13 HD22 ' A' ' 991' ' ' LEU . 0.5 OUTLIER -67.41 -42.83 82.62 Favored 'General case' 0 C--O 1.217 -0.628 0 CA-C-O 118.853 -0.594 . . . . 0.0 111.056 170.757 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.571 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 29.2 ptt180 -64.87 -31.55 72.84 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 119.912 1.233 . . . . 0.0 110.381 -179.067 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 34.2 m -68.79 -33.99 74.79 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.497 HD21 HD21 ' A' 1035 ' ' LEU . 22.0 tp -70.92 -36.27 72.6 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.581 -1.19 . . . . 0.0 109.556 176.027 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.6 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.5 tt -71.77 -39.5 69.92 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 114.828 -1.078 . . . . 0.0 108.399 -175.312 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -74.05 -28.05 61.22 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 114.986 -1.006 . . . . 0.0 112.155 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.51 ' OG1' HG12 ' A' ' 925' ' ' VAL . 5.2 p -74.46 -41.05 61.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 118.475 0.579 . . . . 0.0 110.164 175.324 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.898 HG12 HG23 ' A' ' 984' ' ' ILE . 60.8 t -68.73 -36.48 74.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.564 172.251 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.792 ' HB2' HE22 ' A' ' 988' ' ' GLN . 24.1 t70 -70.87 -37.37 73.07 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.626 0.727 . . . . 0.0 109.175 179.652 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.615 ' O ' HG23 ' A' ' 975' ' ' VAL . 14.0 tp10 -65.88 -32.85 74.6 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.418 176.434 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.401 ' HA ' ' CG2' ' A' ' 975' ' ' VAL . 69.8 m -69.04 -17.59 63.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.055 175.406 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.724 ' HB2' HG21 ' A' ' 984' ' ' ILE . 9.2 tt -67.68 -51.42 30.79 Favored Pre-proline 0 CA--C 1.538 0.505 0 CA-C-O 119.543 -0.265 . . . . 0.0 110.43 -178.184 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.469 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 90.2 Cg_endo -82.9 2.07 8.72 Favored 'Trans proline' 0 C--N 1.356 0.932 0 C-N-CA 121.359 1.373 . . . . 0.0 112.955 170.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.615 HG23 ' O ' ' A' ' 971' ' ' GLU . 26.0 t -67.9 -43.79 85.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 166.675 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . . . . . . . . . 36.5 tp -139.6 94.11 9.47 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.518 174.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -77.77 34.17 0.47 Allowed 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 123.367 2.711 . . . . 0.0 113.163 -173.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . 0.729 ' O ' ' HB3' ' A' ' 981' ' ' HIS . . . -104.73 -148.98 0.41 Allowed 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.269 -179.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.754 ' HB2' ' SD ' ' A' 1046 ' ' MET . 53.7 m -74.23 3.96 6.43 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.415 ' HA ' ' HB1' ' A' 1042 ' ' ALA . 89.7 m -76.38 -29.42 57.12 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 167.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.729 ' HB3' ' O ' ' A' ' 978' ' ' ALA . 0.3 OUTLIER -58.12 -33.43 69.14 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 114.152 -1.386 . . . . 0.0 111.669 -179.861 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -84.25 -21.02 31.28 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 120.29 -0.564 . . . . 0.0 112.404 -176.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.516 ' HG3' HG13 ' A' 1038 ' ' VAL . 0.3 OUTLIER -73.14 -33.62 65.62 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 168.382 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.898 HG23 HG12 ' A' ' 969' ' ' VAL . 52.6 mt -68.66 -31.99 53.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.213 176.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . 0.568 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 46.2 mt-10 -62.69 -53.48 53.8 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.348 0.594 . . . . 0.0 109.751 175.687 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 89.8 mtp -69.84 -43.45 71.9 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.133 -0.94 . . . . 0.0 111.557 -171.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 1.065 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -67.78 -51.03 53.64 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.062 -0.972 . . . . 0.0 112.636 -171.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.792 HE22 ' HB2' ' A' ' 970' ' ' ASP . 3.7 pt20 -63.52 -28.39 69.92 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 119.815 -0.754 . . . . 0.0 111.232 -179.33 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . 0.721 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 90.9 mttt -70.04 -40.95 74.84 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.59 0.709 . . . . 0.0 111.492 172.46 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.62 HD23 ' HB3' ' A' 1035 ' ' LEU . 14.2 tp -49.6 -60.81 2.53 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 114.799 -1.092 . . . . 0.0 113.013 -176.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.855 HD22 HD13 ' A' ' 962' ' ' LEU . 5.1 tt -69.14 -27.45 65.57 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.239 0.542 . . . . 0.0 109.547 -179.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . 0.721 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 33.1 t-20 -51.08 -50.67 58.27 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.355 177.371 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 14.6 m -76.85 -33.32 57.9 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -65.31 -40.82 94.28 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 120.499 -0.481 . . . . 0.0 111.872 177.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 0.573 ' N ' HD21 ' A' 1028 ' ' LEU . 6.3 tt -71.28 -14.33 62.18 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 174.16 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -76.51 -26.27 55.09 Favored 'General case' 0 C--N 1.315 -0.893 0 C-N-CA 119.633 -0.827 . . . . 0.0 110.023 167.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.656 ' O ' ' HG2' ' A' 1001 ' ' LYS . 5.4 mm-40 -74.4 -43.75 54.98 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 173.223 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.678 HD13 ' HB2' ' A' 1025 ' ' ALA . 0.1 OUTLIER -55.08 -46.45 75.44 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.162 -0.926 . . . . 0.0 111.205 -178.657 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.495 ' O ' ' HB2' ' A' 1003 ' ' LYS . 95.1 mt -64.97 -42.66 95.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.666 -176.292 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -60.82 -41.62 96.08 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.174 0.511 . . . . 0.0 111.829 -178.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.871 ' HB3' ' HG3' ' A' 1020 ' ' GLN . 59.8 mmtt -73.86 -42.86 60.19 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 122.63 1.205 . . . . 0.0 108.457 -176.168 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.996 ' HG2' ' HB3' ' A' ' 951' ' ' TYR . 31.6 ttp -62.09 -28.57 69.71 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 113.101 -1.863 . . . . 0.0 109.307 179.499 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 8.7 tptm -69.43 -52.66 24.74 Favored 'General case' 0 N--CA 1.439 -0.999 0 CA-C-N 114.17 -1.377 . . . . 0.0 110.726 -169.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.613 ' HB2' ' CD2' ' A' 1017 ' ' TYR . 93.1 mt -74.7 -13.24 60.59 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.443 -179.103 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.56 ' HB2' ' CB ' ' A' 1017 ' ' TYR . . . -66.72 -46.95 73.86 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 119.585 -0.846 . . . . 0.0 109.797 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.913 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 3.5 pp0? -70.61 -31.41 68.37 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 118.942 -0.551 . . . . 0.0 112.145 171.003 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.584 ' HG3' HD23 ' A' 1004 ' ' LEU . 18.2 mm-40 -48.76 -51.1 30.83 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.149 0.499 . . . . 0.0 111.287 178.321 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.901 ' HB2' ' HG ' ' A' 1013 ' ' LEU . 89.2 m-85 -121.87 43.13 2.93 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 120.279 -0.569 . . . . 0.0 109.861 172.033 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.992 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 7.7 p -51.71 -19.9 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.515 -0.4 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.81 172.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 87.6 mmm -32.09 -53.61 0.29 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.055 -1.43 . . . . 0.0 111.065 170.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 23.9 m -161.66 -80.77 0.04 OUTLIER 'General case' 0 C--O 1.246 0.878 0 CA-C-O 121.188 0.518 . . . . 0.0 112.265 176.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 3.2 p -55.51 -65.45 0.59 Allowed 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.256 -0.883 . . . . 0.0 113.224 -167.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.901 ' HG ' ' HB2' ' A' 1008 ' ' TYR . 1.9 mm? -44.81 -45.38 10.06 Favored 'General case' 0 CA--C 1.508 -0.649 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 178.155 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 0.992 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -59.58 -48.13 82.87 Favored 'General case' 0 N--CA 1.442 -0.843 0 C-N-CA 119.985 -0.686 . . . . 0.0 110.941 -164.984 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -70.44 -40.42 73.77 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.639 -174.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -73.89 -41.04 62.72 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.286 0.565 . . . . 0.0 111.558 -177.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.746 ' CE1' HD13 ' A' 1013 ' ' LEU . 19.2 m-85 -81.1 -28.97 34.98 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 122.019 0.914 . . . . 0.0 112.442 -170.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.659 ' HD3' ' CE1' ' A' ' 951' ' ' TYR . 38.0 tptt -78.71 -28.4 45.08 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 113.933 -1.485 . . . . 0.0 110.29 178.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -71.86 -56.86 4.97 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.398 176.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . 0.871 ' HG3' ' HB3' ' A' 1001 ' ' LYS . 10.3 pt20 -53.69 -26.21 21.72 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 119.708 -0.187 . . . . 0.0 110.799 166.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.565 ' HB3' ' HA ' ' A' 1018 ' ' LYS . 2.1 tmt? -66.51 -51.75 53.3 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 118.207 0.458 . . . . 0.0 110.62 173.705 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . 0.835 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.2 OUTLIER -88.63 -1.76 58.24 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 119.205 -0.998 . . . . 0.0 109.84 -175.234 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . 0.42 ' HB ' ' HA ' ' A' 1020 ' ' GLN . 33.1 m -87.1 -39.15 15.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.447 171.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.531 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -76.92 -21.24 55.16 Favored 'General case' 0 C--O 1.222 -0.356 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 170.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.847 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -84.52 -25.44 28.79 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.169 169.624 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.623 ' O ' HG23 ' A' 1030 ' ' VAL . 4.1 t60 -74.17 -26.82 60.52 Favored 'General case' 0 C--O 1.217 -0.639 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 167.045 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -68.01 -42.46 80.67 Favored 'General case' 0 C--N 1.321 -0.654 0 C-N-CA 123.454 0.701 . . . . 0.0 110.327 164.318 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.628 HD11 HD22 ' A' ' 998' ' ' LEU . 20.3 mt -57.08 -46.61 82.39 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 170.463 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -58.07 -41.75 84.04 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 111.711 0.263 . . . . 0.0 111.711 173.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' 1026 ' ' HIS . 19.3 t -67.8 -51.79 46.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 121.276 0.56 . . . . 0.0 110.952 -175.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.508 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 12.9 m-20 -76.64 -28.9 56.21 Favored 'General case' 0 C--O 1.217 -0.611 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.882 -175.833 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.577 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -59.38 -38.29 80.14 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 168.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 65.2 tttp -65.45 -47.42 76.2 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.748 0.785 . . . . 0.0 109.621 172.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.508 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 38.2 t30 -68.13 -52.38 35.5 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 114.319 -1.31 . . . . 0.0 112.202 -172.076 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 1.065 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 3.8 pp -60.67 -37.05 80.27 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 -176.166 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.726 HD23 HG21 ' A' ' 925' ' ' VAL . 0.3 OUTLIER -68.17 -46.38 70.9 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 117.521 -1.672 . . . . 0.0 109.638 176.077 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . . . . . . . . . 19.1 t70 -49.66 -39.15 35.28 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 122.238 1.018 . . . . 0.0 110.299 176.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.516 HG13 ' HG3' ' A' ' 983' ' ' GLU . 19.0 t -58.35 -45.25 89.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 113.665 -1.607 . . . . 0.0 112.38 175.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.642 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 2.0 mp -78.32 -31.59 16.23 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 CA-C-N 118.599 0.636 . . . . 0.0 110.722 177.504 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.621 ' HB3' ' HB ' ' A' ' 919' ' ' ILE . 27.0 m-20 -58.42 -40.58 82.9 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-O 120.945 0.403 . . . . 0.0 110.377 172.289 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -76.12 -37.94 57.48 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.642 0.258 . . . . 0.0 110.689 172.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.642 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -54.48 -46.36 73.37 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.908 -179.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.624 ' HG2' ' O ' ' A' 1039 ' ' ILE . 11.5 ptm180 -71.97 -42.53 66.41 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.205 -176.662 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.688 HD12 HG22 ' A' ' 919' ' ' ILE . 3.3 tt -61.07 -39.14 88.75 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 177.402 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.592 ' HD2' ' HG2' ' A' 1046 ' ' MET . 2.7 tmmm? -60.87 -32.74 72.17 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.855 -179.449 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.754 ' SD ' ' HB2' ' A' ' 979' ' ' SER . 35.5 mmm -94.79 -26.75 16.1 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 113.588 0.958 . . . . 0.0 113.588 -176.686 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.468 HG12 ' O ' ' A' 1043 ' ' ARG . 43.8 mm -83.31 -43.56 18.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.137 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . 0.487 ' C ' ' H ' ' A' 1050 ' ' SER . 21.6 t -75.83 -56.9 4.23 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 175.564 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 44.8 tt0 68.49 -29.21 0.16 Allowed 'General case' 0 N--CA 1.471 0.622 0 O-C-N 123.525 0.516 . . . . 0.0 112.1 177.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . 0.487 ' H ' ' C ' ' A' 1048 ' ' SER . 31.5 t -68.05 100.77 1.03 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 170.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . . . . . . . . . 20.5 ttp180 63.13 85.17 0.17 Allowed Pre-proline 0 C--N 1.33 -0.241 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 -174.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -79.64 156.02 24.41 Favored 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 122.957 2.438 . . . . 0.0 113.98 -170.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . 0.565 ' HB2' ' HB2' ' A' 1045 ' ' LYS . 86.5 m-70 . . . . . 0 C--N 1.327 -0.374 0 CA-C-N 115.081 -0.963 . . . . 0.0 109.032 173.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.756 0 N-CA-C 111.856 -0.498 . . . . 0.0 111.856 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 909' ' ' SER . . . . . 0.757 ' HB2' ' HD3' ' A' ' 910' ' ' PRO . 19.8 m -77.3 -54.86 1.42 Allowed Pre-proline 0 CA--C 1.538 0.495 0 CA-C-N 116.809 0.305 . . . . 0.0 111.111 178.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 910' ' ' PRO . . . . . 0.757 ' HD3' ' HB2' ' A' ' 909' ' ' SER . 3.2 Cg_endo -86.13 99.15 0.58 Allowed 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 122.304 2.003 . . . . 0.0 111.375 174.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -105.67 -42.53 1.69 Allowed Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.054 -179.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 45.9 mm -120.31 -45.84 2.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.075 0.464 . . . . 0.0 109.958 177.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 5.4 p -75.78 110.37 10.15 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.872 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 115.08 -168.2 12.51 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.003 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 130.81 -3.69 5.7 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.184 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . 136.15 67.57 0.06 OUTLIER Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 111.451 -0.66 . . . . 0.0 111.451 -176.459 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . 116.3 -65.88 0.31 Allowed Glycine 0 N--CA 1.449 -0.451 0 N-CA-C 111.432 -0.667 . . . . 0.0 111.432 -175.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . 0.855 ' H ' HD13 ' A' 1044 ' ' LEU . . . 83.49 128.1 1.38 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 121.083 -0.579 . . . . 0.0 112.449 178.077 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 919' ' ' ILE . . . . . 0.533 ' HB ' ' N ' ' A' 1041 ' ' GLN . 0.0 OUTLIER -56.13 153.19 1.94 Allowed 'Isoleucine or valine' 0 N--CA 1.424 -1.734 0 CA-C-O 121.378 0.609 . . . . 0.0 112.029 176.645 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.594 ' H ' ' HB3' ' A' 1040 ' ' ASP . 5.3 tmm_? 83.43 90.56 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 113.717 -1.583 . . . . 0.0 108.428 -176.518 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 1.7 m -117.76 29.79 7.63 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.923 -1.035 . . . . 0.0 111.323 -173.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 7.6 t30 63.42 87.5 0.11 Allowed 'General case' 0 N--CA 1.469 0.524 0 O-C-N 123.468 0.48 . . . . 0.0 109.868 -178.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.511 ' HB3' HG22 ' A' ' 925' ' ' VAL . 2.2 t70 -131.95 138.74 48.45 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 115.338 1.607 . . . . 0.0 115.338 -166.14 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -55.2 -30.74 60.54 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 112.724 -2.035 . . . . 0.0 112.553 173.183 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.511 HG22 ' HB3' ' A' ' 923' ' ' ASP . 28.6 m -55.19 -41.41 60.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-N 117.959 0.345 . . . . 0.0 111.312 -179.695 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.493 ' HA ' ' HB ' ' A' ' 929' ' ' VAL . 0.2 OUTLIER -79.26 -20.25 48.57 Favored 'General case' 0 CA--C 1.504 -0.801 0 O-C-N 122.105 -0.372 . . . . 0.0 111.003 179.583 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.73 -24.07 45.08 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 118.09 -1.444 . . . . 0.0 112.541 171.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -70.9 -26.78 63.37 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 167.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.553 HG21 HD23 ' A' 1036 ' ' LEU . 53.7 t -74.99 -32.22 26.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 114.223 -1.353 . . . . 0.0 110.419 174.67 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.499 ' O ' ' HB2' ' A' ' 934' ' ' LYS . 9.7 m -59.82 -42.99 94.75 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 119.032 0.833 . . . . 0.0 108.986 170.584 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -69.58 -52.46 20.85 Favored Glycine 0 CA--C 1.528 0.86 0 CA-C-N 115.242 -0.89 . . . . 0.0 113.557 178.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.55 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.9 pp -65.73 -49.39 68.61 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -176.097 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.546 HG22 ' HA ' ' A' 1029 ' ' ALA . 54.0 t -66.86 -40.85 86.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-O 120.872 0.368 . . . . 0.0 111.186 -173.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.654 ' O ' ' HG2' ' A' ' 938' ' ' GLU . 0.1 OUTLIER -58.3 -47.08 84.81 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.206 179.984 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -57.13 -43.19 82.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.19 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.828 HG22 ' HB1' ' A' 1025 ' ' ALA . 70.9 t -43.53 -68.32 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.892 177.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 13.7 pt -71.11 -49.69 47.18 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 N-CA-C 112.802 0.668 . . . . 0.0 112.802 -176.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.841 ' O ' ' HB3' ' A' ' 942' ' ' LYS . 11.6 pt-20 -73.06 -34.93 66.57 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 119.779 -0.768 . . . . 0.0 111.295 -169.142 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.599 ' HA ' HG22 ' A' ' 943' ' ' ILE . 62.5 mtt -74.33 -36.74 63.68 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 118.388 -1.325 . . . . 0.0 109.356 177.537 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.668 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 44.8 t -49.43 -54.73 16.03 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 114.609 -1.178 . . . . 0.0 113.082 -168.522 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 23.5 m -125.23 -18.26 5.44 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.608 -173.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.841 ' HB3' ' O ' ' A' ' 938' ' ' GLU . 1.5 tttp -83.45 -63.18 1.4 Allowed 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 119.83 -0.748 . . . . 0.0 110.644 -179.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.841 HG23 ' HG2' ' A' ' 950' ' ' GLU . 4.9 tp -74.76 -14.21 15.74 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 -172.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.473 ' HA ' ' HD3' ' A' ' 945' ' ' PRO . 5.8 tp60 -55.74 106.95 0.74 Allowed Pre-proline 0 N--CA 1.469 0.501 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 173.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.497 ' HB2' ' HD2' ' A' ' 947' ' ' PRO . 73.7 Cg_endo -99.34 -159.4 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.098 0 C-N-CA 123.614 2.876 . . . . 0.0 112.861 -174.571 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.697 ' HB3' ' HD3' ' A' ' 947' ' ' PRO . . . -69.74 -50.32 18.32 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.616 174.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.697 ' HD3' ' HB3' ' A' ' 946' ' ' ALA . 17.3 Cg_exo -68.74 107.73 1.73 Allowed 'Trans proline' 0 C--N 1.361 1.19 0 C-N-CA 121.833 1.689 . . . . 0.0 110.129 167.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.458 ' HB2' HG11 ' A' 1009 ' ' VAL . 9.1 Cg_exo -70.35 -176.29 1.6 Allowed 'Trans proline' 0 N--CA 1.464 -0.245 0 C-N-CA 122.993 2.462 . . . . 0.0 114.388 -168.395 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.633 ' HB3' ' CB ' ' A' 1006 ' ' GLN . 7.5 pt-20 42.36 89.73 0.01 OUTLIER 'General case' 0 CA--C 1.507 -0.709 0 CA-C-N 113.674 -1.603 . . . . 0.0 114.832 -174.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.841 ' HG2' HG23 ' A' ' 943' ' ' ILE . 0.1 OUTLIER -92.3 16.49 11.5 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 150.775 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.576 ' HB3' ' CG ' ' A' 1002 ' ' MET . 0.3 OUTLIER -72.21 -62.79 1.31 Allowed 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.989 -173.77 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 0.659 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 59.0 t -53.7 -48.23 94.02 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.867 170.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 0.659 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 81.7 Cg_exo -53.07 -34.16 66.72 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 121.917 1.744 . . . . 0.0 112.499 172.547 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.531 ' HA ' ' HB2' ' A' ' 957' ' ' GLU . 6.9 tpt -76.19 -31.43 58.46 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.065 177.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.513 HG22 ' HE3' ' A' 1002 ' ' MET . 75.4 t -53.39 -44.05 53.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 173.666 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 6.1 tmtt? -67.81 -34.01 75.91 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.828 -1.078 . . . . 0.0 112.055 175.009 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . 0.531 ' HB2' ' HA ' ' A' ' 954' ' ' MET . 25.3 mm-40 -77.63 -46.87 20.76 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -175.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.504 HG12 ' O ' ' A' ' 954' ' ' MET . 12.0 p -80.17 -31.86 13.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -59.35 -40.1 95.58 Favored Glycine 0 N--CA 1.444 -0.767 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 175.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . 0.543 HD12 ' HD3' ' A' ' 963' ' ' ARG . 23.7 tp -67.1 -33.6 75.83 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.66 -0.27 . . . . 0.0 111.112 176.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -80.38 -59.33 2.74 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.829 0.347 . . . . 0.0 110.696 -176.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.98 HD13 HD22 ' A' ' 995' ' ' LEU . 3.3 pp -50.76 -35.27 30.8 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.547 -0.751 . . . . 0.0 112.512 172.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.543 ' HD3' HD12 ' A' ' 960' ' ' LEU . 12.2 ptm180 -71.67 -38.77 70.6 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 119.958 1.254 . . . . 0.0 110.825 174.24 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 41.7 m -62.89 -34.42 77.35 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 176.188 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.891 HD23 HD22 ' A' ' 991' ' ' LEU . 26.3 tp -66.84 -45.31 78.65 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 114.845 -1.071 . . . . 0.0 111.021 176.044 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.632 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 10.4 tt -66.98 -36.14 81.53 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 -176.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 971' ' ' GLU . . . -72.66 -34.44 67.25 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 115.168 -0.923 . . . . 0.0 112.15 178.336 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 1.9 p -67.71 -37.63 82.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 119.031 0.832 . . . . 0.0 109.9 174.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.612 HG12 HG23 ' A' ' 984' ' ' ILE . 84.6 t -69.29 -40.6 80.43 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.535 172.518 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.59 ' HB2' HE22 ' A' ' 988' ' ' GLN . 18.9 t70 -68.17 -39.67 82.51 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.876 0.846 . . . . 0.0 109.216 -178.26 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.587 ' O ' HG23 ' A' ' 975' ' ' VAL . 6.8 tp10 -61.78 -36.56 81.44 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.553 -1.203 . . . . 0.0 109.135 176.082 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.446 ' HB2' ' O ' ' A' ' 969' ' ' VAL . 71.5 m -65.66 -19.56 65.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.361 176.23 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.662 ' HA ' HD13 ' A' ' 984' ' ' ILE . 51.7 tp -66.75 -52.31 34.29 Favored Pre-proline 0 CA--C 1.53 0.187 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.539 -174.145 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.625 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 95.7 Cg_endo -85.37 2.65 7.67 Favored 'Trans proline' 0 C--N 1.352 0.758 0 C-N-CA 121.055 1.17 . . . . 0.0 112.996 172.148 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.587 HG23 ' O ' ' A' ' 971' ' ' GLU . 33.8 t -71.33 -50.81 38.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 166.564 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.583 ' HG ' HG12 ' A' ' 975' ' ' VAL . 96.8 mt -126.1 82.44 65.09 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.924 177.495 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -83.0 27.27 0.61 Allowed 'Trans proline' 0 N--CA 1.462 -0.372 0 C-N-CA 123.706 2.938 . . . . 0.0 112.864 -174.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . -131.42 101.16 5.41 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.375 0.131 . . . . 0.0 111.03 -178.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.666 ' HB2' ' SD ' ' A' 1046 ' ' MET . 55.5 m 68.92 -47.68 0.57 Allowed 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.294 1.038 . . . . 0.0 112.843 175.066 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.523 HG23 ' HB1' ' A' 1042 ' ' ALA . 65.4 m -56.0 -25.69 45.3 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 169.554 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -55.19 -35.87 65.3 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 113.772 -1.558 . . . . 0.0 111.264 176.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . 0.517 ' HA ' ' HG2' ' A' ' 985' ' ' GLU . 1.5 ptp180 -82.99 -19.79 36.36 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.408 -0.517 . . . . 0.0 111.124 -178.276 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.533 ' HG3' HG13 ' A' 1038 ' ' VAL . 1.2 mp0 -77.17 -33.64 56.5 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 119.69 -0.804 . . . . 0.0 109.126 171.178 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.755 ' HA ' HD11 ' A' 1039 ' ' ILE . 67.9 mt -71.87 -34.78 52.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 CA-C-N 114.952 -1.022 . . . . 0.0 109.909 179.34 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . 0.517 ' HG2' ' HA ' ' A' ' 982' ' ' ARG . 10.7 pt-20 -70.21 -44.96 67.56 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.697 0.76 . . . . 0.0 109.563 -179.252 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . 0.551 ' HA ' ' HD3' ' A' ' 989' ' ' LYS . 66.3 mtt -73.63 -42.92 60.79 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 114.786 -1.097 . . . . 0.0 111.715 -172.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.843 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -68.24 -51.37 46.03 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.809 -173.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.632 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 3.5 pt20 -61.44 -24.32 66.47 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 120.497 -0.481 . . . . 0.0 110.754 177.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . 0.655 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 0.0 OUTLIER -76.12 -38.86 56.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.011 0.434 . . . . 0.0 111.181 173.842 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 12.3 tp -53.24 -59.74 4.18 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.692 -0.686 . . . . 0.0 112.107 178.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.891 HD22 HD23 ' A' ' 965' ' ' LEU . 9.9 tp -57.82 -38.5 75.72 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-O 121.529 0.68 . . . . 0.0 109.711 177.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . 0.655 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 42.4 t-20 -49.34 -51.32 35.26 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 113.895 -1.502 . . . . 0.0 111.549 -176.396 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . 0.456 ' O ' ' HG2' ' A' ' 997' ' ' GLU . 28.7 t -78.17 -31.53 49.68 Favored 'General case' 0 C--N 1.319 -0.717 0 C-N-CA 120.163 -0.615 . . . . 0.0 111.969 179.267 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . 0.4 ' O ' ' HB2' ' A' ' 997' ' ' GLU . 0.1 OUTLIER -71.32 -34.6 70.72 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 119.146 -1.021 . . . . 0.0 111.76 -179.925 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 0.98 HD22 HD13 ' A' ' 962' ' ' LEU . 3.0 pp -71.71 -16.95 62.25 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 171.22 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -78.59 -27.0 45.58 Favored 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 119.981 -0.688 . . . . 0.0 109.898 167.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.456 ' HG2' ' O ' ' A' ' 993' ' ' SER . 5.0 mm-40 -72.15 -45.29 61.09 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 173.012 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.882 HD13 ' HB2' ' A' 1025 ' ' ALA . 0.1 OUTLIER -56.17 -48.03 77.12 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.941 -176.074 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.585 ' O ' ' HB2' ' A' 1003 ' ' LYS . 91.6 mt -66.75 -40.59 86.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.265 -175.329 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 16.7 m-80 -62.04 -40.15 94.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.344 0.592 . . . . 0.0 111.709 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.866 ' HD3' ' HG2' ' A' 1020 ' ' GLN . 86.6 mttt -79.84 -40.84 27.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 122.097 0.951 . . . . 0.0 109.288 -175.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.576 ' CG ' ' HB3' ' A' ' 951' ' ' TYR . 22.5 ttp -61.06 -26.38 67.6 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.232 -1.349 . . . . 0.0 109.637 175.18 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.585 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 11.5 tptp -74.12 -54.96 6.69 Favored 'General case' 0 N--CA 1.438 -1.037 0 CA-C-N 114.894 -1.048 . . . . 0.0 111.551 -171.43 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.73 ' HA ' ' HB2' ' A' 1007 ' ' GLN . 7.6 mp -68.05 -13.73 62.43 Favored 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 120.305 -0.558 . . . . 0.0 110.73 179.389 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.885 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -69.86 -42.2 73.84 Favored 'General case' 0 C--O 1.213 -0.841 0 C-N-CA 119.768 -0.773 . . . . 0.0 109.326 176.075 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.954 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -77.35 -34.57 55.09 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 119.063 -0.494 . . . . 0.0 111.754 171.224 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.73 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 14.7 mm100 -46.14 -49.01 17.26 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.399 0.618 . . . . 0.0 110.637 175.107 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.553 ' HB2' HD22 ' A' 1013 ' ' LEU . 60.0 m-85 -126.99 46.28 2.54 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.602 0.715 . . . . 0.0 110.584 172.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 1.11 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 10.7 p -54.05 -18.53 2.45 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.352 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.219 170.255 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 84.5 mtp -49.32 -38.17 26.82 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 113.796 -1.547 . . . . 0.0 111.731 174.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . 0.419 ' O ' ' HB3' ' A' 1014 ' ' GLN . 0.0 OUTLIER -162.55 -102.82 0.02 OUTLIER 'General case' 0 C--O 1.245 0.862 0 N-CA-C 114.976 1.473 . . . . 0.0 114.976 179.729 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 19.7 m -57.7 -60.52 3.56 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.906 -164.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.713 ' HG ' ' CE2' ' A' 1017 ' ' TYR . 3.1 mp -45.85 -43.09 13.21 Favored 'General case' 0 CA--C 1.506 -0.734 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 177.08 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 1.11 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.99 -50.21 69.57 Favored 'General case' 0 N--CA 1.443 -0.822 0 O-C-N 123.752 0.658 . . . . 0.0 111.879 -168.972 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.687 ' O ' ' HB3' ' A' 1019 ' ' LYS . 12.8 mm100 -70.26 -41.62 73.25 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.433 -174.383 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . 0.476 ' O ' ' HD3' ' A' 1019 ' ' LYS . 30.2 tt0 -69.3 -55.04 11.65 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.338 0.59 . . . . 0.0 110.833 178.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.885 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 9.9 m-85 -60.08 -38.8 83.98 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -176.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.601 ' HA ' ' HB3' ' A' 1021 ' ' MET . 23.5 tptm -81.21 -30.45 34.26 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.539 -178.406 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . 0.687 ' HB3' ' O ' ' A' 1015 ' ' GLN . 0.1 OUTLIER -73.34 -39.04 65.53 Favored 'General case' 0 C--O 1.222 -0.36 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 175.17 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . 0.866 ' HG2' ' HD3' ' A' 1001 ' ' LYS . 10.3 tt0 -63.66 -32.41 73.88 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.424 165.24 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.601 ' HB3' ' HA ' ' A' 1018 ' ' LYS . 2.0 tmt? -64.25 -51.12 65.19 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 177.538 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . 0.555 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -81.82 -6.82 59.4 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 119.343 -0.943 . . . . 0.0 109.919 -175.005 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 62.8 m -87.33 -36.75 17.66 Favored 'General case' 0 C--O 1.223 -0.313 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 173.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.514 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -79.08 -22.72 44.88 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 172.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.882 ' HB2' HD13 ' A' ' 998' ' ' LEU . . . -86.14 -22.44 27.05 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.113 169.612 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.591 ' O ' HG23 ' A' 1030 ' ' VAL . 83.7 t60 -76.43 -25.0 53.99 Favored 'General case' 0 C--O 1.214 -0.792 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 165.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . 0.514 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -69.14 -41.09 77.77 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 123.783 0.833 . . . . 0.0 109.959 163.332 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.681 ' CD1' HD22 ' A' ' 998' ' ' LEU . 18.0 mt -60.44 -45.58 93.14 Favored 'General case' 0 C--N 1.314 -0.95 0 C-N-CA 119.933 -0.707 . . . . 0.0 109.259 170.072 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . 0.546 ' HA ' HG22 ' A' ' 933' ' ' VAL . . . -57.55 -42.91 83.93 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.41 0.148 . . . . 0.0 111.274 173.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' 1026 ' ' HIS . 12.3 t -67.4 -52.16 44.84 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 CA-C-O 121.652 0.739 . . . . 0.0 110.648 -177.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.503 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 38.8 m-20 -77.34 -29.39 53.44 Favored 'General case' 0 C--O 1.216 -0.681 0 CA-C-N 114.742 -1.117 . . . . 0.0 112.207 -174.51 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.945 ' HA ' HD22 ' A' 1035 ' ' LEU . . . -71.82 -29.9 64.92 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 170.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.418 ' O ' ' HG ' ' A' 1036 ' ' LEU . 87.9 tttt -65.68 -49.36 68.86 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.823 0.821 . . . . 0.0 109.18 168.304 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.503 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 10.6 t30 -68.74 -44.3 74.08 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 114.383 -1.28 . . . . 0.0 112.8 -174.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.945 HD22 ' HA ' ' A' 1032 ' ' ALA . 0.2 OUTLIER -64.52 -37.63 88.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 118.039 0.382 . . . . 0.0 110.099 -176.75 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.553 HD23 HG21 ' A' ' 929' ' ' VAL . 4.0 pp -72.03 -41.57 67.37 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 117.25 -1.78 . . . . 0.0 108.888 178.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.495 ' HB3' ' O ' ' A' 1034 ' ' ASN . 7.6 t70 -49.85 -46.23 51.18 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 114.272 -1.331 . . . . 0.0 110.117 172.479 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.533 HG13 ' HG3' ' A' ' 983' ' ' GLU . 15.5 t -54.51 -47.28 71.42 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.643 0 CA-C-N 114.004 -1.453 . . . . 0.0 111.822 174.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.755 HD11 ' HA ' ' A' ' 984' ' ' ILE . 1.4 mp -77.77 -35.68 21.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 118.775 0.716 . . . . 0.0 112.076 179.338 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.777 ' HA ' ' HE ' ' A' 1043 ' ' ARG . 1.9 m-20 -59.23 -45.9 89.92 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-O 120.73 0.3 . . . . 0.0 110.832 173.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.533 ' N ' ' HB ' ' A' ' 919' ' ' ILE . 0.0 OUTLIER -77.73 -26.33 49.91 Favored 'General case' 0 N--CA 1.432 -1.353 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 176.294 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.664 ' HA ' ' CD2' ' A' 1053 ' ' HIS . . . -54.29 -48.45 71.24 Favored 'General case' 0 CA--C 1.505 -0.773 0 C-N-CA 122.997 0.519 . . . . 0.0 111.804 175.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.777 ' HE ' ' HA ' ' A' 1040 ' ' ASP . 3.2 ptt180 -70.61 -40.5 73.15 Favored 'General case' 0 N--CA 1.444 -0.774 0 C-N-CA 120.432 -0.507 . . . . 0.0 109.75 -177.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.855 HD13 ' H ' ' A' ' 918' ' ' GLY . 12.3 tp -57.21 -47.0 82.38 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.104 173.608 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.434 ' HB3' ' CD2' ' A' 1053 ' ' HIS . 1.1 tmtt? -71.81 -35.79 70.07 Favored 'General case' 0 N--CA 1.437 -1.114 0 C-N-CA 123.571 0.749 . . . . 0.0 109.636 -175.188 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.666 ' SD ' ' HB2' ' A' ' 979' ' ' SER . 1.2 tmm? -64.11 -36.02 82.67 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 120.173 -0.611 . . . . 0.0 111.027 175.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.453 HG12 ' O ' ' A' 1043 ' ' ARG . 49.0 mm -82.39 -43.39 19.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.522 0.201 . . . . 0.0 111.293 179.395 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 30.0 t -65.08 -30.11 71.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.388 -176.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . . . . . . . . . 49.7 mm-40 -81.48 -95.75 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.353 177.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 40.6 t 179.28 -56.53 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 -173.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . 0.808 ' HB2' ' HD3' ' A' 1052 ' ' PRO . 83.9 mtm180 -136.07 -64.04 0.02 OUTLIER Pre-proline 0 C--O 1.219 -0.511 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.896 -178.714 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . 0.808 ' HD3' ' HB2' ' A' 1051 ' ' ARG . 94.7 Cg_endo -88.48 138.11 3.74 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 121.765 1.643 . . . . 0.0 113.91 -172.458 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . 0.664 ' CD2' ' HA ' ' A' 1042 ' ' ALA . 3.2 t-80 . . . . . 0 C--N 1.325 -0.464 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 170.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.787 0 N-CA-C 111.663 -0.575 . . . . 0.0 111.663 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 11.0 p -132.88 150.13 74.81 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 116.76 0.28 . . . . 0.0 110.412 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -60.32 -43.05 36.95 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.441 2.094 . . . . 0.0 111.647 176.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . 93.88 92.22 1.6 Allowed Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.82 175.218 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 34.3 pt -129.5 141.12 47.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 175.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 14.7 m -101.22 -42.1 6.47 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.133 0.492 . . . . 0.0 109.933 179.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . -77.89 67.72 2.91 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.652 -0.703 . . . . 0.0 111.926 178.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . -83.0 88.61 1.49 Allowed Glycine 0 N--CA 1.444 -0.799 0 N-CA-C 111.603 -0.599 . . . . 0.0 111.603 178.402 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . -59.59 107.15 1.15 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 121.343 -0.456 . . . . 0.0 112.303 178.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . 166.33 -129.39 1.92 Allowed Glycine 0 N--CA 1.445 -0.731 0 N-CA-C 111.044 -0.822 . . . . 0.0 111.044 -178.278 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . -119.15 -65.01 0.29 Allowed Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 120.63 -0.795 . . . . 0.0 111.786 178.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 919' ' ' ILE . . . . . 0.811 HG21 ' HB2' ' A' 1044 ' ' LEU . 46.5 mm -108.09 30.93 1.02 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 CA-C-O 122.431 1.11 . . . . 0.0 109.635 -177.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 919' ' ' ILE . 8.0 mpt_? 77.66 54.22 0.03 OUTLIER 'General case' 0 C--O 1.234 0.253 0 CA-C-N 114.292 -1.322 . . . . 0.0 113.397 168.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 14.7 m -128.36 89.13 2.85 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.908 0.385 . . . . 0.0 110.248 169.062 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.588 ' O ' ' HB3' ' A' ' 926' ' ' TYR . 2.1 t-20 -84.85 -59.76 2.25 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 177.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.656 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 4.7 m-20 46.49 -174.42 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 116.594 2.072 . . . . 0.0 116.594 166.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.458 ' HA ' ' HG2' ' A' ' 927' ' ' GLU . 12.2 mmtp -57.36 -23.27 47.95 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 113.659 -1.609 . . . . 0.0 112.2 177.514 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.619 HG23 HD22 ' A' 1036 ' ' LEU . 33.9 m -62.22 -29.86 47.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 176.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.656 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -77.02 -32.95 57.42 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 118.854 -0.594 . . . . 0.0 111.651 176.535 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . 0.826 ' HA ' ' HB ' ' A' ' 930' ' ' THR . 4.1 pt-20 -75.64 -25.59 56.98 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.833 1.197 . . . . 0.0 111.268 176.808 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.589 ' OD1' ' HB ' ' A' ' 964' ' ' THR . 69.8 m-80 -75.63 -26.89 58.15 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 119.338 0.972 . . . . 0.0 110.582 173.013 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.728 HG22 ' HB1' ' A' 1032 ' ' ALA . 98.4 t -75.15 -30.1 22.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 167.189 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.826 ' HB ' ' HA ' ' A' ' 927' ' ' GLU . 0.9 OUTLIER -63.26 -42.85 99.2 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 169.907 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -72.56 -54.02 7.97 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 120.667 -0.778 . . . . 0.0 113.585 176.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.556 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 1.8 pp -62.33 -48.47 79.67 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -176.577 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 79.7 t -67.28 -39.89 83.82 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 CA-C-O 121.103 0.477 . . . . 0.0 110.913 -175.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.602 ' HB2' ' O ' ' A' ' 930' ' ' THR . 0.2 OUTLIER -62.07 -35.38 78.47 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.683 179.036 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -64.16 -42.18 96.86 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.832 176.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.746 HG22 ' HB1' ' A' 1025 ' ' ALA . 49.6 t -49.76 -85.01 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 C-N-CA 123.36 0.664 . . . . 0.0 112.218 -179.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.452 ' O ' ' HB2' ' A' ' 940' ' ' SER . 15.8 pt -61.61 -42.47 94.24 Favored 'Isoleucine or valine' 0 C--O 1.248 1.005 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -173.03 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.523 ' HB3' ' O ' ' A' ' 934' ' ' LYS . 23.9 tp10 -61.5 -53.2 59.61 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.271 -172.504 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.508 ' HA ' HG12 ' A' ' 943' ' ' ILE . 78.4 mtp -71.3 -26.55 62.91 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.36 -177.076 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.601 ' HA ' ' OE1' ' A' ' 949' ' ' GLU . 6.9 m -51.4 -49.73 61.01 Favored 'General case' 0 CA--C 1.514 -0.441 0 O-C-N 124.238 0.961 . . . . 0.0 112.122 -172.45 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 7.4 m -104.1 -30.73 10.05 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.215 -174.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.489 ' HG3' ' O ' ' A' ' 938' ' ' GLU . 0.0 OUTLIER -85.96 -46.7 10.3 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 118.622 -1.231 . . . . 0.0 112.111 -164.614 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.508 HG12 ' HA ' ' A' ' 939' ' ' MET . 32.6 mm -50.28 -39.31 16.53 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 -175.358 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.624 ' HG2' ' CA ' ' A' ' 949' ' ' GLU . 0.0 OUTLIER -139.29 110.26 7.62 Favored Pre-proline 0 C--N 1.321 -0.654 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 -169.434 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.421 ' HD2' ' HD2' ' A' ' 947' ' ' PRO . 21.9 Cg_endo -96.86 2.6 1.78 Allowed 'Trans proline' 0 N--CA 1.45 -1.051 0 C-N-CA 123.454 2.769 . . . . 0.0 111.669 169.172 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.55 ' H ' ' HD2' ' A' ' 947' ' ' PRO . . . -158.62 -53.48 0.01 OUTLIER Pre-proline 0 CA--C 1.536 0.417 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.83 -176.364 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.616 ' O ' ' HB2' ' A' ' 944' ' ' GLN . 86.7 Cg_endo -79.67 -177.47 3.87 Favored 'Trans proline' 0 C--N 1.359 1.1 0 C-N-CA 122.094 1.862 . . . . 0.0 111.476 177.165 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.746 ' HB3' ' HB2' ' A' 1006 ' ' GLN . 49.0 Cg_endo -70.83 160.21 50.12 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 121.986 1.791 . . . . 0.0 112.118 173.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.624 ' CA ' ' HG2' ' A' ' 944' ' ' GLN . 38.2 tt0 -69.19 -2.38 10.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.017 -178.203 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.482 ' HB3' ' HG2' ' A' ' 953' ' ' PRO . 49.2 mt-10 53.89 43.13 31.33 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 -163.387 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 1.119 ' HA ' ' HB3' ' A' ' 954' ' ' MET . 0.4 OUTLIER -75.64 -15.03 60.38 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.081 -0.648 . . . . 0.0 111.975 -167.785 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 0.698 ' HB ' ' HD3' ' A' ' 953' ' ' PRO . 56.8 t -64.42 -52.41 53.49 Favored Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 166.332 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 0.698 ' HD3' ' HB ' ' A' ' 952' ' ' VAL . 25.6 Cg_exo -50.01 -37.81 47.88 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 121.845 1.696 . . . . 0.0 112.474 162.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 1.119 ' HB3' ' HA ' ' A' ' 951' ' ' TYR . 3.6 tpt -64.96 -32.73 74.59 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 122.764 0.426 . . . . 0.0 110.825 174.359 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.624 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 87.9 t -53.75 -41.65 48.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 169.336 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.507 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 8.9 tmtt? -67.78 -32.04 72.35 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.482 176.071 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -78.0 -48.06 17.07 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.967 0.413 . . . . 0.0 111.597 -175.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.559 HG22 HD23 ' A' ' 962' ' ' LEU . 12.5 p -84.99 -35.52 10.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.279 -178.453 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -62.26 -41.25 99.73 Favored Glycine 0 N--CA 1.448 -0.546 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 179.182 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . 0.57 ' O ' ' HG3' ' A' ' 963' ' ' ARG . 24.9 tp -71.75 -31.2 66.41 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 110.667 -0.123 . . . . 0.0 110.667 178.039 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -73.7 -60.83 2.07 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.968 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 1.058 HD13 HD22 ' A' ' 995' ' ' LEU . 4.0 pp -50.64 -35.35 30.11 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 172.039 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.604 ' N ' HD12 ' A' ' 962' ' ' LEU . 0.0 OUTLIER -71.09 -36.21 72.11 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 120.173 1.351 . . . . 0.0 111.022 175.2 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . 0.589 ' HB ' ' OD1' ' A' ' 928' ' ' ASN . 17.6 m -71.56 -27.0 62.86 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.281 -0.567 . . . . 0.0 109.498 177.563 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.635 HD23 HD22 ' A' ' 991' ' ' LEU . 36.8 tp -65.65 -45.55 82.54 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-O 122.103 0.954 . . . . 0.0 109.566 169.303 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.717 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 9.2 tt -65.54 -37.25 86.19 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 114.484 -1.235 . . . . 0.0 108.664 -176.084 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . 0.585 ' O ' ' HB2' ' A' ' 971' ' ' GLU . . . -75.53 -29.47 59.44 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.492 179.277 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 1.1 p -72.03 -36.48 69.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 118.497 0.59 . . . . 0.0 110.029 174.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.702 HG12 HG23 ' A' ' 984' ' ' ILE . 96.9 t -72.43 -39.25 62.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.311 171.677 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.945 ' HB2' HE22 ' A' ' 988' ' ' GLN . 26.1 t70 -65.9 -38.15 87.98 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 122.19 0.995 . . . . 0.0 108.435 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.687 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 4.9 tp10 -63.56 -37.0 85.67 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.045 -1.434 . . . . 0.0 109.496 176.376 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.469 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 24.1 m -63.26 -17.97 63.07 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.559 175.596 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.765 ' HA ' HD13 ' A' ' 984' ' ' ILE . 8.4 tt -68.88 -52.62 16.73 Favored Pre-proline 0 CA--C 1.535 0.372 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.265 -177.199 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.736 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 1.8 Cg_endo -87.8 -14.3 3.65 Favored 'Trans proline' 0 C--N 1.358 1.036 0 C-N-CA 121.667 1.578 . . . . 0.0 113.676 174.409 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.498 HG23 ' O ' ' A' ' 971' ' ' GLU . 13.7 t -62.37 -44.75 99.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 173.035 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.456 HD21 ' HB3' ' A' 1043 ' ' ARG . 10.0 mp -80.44 152.94 73.6 Favored Pre-proline 0 C--N 1.323 -0.552 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 171.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_exo -39.19 -64.71 0.2 Allowed 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 123.517 2.811 . . . . 0.0 113.919 -175.237 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . 178.6 -34.24 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.251 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.261 -179.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.452 ' HB3' ' CE ' ' A' 1046 ' ' MET . 1.5 m -44.84 -49.74 10.66 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.292 -0.867 . . . . 0.0 113.181 -177.093 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.486 HG23 ' HB1' ' A' 1042 ' ' ALA . 16.1 m -73.33 -5.82 42.11 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -171.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -50.27 -36.26 30.62 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 -171.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . 0.534 ' HA ' ' HG2' ' A' ' 985' ' ' GLU . 7.0 ptp180 -83.2 -22.36 33.19 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 118.986 -1.085 . . . . 0.0 112.142 -168.74 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.515 ' OE2' HG13 ' A' 1038 ' ' VAL . 2.0 mt-10 -80.03 -35.74 36.81 Favored 'General case' 0 CA--C 1.501 -0.931 0 C-N-CA 119.39 -0.924 . . . . 0.0 109.734 171.095 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.765 HD13 ' HA ' ' A' ' 973' ' ' LEU . 48.7 mt -64.97 -37.44 80.25 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-N 114.795 -1.093 . . . . 0.0 108.927 178.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . 0.534 ' HG2' ' HA ' ' A' ' 982' ' ' ARG . 11.3 pt-20 -74.09 -38.52 63.85 Favored 'General case' 0 N--CA 1.44 -0.944 0 C-N-CA 118.317 -1.353 . . . . 0.0 110.362 -177.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . 0.654 ' O ' ' HB3' ' A' ' 989' ' ' LYS . 26.3 ttt -72.22 -37.28 69.24 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.889 -173.746 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.995 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -76.34 -49.74 16.08 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.878 -1.056 . . . . 0.0 111.879 -172.528 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.945 HE22 ' HB2' ' A' ' 970' ' ' ASP . 4.7 pt20 -59.73 -26.15 65.41 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.559 0.695 . . . . 0.0 109.629 173.378 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . 0.796 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 7.8 tmtm? -71.11 -39.73 71.9 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.586 -1.188 . . . . 0.0 111.287 172.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 18.2 tp -55.97 -58.36 8.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.569 176.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.635 HD22 HD23 ' A' ' 965' ' ' LEU . 13.0 tp -55.19 -36.07 65.5 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.557 0.694 . . . . 0.0 109.804 177.068 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . 0.796 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 25.4 t-20 -48.86 -52.04 26.43 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 113.751 -1.568 . . . . 0.0 112.119 -177.106 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 32.1 t -74.39 -35.83 63.49 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.33 -36.69 77.2 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 119.246 -0.982 . . . . 0.0 111.829 -178.358 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 1.058 HD22 HD13 ' A' ' 962' ' ' LEU . 3.2 pp -70.45 -23.47 62.72 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 122.808 0.443 . . . . 0.0 110.416 172.294 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -73.44 -28.1 61.78 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 119.527 -0.869 . . . . 0.0 109.978 170.318 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.766 ' O ' ' HG2' ' A' 1001 ' ' LYS . 17.0 mt-10 -75.25 -41.72 56.74 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 172.091 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.648 ' HB3' ' HA ' ' A' ' 995' ' ' LEU . 0.4 OUTLIER -54.78 -46.76 74.47 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.968 -175.611 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 995' ' ' LEU . 71.5 mt -66.84 -43.28 89.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.199 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 10.3 m-80 -58.5 -44.89 89.61 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.453 0.644 . . . . 0.0 112.34 -178.343 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.766 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 28.5 mmtp -74.7 -40.38 61.38 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 122.29 1.043 . . . . 0.0 108.381 -171.624 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.569 ' HG2' ' CG ' ' A' ' 951' ' ' TYR . 16.2 ttp -57.03 -43.89 82.36 Favored 'General case' 0 N--CA 1.428 -1.531 0 CA-C-N 113.894 -1.503 . . . . 0.0 108.419 176.841 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.494 ' HA ' ' CE1' ' A' ' 951' ' ' TYR . 1.5 tptm -64.0 -33.0 74.75 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 114.141 -1.391 . . . . 0.0 112.313 -168.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.801 HD13 ' HG3' ' A' 1007 ' ' GLN . 4.2 mm? -84.06 -14.87 49.39 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.007 -0.677 . . . . 0.0 110.948 177.273 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.64 ' HB1' ' HA ' ' A' 1014 ' ' GLN . . . -63.45 -50.81 68.26 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 119.391 -0.924 . . . . 0.0 110.55 -177.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 1.026 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 2.2 pp0? -76.99 -24.66 52.23 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 118.979 0.809 . . . . 0.0 110.936 177.328 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.801 ' HG3' HD13 ' A' 1004 ' ' LEU . 18.4 mm-40 -41.75 -40.08 1.91 Allowed 'General case' 0 C--N 1.344 0.336 0 CA-C-O 121.363 0.601 . . . . 0.0 109.795 169.737 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.921 ' HD2' HD22 ' A' 1013 ' ' LEU . 82.7 m-85 -132.1 45.1 2.81 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.631 166.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 1.032 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 7.3 p -49.48 -22.96 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 CA-C-O 121.251 0.548 . . . . 0.0 109.987 171.469 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 21.6 mmt -42.7 -45.83 4.86 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.938 174.043 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 15.9 m -162.23 -84.24 0.03 OUTLIER 'General case' 0 C--O 1.248 0.987 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 176.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . 0.454 ' O ' ' HG2' ' A' 1015 ' ' GLN . 15.6 m -55.27 -73.41 0.05 Allowed 'General case' 0 C--O 1.234 0.256 0 CA-C-N 114.807 -1.088 . . . . 0.0 112.844 -164.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.921 HD22 ' HD2' ' A' 1008 ' ' TYR . 8.7 mp -47.72 -42.85 26.22 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -177.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 1.032 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -55.8 -45.73 78.16 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.206 -0.598 . . . . 0.0 111.083 -169.403 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.46 ' O ' ' HD3' ' A' 1019 ' ' LYS . 11.0 pt20 -75.57 -41.04 55.76 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.153 -176.287 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -72.39 -56.33 5.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.328 0.585 . . . . 0.0 110.834 -178.184 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.695 ' CE2' ' HG ' ' A' 1013 ' ' LEU . 8.7 m-85 -58.03 -39.01 77.32 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.097 -0.956 . . . . 0.0 113.241 -178.12 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.572 ' HA ' ' CB ' ' A' 1021 ' ' MET . 8.4 ttpp -82.17 -24.59 34.91 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.844 -176.557 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . 0.46 ' HD3' ' O ' ' A' 1015 ' ' GLN . 4.0 mptp? -71.57 -46.12 60.28 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 171.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -56.19 -31.93 63.9 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 114.867 -1.061 . . . . 0.0 110.986 164.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.587 ' HG2' HD22 ' A' ' 998' ' ' LEU . 18.2 tmm? -69.21 -53.69 18.66 Favored 'General case' 0 CA--C 1.509 -0.611 0 O-C-N 122.16 -0.337 . . . . 0.0 110.793 176.076 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . 0.5 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.3 OUTLIER -80.29 -8.55 59.52 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 119.478 -0.889 . . . . 0.0 109.78 -171.229 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 85.3 m -88.83 -31.43 18.32 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.725 172.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.474 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -79.42 -24.73 42.32 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-O 121.419 0.628 . . . . 0.0 109.444 171.489 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.746 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -86.44 -24.74 25.55 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.222 170.59 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.563 ' O ' HG23 ' A' 1030 ' ' VAL . 47.0 t-80 -74.6 -26.73 60.1 Favored 'General case' 0 C--O 1.214 -0.765 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 164.533 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . 0.47 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -68.97 -40.72 78.67 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 123.664 0.785 . . . . 0.0 110.118 163.576 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.668 HD21 ' N ' ' A' ' 995' ' ' LEU . 22.6 mt -59.81 -44.69 93.86 Favored 'General case' 0 C--N 1.315 -0.898 0 C-N-CA 119.996 -0.682 . . . . 0.0 109.456 169.638 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -58.46 -43.25 88.8 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.755 0.312 . . . . 0.0 111.383 173.09 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.563 HG23 ' O ' ' A' 1026 ' ' HIS . 13.2 t -67.79 -50.55 59.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.168 0.509 . . . . 0.0 110.747 -177.113 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.6 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 47.0 m-20 -75.32 -28.93 59.85 Favored 'General case' 0 C--O 1.214 -0.804 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.551 -175.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.766 ' HA ' HD12 ' A' 1035 ' ' LEU . . . -64.35 -39.58 94.16 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 168.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.404 ' HE2' ' HB3' ' A' 1033 ' ' LYS . 13.4 ttpt -63.1 -43.94 97.07 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 122.092 0.948 . . . . 0.0 109.25 171.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.6 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 51.2 t30 -72.93 -52.56 14.15 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-N 113.975 -1.466 . . . . 0.0 112.465 -171.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.995 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 0.0 OUTLIER -64.32 -34.95 79.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 119.468 -0.301 . . . . 0.0 110.759 -173.284 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.678 ' N ' HD13 ' A' 1035 ' ' LEU . 4.6 pp -72.97 -36.47 67.11 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 116.88 -1.928 . . . . 0.0 109.673 177.252 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.541 ' HB3' ' O ' ' A' 1034 ' ' ASN . 20.5 t70 -55.24 -43.54 74.68 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 122.336 1.065 . . . . 0.0 110.087 172.637 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.547 ' HB ' ' O ' ' A' 1035 ' ' LEU . 15.2 t -51.95 -58.18 2.69 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.512 0 CA-C-N 113.302 -1.772 . . . . 0.0 111.019 172.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.763 HG12 HG12 ' A' ' 984' ' ' ILE . 2.5 mp -67.52 -23.87 30.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 118.188 0.449 . . . . 0.0 111.604 179.371 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.533 ' CG ' ' H ' ' A' ' 919' ' ' ILE . 1.5 t0 -62.3 -48.98 77.48 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-O 121.694 0.759 . . . . 0.0 110.285 171.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -72.58 -36.31 68.13 Favored 'General case' 0 C--N 1.31 -1.136 0 O-C-N 122.021 -0.424 . . . . 0.0 109.951 176.183 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.702 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -53.02 -48.93 67.18 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 123.462 0.705 . . . . 0.0 112.499 -179.544 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.652 ' O ' HG12 ' A' 1047 ' ' ILE . 9.7 ptp180 -61.07 -51.8 67.62 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.353 179.444 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.811 ' HB2' HG21 ' A' ' 919' ' ' ILE . 3.2 tm? -61.16 -40.08 92.51 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.213 0.53 . . . . 0.0 109.836 179.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.716 ' HE2' ' HB2' ' A' 1053 ' ' HIS . 47.5 mtpt -61.58 -42.67 99.19 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.404 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.452 ' CE ' ' HB3' ' A' ' 979' ' ' SER . 86.3 mmm -74.71 -27.48 60.4 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.538 -0.465 . . . . 0.0 112.102 176.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.652 HG12 ' O ' ' A' 1043 ' ' ARG . 28.8 mm -58.63 -48.34 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-O 121.079 0.466 . . . . 0.0 110.522 175.544 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 47.9 m -145.74 72.26 1.3 Allowed 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.124 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . 0.434 ' NE2' ' H ' ' A' 1053 ' ' HIS . 32.1 tt0 -71.22 127.9 34.13 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 122.211 1.005 . . . . 0.0 111.902 -176.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 70.0 p -133.22 8.65 4.02 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 113.567 -1.652 . . . . 0.0 107.307 171.05 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . 0.761 ' HB3' ' HD2' ' A' 1052 ' ' PRO . 52.1 mtp85 -133.01 178.89 1.55 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 113.865 -1.516 . . . . 0.0 109.083 -169.236 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . 0.761 ' HD2' ' HB3' ' A' 1051 ' ' ARG . 67.7 Cg_endo -78.08 112.1 3.19 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 121.035 1.157 . . . . 0.0 112.745 176.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . 0.716 ' HB2' ' HE2' ' A' 1045 ' ' LYS . 1.1 t-80 . . . . . 0 C--N 1.323 -0.544 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 172.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.748 0 N-CA-C 111.914 -0.475 . . . . 0.0 111.914 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 8.7 t -114.76 113.84 44.57 Favored Pre-proline 0 C--N 1.321 -0.653 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 178.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -77.73 17.3 0.98 Allowed 'Trans proline' 0 CA--C 1.528 0.222 0 C-N-CA 122.956 2.438 . . . . 0.0 112.742 -177.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . 96.81 -176.39 32.11 Favored Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.866 -0.683 . . . . 0.0 111.963 -179.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 22.4 pt -133.12 -175.0 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 179.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 23.1 t -123.93 116.46 22.93 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.051 0.453 . . . . 0.0 110.605 179.117 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . -135.59 155.69 22.36 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.989 179.305 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 155.95 149.51 5.36 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 121.04 -0.6 . . . . 0.0 112.102 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . 151.45 124.39 1.13 Allowed Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.073 -179.517 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . -151.61 159.2 28.14 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.458 178.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . 79.55 170.83 40.65 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 121.263 -0.494 . . . . 0.0 112.929 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 919' ' ' ILE . . . . . 0.66 ' HB ' ' HB3' ' A' 1040 ' ' ASP . 0.1 OUTLIER -80.32 143.75 11.87 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 174.189 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . . . . . . . . . 11.2 ttp180 179.86 -47.26 0.01 OUTLIER 'General case' 0 C--O 1.234 0.28 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -169.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 11.3 m -78.3 6.08 9.05 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 115.548 1.684 . . . . 0.0 115.548 -153.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -106.15 -74.98 0.64 Allowed 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 118.383 -1.327 . . . . 0.0 110.352 178.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.645 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 7.6 t70 75.45 -48.46 0.61 Allowed 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 168.348 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . . . . . . . . . 15.0 tptp -56.98 -31.3 64.91 Favored 'General case' 0 C--N 1.321 -0.646 0 O-C-N 121.583 -0.698 . . . . 0.0 111.779 -177.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.639 ' CG2' ' HB3' ' A' 1036 ' ' LEU . 1.5 p -61.11 -31.83 51.09 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 CA-C-O 121.295 0.569 . . . . 0.0 110.894 174.764 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.645 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -67.25 -36.64 82.04 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 123.591 0.756 . . . . 0.0 111.882 178.031 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -75.04 -23.41 58.13 Favored 'General case' 0 C--N 1.313 -1.001 0 C-N-CA 118.374 -1.33 . . . . 0.0 110.195 -179.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.44 ' O ' ' HB1' ' A' ' 961' ' ' ALA . 1.6 m120 -69.21 -31.11 69.48 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 173.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.586 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 46.6 t -81.13 -28.87 10.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 114.79 -1.095 . . . . 0.0 110.154 174.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . . . . . . . . . 22.3 m -55.61 -43.12 75.79 Favored 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 165.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -71.03 -53.13 11.26 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-N 115.318 -0.855 . . . . 0.0 114.087 178.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.586 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.4 pp -62.22 -47.92 82.29 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 117.513 0.657 . . . . 0.0 112.694 -176.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 75.9 t -65.32 -36.12 76.95 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 CA-C-O 121.083 0.468 . . . . 0.0 110.862 -176.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.525 ' HD2' ' C ' ' A' ' 934' ' ' LYS . 0.1 OUTLIER -55.35 -45.39 76.46 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.822 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . 0.4 ' HB3' HG12 ' A' ' 958' ' ' VAL . . . -63.26 -34.15 77.06 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.625 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.769 HG22 ' HB1' ' A' 1025 ' ' ALA . 59.0 t -54.03 -76.03 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 CA-C-O 121.11 0.481 . . . . 0.0 112.166 -179.391 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 21.0 pt -68.7 -38.63 79.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -175.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.503 ' O ' ' HD3' ' A' ' 942' ' ' LYS . 34.9 tt0 -66.45 -52.22 48.61 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.613 0.72 . . . . 0.0 110.288 -175.174 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.49 ' HA ' ' HB2' ' A' ' 942' ' ' LYS . 23.2 mmt -69.66 -24.35 63.6 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 119.596 -0.842 . . . . 0.0 109.231 -179.048 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.523 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 5.7 p -53.47 -38.45 63.61 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-O 121.187 0.518 . . . . 0.0 110.022 -175.642 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 11.2 m -94.81 -10.5 31.25 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.701 -178.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.503 ' HD3' ' O ' ' A' ' 938' ' ' GLU . 13.7 mptt -80.71 -1.48 42.81 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 177.091 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . . . . . . . . . 37.9 pt -42.05 -33.33 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 165.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.565 ' H ' ' HD2' ' A' ' 945' ' ' PRO . 0.0 OUTLIER -101.88 -54.46 0.14 Allowed Pre-proline 0 CA--C 1.54 0.566 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -171.837 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.565 ' HD2' ' H ' ' A' ' 944' ' ' GLN . 29.2 Cg_endo -62.22 -11.31 21.61 Favored 'Trans proline' 0 C--N 1.36 1.172 0 C-N-CA 122.182 1.922 . . . . 0.0 113.488 -174.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . . . . . . . . . . . -136.98 152.91 74.87 Favored Pre-proline 0 C--N 1.321 -0.667 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 177.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -58.51 162.89 11.53 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.345 2.03 . . . . 0.0 110.839 173.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.753 ' HB3' HG11 ' A' 1009 ' ' VAL . 33.7 Cg_exo -26.69 116.88 0.03 OUTLIER 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 124.666 3.578 . . . . 0.0 113.334 -178.182 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.481 ' C ' ' H ' ' A' ' 951' ' ' TYR . 10.1 mt-10 -54.6 -22.07 12.29 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.672 175.151 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.615 ' HB3' ' HG2' ' A' ' 953' ' ' PRO . 23.2 tt0 69.96 -0.35 2.77 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.659 179.165 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.597 ' O ' HG23 ' A' ' 955' ' ' VAL . 27.4 m-85 47.65 -52.09 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 116.222 1.934 . . . . 0.0 116.222 176.063 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 0.601 ' O ' ' HB ' ' A' ' 955' ' ' VAL . 43.2 t -49.76 -45.56 79.68 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 118.667 0.667 . . . . 0.0 112.041 174.601 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 0.619 ' O ' ' HB3' ' A' ' 956' ' ' LYS . 36.3 Cg_exo -50.01 -44.55 36.91 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 122.089 1.859 . . . . 0.0 112.899 174.162 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.561 ' HG2' ' O ' ' A' ' 951' ' ' TYR . 4.4 ptp -75.32 -29.75 60.12 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 178.158 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.601 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 99.2 t -54.67 -36.5 36.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.145 168.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.619 ' HB3' ' O ' ' A' ' 953' ' ' PRO . 23.2 ttpt -59.07 -43.44 91.77 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.886 171.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . 0.52 ' HG2' ' HA ' ' A' ' 954' ' ' MET . 14.6 pt-20 -79.63 -43.41 22.9 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 119.75 -0.78 . . . . 0.0 112.087 -178.133 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.534 HG22 ' HA ' ' A' ' 955' ' ' VAL . 16.7 m -76.52 -33.04 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-O 120.689 0.281 . . . . 0.0 110.904 -179.042 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -68.88 -35.77 80.23 Favored Glycine 0 N--CA 1.436 -1.33 0 N-CA-C 110.474 -1.05 . . . . 0.0 110.474 175.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . 0.607 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 16.5 tp -65.73 -38.33 88.86 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 172.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.44 ' HB1' ' O ' ' A' ' 928' ' ' ASN . . . -68.45 -58.46 4.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.647 -0.251 . . . . 0.0 110.757 -177.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.576 HD22 HD22 ' A' ' 995' ' ' LEU . 0.1 OUTLIER -43.54 -49.91 7.32 Favored 'General case' 0 C--O 1.215 -0.748 0 CA-C-O 118.596 -0.716 . . . . 0.0 112.698 167.591 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.607 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 6.4 ptp180 -68.43 -29.0 67.56 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 120.303 1.41 . . . . 0.0 110.805 -179.163 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . 0.408 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 43.7 m -68.24 -37.99 81.37 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 174.572 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.619 HD11 HD21 ' A' 1035 ' ' LEU . 0.0 OUTLIER -66.28 -40.01 89.79 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.17 174.423 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.43 ' HG ' HE21 ' A' ' 988' ' ' GLN . 10.4 tt -67.91 -41.45 82.64 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 114.727 -1.124 . . . . 0.0 108.307 -175.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . 0.579 ' O ' ' HB2' ' A' ' 971' ' ' GLU . . . -72.59 -38.77 67.75 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-N 114.966 -1.015 . . . . 0.0 112.021 -179.508 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 9.8 p -61.92 -40.98 97.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 118.657 0.662 . . . . 0.0 110.3 177.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.985 HG12 HG23 ' A' ' 984' ' ' ILE . 67.7 t -73.94 -38.54 49.99 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.712 174.493 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.892 ' HB2' HE22 ' A' ' 988' ' ' GLN . 12.1 t70 -67.75 -44.38 77.66 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.805 0.812 . . . . 0.0 109.585 -177.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.592 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 0.6 OUTLIER -63.83 -32.5 74.04 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 114.667 -1.152 . . . . 0.0 109.26 177.536 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.631 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 39.8 m -65.3 -18.02 64.98 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.53 175.397 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.753 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 9.7 tt -69.62 -52.65 13.77 Favored Pre-proline 0 CA--C 1.532 0.262 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.087 -179.171 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.753 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 3.0 Cg_exo -80.36 -2.12 11.77 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.627 1.551 . . . . 0.0 113.116 172.54 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.631 ' HB ' ' HA ' ' A' ' 972' ' ' SER . 15.0 t -83.38 -50.66 15.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 110.094 -0.336 . . . . 0.0 110.094 173.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . . . . . . . . . 97.4 mt -76.41 153.53 83.9 Favored Pre-proline 0 C--N 1.325 -0.476 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 176.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -36.05 -64.67 0.16 Allowed 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 123.962 3.108 . . . . 0.0 114.199 -174.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . 176.06 -29.84 0.0 OUTLIER 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 121.342 0.591 . . . . 0.0 110.115 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.419 ' HB2' ' HB3' ' A' 1046 ' ' MET . 0.8 OUTLIER -51.27 -50.07 59.97 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.955 -1.02 . . . . 0.0 113.351 -174.078 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.661 HG22 ' HG3' ' A' 1046 ' ' MET . 40.9 p -78.39 9.12 4.17 Favored 'General case' 0 C--N 1.33 -0.258 0 O-C-N 122.162 -0.336 . . . . 0.0 111.75 -171.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.714 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 0.3 OUTLIER -55.56 -34.34 64.65 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.345 -178.65 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . 0.457 HH11 ' HD3' ' A' ' 982' ' ' ARG . 9.5 ptp180 -84.48 -19.21 33.71 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.477 -178.479 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.733 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 0.5 OUTLIER -73.98 -38.85 64.04 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.088 -1.078 . . . . 0.0 108.088 172.586 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.985 HG23 HG12 ' A' ' 969' ' ' VAL . 65.6 mt -72.01 -29.51 33.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 114.225 -1.352 . . . . 0.0 109.206 179.387 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . 0.714 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 26.6 mt-10 -65.0 -51.63 60.63 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.402 0.62 . . . . 0.0 110.444 174.162 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 25.5 ttt -70.23 -43.28 70.95 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.311 -170.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.982 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -74.54 -50.85 16.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.066 -0.97 . . . . 0.0 112.827 -171.236 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.892 HE22 ' HB2' ' A' ' 970' ' ' ASP . 3.2 pt20 -65.29 -23.04 66.93 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 119.817 -0.753 . . . . 0.0 109.94 179.432 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . 0.772 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 6.8 tttp -74.31 -40.67 62.07 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.327 171.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.422 ' HB3' ' O ' ' A' ' 987' ' ' ALA . 27.5 tp -52.19 -59.79 3.97 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.208 178.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.648 ' HB2' ' CD2' ' A' 1035 ' ' LEU . 0.3 OUTLIER -66.04 -28.91 69.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.519 0.676 . . . . 0.0 109.789 179.059 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . 0.772 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 23.7 t-20 -52.05 -56.39 14.65 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.436 -1.257 . . . . 0.0 111.485 179.752 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 34.1 t -77.84 -33.99 52.07 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 111.776 0.288 . . . . 0.0 111.776 -178.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . 0.433 ' O ' ' HB3' ' A' ' 997' ' ' GLU . 0.6 OUTLIER -66.99 -36.34 81.95 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 120.176 -0.61 . . . . 0.0 112.354 -179.823 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 0.627 HD12 HD13 ' A' 1028 ' ' LEU . 8.4 tt -73.7 -17.45 61.13 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 173.041 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -75.29 -26.46 58.76 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 119.77 -0.772 . . . . 0.0 109.77 167.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.433 ' HB3' ' O ' ' A' ' 994' ' ' ASP . 3.8 tp10 -74.51 -40.63 61.67 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 173.14 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.95 HD13 ' HB2' ' A' 1025 ' ' ALA . 2.2 tp -55.91 -46.98 78.25 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.039 0.447 . . . . 0.0 110.747 178.058 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.78 ' HA ' ' SD ' ' A' 1002 ' ' MET . 80.1 mt -68.57 -38.5 79.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.881 -171.093 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -60.59 -46.86 88.65 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.442 0.639 . . . . 0.0 111.254 -177.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.531 ' O ' ' HB3' ' A' 1017 ' ' TYR . 89.7 mttt -84.62 -31.8 24.06 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.962 -173.165 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.78 ' SD ' ' HA ' ' A' ' 999' ' ' ILE . 13.1 ptm -64.29 -27.81 69.29 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 122.099 0.952 . . . . 0.0 108.512 173.47 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.616 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 9.4 tptp -67.26 -54.01 24.73 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 114.145 -1.389 . . . . 0.0 110.352 -171.255 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.634 ' HG ' ' NE2' ' A' 1007 ' ' GLN . 9.1 mp -71.14 -13.8 62.07 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.388 -178.68 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.655 ' HB1' ' NE2' ' A' 1014 ' ' GLN . . . -69.26 -55.15 11.37 Favored 'General case' 0 C--O 1.217 -0.638 0 C-N-CA 119.888 -0.725 . . . . 0.0 110.289 179.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.968 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 0.8 OUTLIER -63.88 -24.91 67.93 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 118.871 -0.585 . . . . 0.0 112.467 171.787 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.634 ' NE2' ' HG ' ' A' 1004 ' ' LEU . 19.3 mt-30 -51.98 -50.22 61.73 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.625 0.726 . . . . 0.0 110.07 175.528 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.738 ' HB2' ' HG ' ' A' 1013 ' ' LEU . 76.5 m-85 -124.99 49.74 1.83 Allowed 'General case' 0 N--CA 1.442 -0.835 0 CA-C-O 121.588 0.709 . . . . 0.0 109.617 172.361 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 1.052 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 9.3 p -55.41 -19.27 5.29 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.282 0 CA-C-N 114.157 -1.383 . . . . 0.0 109.678 170.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 65.0 mtt -40.01 -51.31 2.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.55 -1.204 . . . . 0.0 110.655 171.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 41.6 m -162.54 -75.66 0.05 OUTLIER 'General case' 0 C--O 1.239 0.52 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 175.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 13.1 p -55.93 -79.9 0.02 OUTLIER 'General case' 0 C--O 1.248 0.986 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -163.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.738 ' HG ' ' HB2' ' A' 1008 ' ' TYR . 13.0 mt -48.19 -42.62 30.39 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.453 -175.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 1.052 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.1 OUTLIER -52.66 -59.15 4.82 Favored 'General case' 0 N--CA 1.437 -1.113 0 O-C-N 123.989 0.806 . . . . 0.0 110.477 -165.73 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.514 ' O ' ' HD3' ' A' 1019 ' ' LYS . 27.7 mt-30 -65.92 -38.21 88.07 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.651 -169.201 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -70.03 -44.94 68.22 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.468 0.652 . . . . 0.0 110.574 178.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.628 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 13.4 m-85 -71.94 -30.76 65.65 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.758 -176.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.596 ' HD3' ' CZ ' ' A' ' 951' ' ' TYR . 23.4 tptm -78.86 -33.99 45.4 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 114.172 -1.376 . . . . 0.0 109.951 -176.001 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . 0.514 ' HD3' ' O ' ' A' 1015 ' ' GLN . 4.6 mptp? -71.1 -44.65 65.21 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 175.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -57.8 -33.01 68.12 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.72 165.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.548 ' HB3' ' HA ' ' A' 1018 ' ' LYS . 1.9 tmt? -65.85 -51.5 58.31 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 110.294 -0.262 . . . . 0.0 110.294 179.21 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . 0.542 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.0 OUTLIER -81.15 -9.69 59.76 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 119.423 -0.911 . . . . 0.0 109.869 -175.713 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 72.7 m -81.97 -41.11 21.22 Favored 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 173.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.503 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -78.51 -22.13 47.84 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-O 121.139 0.495 . . . . 0.0 109.843 174.733 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.95 ' HB2' HD13 ' A' ' 998' ' ' LEU . . . -85.57 -23.57 27.57 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.216 170.441 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.51 ' O ' HG23 ' A' 1030 ' ' VAL . 22.2 t-80 -76.04 -25.92 56.09 Favored 'General case' 0 C--O 1.214 -0.779 0 C-N-CA 120.164 -0.614 . . . . 0.0 109.422 164.154 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . 0.503 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -66.5 -40.15 89.07 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 162.552 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.627 HD13 HD12 ' A' ' 995' ' ' LEU . 16.6 mt -60.17 -49.16 78.73 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 170.629 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -57.11 -41.02 78.18 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 175.29 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.51 HG23 ' O ' ' A' 1026 ' ' HIS . 10.6 t -71.88 -51.55 30.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.44 0.638 . . . . 0.0 110.794 -176.17 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -77.11 -30.12 55.11 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.907 -174.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.516 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -70.7 -32.83 70.2 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 172.342 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 52.5 tttm -62.81 -45.69 91.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.768 0.794 . . . . 0.0 109.37 169.062 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.506 ' O ' ' HB3' ' A' 1037 ' ' ASP . 53.7 t30 -68.14 -50.32 55.35 Favored 'General case' 0 C--O 1.218 -0.595 0 CA-C-N 114.369 -1.287 . . . . 0.0 111.738 -176.408 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.982 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 1.9 pp -62.52 -40.84 98.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 119.084 -0.484 . . . . 0.0 111.047 -171.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.639 ' HB3' ' CG2' ' A' ' 925' ' ' VAL . 3.9 pp -66.26 -42.34 88.63 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 117.66 -1.616 . . . . 0.0 109.587 177.656 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.506 ' HB3' ' O ' ' A' 1034 ' ' ASN . 23.6 t70 -54.47 -38.36 66.29 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-N 113.982 -1.463 . . . . 0.0 110.128 175.663 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' 1034 ' ' ASN . 27.3 t -63.93 -36.5 76.95 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.614 0 CA-C-N 114.453 -1.249 . . . . 0.0 112.366 177.078 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.611 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 1.7 mp -86.56 -32.37 6.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 119.04 0.836 . . . . 0.0 111.094 177.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.66 ' HB3' ' HB ' ' A' ' 919' ' ' ILE . 4.0 m-20 -62.9 -41.27 99.38 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 169.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . . . . . . . . . 12.0 mt-30 -68.2 -39.25 82.5 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.056 170.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.733 ' HB2' ' HG2' ' A' ' 983' ' ' GLU . . . -55.41 -48.75 73.91 Favored 'General case' 0 CA--C 1.49 -1.339 0 C-N-CA 123.066 0.546 . . . . 0.0 110.782 -176.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.639 ' HD3' ' N ' ' A' 1044 ' ' LEU . 0.0 OUTLIER -65.01 -34.97 79.7 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.402 -174.08 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.639 ' N ' ' HD3' ' A' 1043 ' ' ARG . 3.1 tm? -78.04 -47.09 19.16 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 121.567 0.698 . . . . 0.0 110.123 179.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.53 ' O ' ' HB3' ' A' 1049 ' ' GLN . 31.1 ttpt -56.96 -46.48 82.11 Favored 'General case' 0 C--O 1.214 -0.79 0 C-N-CA 124.752 1.221 . . . . 0.0 111.09 178.764 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.661 ' HG3' HG22 ' A' ' 980' ' ' THR . 5.1 mmt -71.77 -24.17 61.71 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.151 -0.968 . . . . 0.0 111.407 -178.417 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.605 HG12 ' O ' ' A' 1043 ' ' ARG . 23.1 mm -67.35 -62.33 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.56 170.21 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 31.7 t -128.39 48.85 2.25 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 119.397 -0.921 . . . . 0.0 112.293 -175.559 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . 0.53 ' HB3' ' O ' ' A' 1045 ' ' LYS . 6.3 tp-100 -130.17 -71.58 0.59 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.331 -0.85 . . . . 0.0 108.75 166.012 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 78.8 p 53.8 12.29 0.4 Allowed 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 175.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . 0.64 ' HB3' ' HD3' ' A' 1052 ' ' PRO . 1.8 tmt_? -90.96 -61.62 0.21 Allowed Pre-proline 0 C--N 1.327 -0.392 0 O-C-N 122.222 -0.299 . . . . 0.0 110.99 -176.091 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . 0.64 ' HD3' ' HB3' ' A' 1051 ' ' ARG . 1.0 OUTLIER -83.29 23.95 0.78 Allowed 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 122.371 2.047 . . . . 0.0 112.982 -174.18 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . 0.53 ' HB2' ' HE1' ' A' 1046 ' ' MET . 13.6 m-70 . . . . . 0 C--N 1.32 -0.711 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.566 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.907 0 N-CA-C 112.09 -0.404 . . . . 0.0 112.09 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 16.4 p 50.56 92.08 0.06 OUTLIER Pre-proline 0 N--CA 1.47 0.573 0 C-N-CA 123.672 0.789 . . . . 0.0 112.692 178.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -75.22 48.71 2.12 Favored 'Trans proline' 0 CA--C 1.531 0.371 0 C-N-CA 123.502 2.802 . . . . 0.0 112.739 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -109.71 35.19 5.03 Favored Glycine 0 N--CA 1.448 -0.548 0 N-CA-C 111.562 -0.615 . . . . 0.0 111.562 178.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 56.9 mt -86.53 94.42 4.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.15 0.5 . . . . 0.0 110.685 -177.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 36.8 t -118.03 -71.24 0.75 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.602 -0.727 . . . . 0.0 109.079 175.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . -95.16 -40.31 4.31 Favored Glycine 0 N--CA 1.442 -0.943 0 N-CA-C 110.19 -1.164 . . . . 0.0 110.19 171.431 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 133.32 -119.46 2.35 Favored Glycine 0 N--CA 1.446 -0.666 0 N-CA-C 111.666 -0.574 . . . . 0.0 111.666 177.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . -141.11 84.63 0.21 Allowed Glycine 0 N--CA 1.446 -0.675 0 N-CA-C 111.266 -0.733 . . . . 0.0 111.266 177.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . -161.25 109.94 0.42 Allowed Glycine 0 N--CA 1.445 -0.732 0 C-N-CA 120.51 -0.853 . . . . 0.0 112.799 -177.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . . . . . . . . . . . 119.62 119.87 2.82 Favored Glycine 0 CA--C 1.517 0.211 0 C-N-CA 120.593 -0.813 . . . . 0.0 113.438 172.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 919' ' ' ILE . . . . . 0.716 HG22 ' HA ' ' A' 1041 ' ' GLN . 6.6 pt -68.07 142.13 16.78 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.955 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 175.691 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.566 ' HG3' ' NH1' ' A' 1043 ' ' ARG . 5.5 ptm180 -164.27 124.18 2.03 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.027 0.442 . . . . 0.0 111.956 -177.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . 0.409 ' HB3' ' OH ' ' A' ' 926' ' ' TYR . 9.9 t -116.35 -169.2 1.57 Allowed 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 171.466 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . 0.565 ' OD1' ' HE3' ' A' ' 924' ' ' LYS . 15.0 t-20 -77.58 -126.29 0.01 OUTLIER 'General case' 0 C--N 1.309 -1.162 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 176.245 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.841 ' HA ' ' CD1' ' A' ' 926' ' ' TYR . 4.1 p30 -149.06 2.98 0.59 Allowed 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 120.884 0.374 . . . . 0.0 111.251 174.069 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.565 ' HE3' ' OD1' ' A' ' 922' ' ' ASN . 16.4 mmtp -76.3 -44.68 35.88 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -174.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.627 HG23 HD22 ' A' 1036 ' ' LEU . 20.7 m -57.87 -29.12 34.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.709 0.766 . . . . 0.0 110.352 -179.73 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.841 ' CD1' ' HA ' ' A' ' 923' ' ' ASP . 14.3 m-85 -72.94 -39.78 65.93 Favored 'General case' 0 CA--C 1.483 -1.603 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.582 175.503 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . 0.506 ' HA ' ' OG1' ' A' ' 930' ' ' THR . 9.3 pt-20 -74.38 -22.29 59.26 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 117.749 -1.58 . . . . 0.0 109.982 -176.406 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -75.05 -32.04 61.43 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.038 -0.726 . . . . 0.0 109.038 172.095 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.672 HG22 ' HB1' ' A' 1032 ' ' ALA . 85.4 t -81.13 -29.79 11.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.244 175.536 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.506 ' OG1' ' HA ' ' A' ' 927' ' ' GLU . 66.5 p -68.82 -29.28 67.58 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 169.351 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -70.19 -53.26 14.6 Favored Glycine 0 CA--C 1.529 0.958 0 CA-C-N 115.113 -0.949 . . . . 0.0 113.14 172.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.661 HD21 HG22 ' A' ' 929' ' ' VAL . 2.6 pp -65.28 -49.32 70.0 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -178.453 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.426 HG22 ' HA ' ' A' 1029 ' ' ALA . 88.6 t -64.27 -41.18 91.58 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-O 121.069 0.461 . . . . 0.0 110.238 -176.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . . . . . . . . . 1.4 ttpt -54.73 -39.92 68.74 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.133 -0.939 . . . . 0.0 109.958 177.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -66.72 -39.95 88.21 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.613 0.227 . . . . 0.0 111.613 -178.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.751 HG22 ' HB1' ' A' 1025 ' ' ALA . 59.7 t -47.46 -68.32 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 O-C-N 123.81 0.694 . . . . 0.0 111.3 179.506 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 26.5 pt -65.45 -37.29 79.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.905 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -58.89 -56.55 20.81 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.57 0.7 . . . . 0.0 110.747 -172.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.558 ' HB3' ' OE2' ' A' ' 949' ' ' GLU . 13.3 mmt -76.52 -25.82 54.56 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.52 -0.763 . . . . 0.0 110.394 -177.076 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.546 ' HB3' ' O ' ' A' ' 936' ' ' VAL . 76.9 p -52.98 -41.55 64.69 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.447 0.642 . . . . 0.0 110.995 -169.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 8.7 p -104.44 -19.22 14.11 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 114.907 -1.042 . . . . 0.0 112.203 -177.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -82.73 -3.78 56.97 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 119.949 -0.7 . . . . 0.0 110.214 -177.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.572 HD13 ' HG2' ' A' 1018 ' ' LYS . 47.3 pt -50.69 -47.01 28.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.921 162.274 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.555 ' N ' HG13 ' A' ' 943' ' ' ILE . 3.7 pt20 50.51 170.66 0.03 OUTLIER Pre-proline 0 N--CA 1.475 0.778 0 C-N-CA 125.095 1.358 . . . . 0.0 113.232 177.19 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -67.84 86.82 0.37 Allowed 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 121.953 1.768 . . . . 0.0 110.747 168.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.612 ' HB1' ' HD2' ' A' ' 947' ' ' PRO . . . -162.03 179.1 1.36 Allowed Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.652 -175.258 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.612 ' HD2' ' HB1' ' A' ' 946' ' ' ALA . 54.3 Cg_exo -54.04 149.7 34.17 Favored 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 122.283 1.989 . . . . 0.0 111.883 172.616 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.598 ' HB3' HG11 ' A' 1009 ' ' VAL . 3.0 Cg_endo -47.52 135.79 20.86 Favored 'Trans proline' 0 CA--C 1.517 -0.364 0 C-N-CA 123.513 2.808 . . . . 0.0 113.948 -176.015 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.571 ' HB3' ' CD1' ' A' ' 951' ' ' TYR . 13.5 tt0 -58.72 -23.31 59.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.072 -0.967 . . . . 0.0 108.477 167.164 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.587 ' HB2' ' HG2' ' A' ' 953' ' ' PRO . 46.1 mt-10 74.59 -7.92 1.61 Allowed 'General case' 0 C--N 1.344 0.366 0 CA-C-N 114.368 -1.287 . . . . 0.0 109.592 -171.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.992 ' HB3' ' HG3' ' A' 1002 ' ' MET . 22.9 m-85 50.17 -53.4 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.063 1.745 . . . . 0.0 115.509 176.544 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 0.653 ' O ' ' HB ' ' A' ' 955' ' ' VAL . 61.4 t -43.87 -46.12 19.63 Favored Pre-proline 0 C--N 1.32 -0.709 0 C-N-CA 122.868 0.467 . . . . 0.0 111.65 172.297 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 0.635 ' HA ' ' HD3' ' A' ' 956' ' ' LYS . 14.1 Cg_exo -45.5 -51.07 8.47 Favored 'Trans proline' 0 CA--C 1.544 0.987 0 C-N-CA 122.434 2.089 . . . . 0.0 113.59 173.591 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.431 ' HE3' ' HB2' ' A' ' 939' ' ' MET . 6.8 ptm -69.56 -30.96 68.87 Favored 'General case' 0 N--CA 1.463 0.199 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 177.615 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.653 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 73.5 t -54.13 -36.68 32.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.778 171.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.635 ' HD3' ' HA ' ' A' ' 953' ' ' PRO . 2.4 mptp? -59.22 -41.63 89.09 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 119.097 -0.477 . . . . 0.0 111.371 171.179 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -77.54 -39.6 45.41 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 118.929 -1.108 . . . . 0.0 111.378 -177.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.649 HG22 ' HA ' ' A' ' 955' ' ' VAL . 24.3 m -73.97 -35.33 41.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 O-C-N 122.208 -0.308 . . . . 0.0 111.2 179.716 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -66.07 -34.96 89.87 Favored Glycine 0 N--CA 1.44 -1.082 0 N-CA-C 110.672 -0.971 . . . . 0.0 110.672 177.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . 0.545 ' HA ' ' HG2' ' A' ' 963' ' ' ARG . 9.4 tt -71.29 -33.11 69.43 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.127 -0.537 . . . . 0.0 109.803 176.007 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . 0.415 ' HB1' ' HB3' ' A' ' 932' ' ' LEU . . . -73.83 -37.8 64.74 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.513 -176.519 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.874 HD13 HD22 ' A' ' 991' ' ' LEU . 0.2 OUTLIER -66.5 -49.38 66.76 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-O 119.303 -0.38 . . . . 0.0 110.638 171.792 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.545 ' HG2' ' HA ' ' A' ' 960' ' ' LEU . 12.7 ptm180 -64.24 -30.29 71.35 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 118.856 0.753 . . . . 0.0 111.042 -177.416 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . 0.402 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 38.7 m -69.14 -33.89 74.15 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 176.641 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.466 ' CD1' ' HB ' ' A' ' 925' ' ' VAL . 31.9 tp -71.34 -39.87 71.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 122.053 0.93 . . . . 0.0 109.669 175.176 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.548 ' HG ' HE21 ' A' ' 988' ' ' GLN . 10.4 tt -63.18 -43.94 96.82 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 114.505 -1.225 . . . . 0.0 108.812 -177.251 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -70.19 -38.61 75.38 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 114.787 -1.097 . . . . 0.0 111.977 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . . . . . . . . . 3.2 p -65.46 -44.17 88.03 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.544 177.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.869 HG12 HG23 ' A' ' 984' ' ' ILE . 61.2 t -68.35 -36.41 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.246 175.134 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.848 ' HB2' HE22 ' A' ' 988' ' ' GLN . 8.1 t70 -69.38 -41.96 75.8 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 122.24 1.019 . . . . 0.0 109.031 -179.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.619 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 39.1 tt0 -73.24 -22.31 60.44 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 114.482 -1.236 . . . . 0.0 109.476 -179.324 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.699 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 58.7 m -72.9 -15.97 61.57 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.925 172.324 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.764 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 8.1 tt -64.08 -50.65 67.8 Favored Pre-proline 0 C--N 1.329 -0.302 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 175.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.764 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 13.2 Cg_exo -72.34 -11.85 27.01 Favored 'Trans proline' 0 C--N 1.355 0.916 0 C-N-CA 121.705 1.603 . . . . 0.0 113.396 169.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.699 ' HB ' ' HA ' ' A' ' 972' ' ' SER . 45.9 t -76.35 -52.1 18.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 O-C-N 122.034 -0.416 . . . . 0.0 110.269 174.112 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.823 HD13 ' HB3' ' A' 1043 ' ' ARG . 83.0 mt -97.7 107.18 38.28 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.814 178.396 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -70.82 -178.92 3.0 Favored 'Trans proline' 0 N--CA 1.463 -0.292 0 C-N-CA 122.533 2.155 . . . . 0.0 112.653 -175.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . 65.87 -149.83 0.23 Allowed 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.882 176.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.412 ' HA ' ' CD2' ' A' ' 981' ' ' HIS . 17.8 m -83.42 32.46 0.46 Allowed 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 -169.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.488 ' OG1' ' HG2' ' A' 1046 ' ' MET . 88.4 m -80.4 -20.06 44.85 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.104 0.478 . . . . 0.0 110.369 172.332 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.47 ' O ' ' HG3' ' A' ' 985' ' ' GLU . 14.1 p80 -50.36 -57.37 8.09 Favored 'General case' 0 C--O 1.219 -0.517 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 -176.118 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 5.5 ptp180 -56.23 -22.65 30.9 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 113.974 1.101 . . . . 0.0 113.974 -176.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.54 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 2.6 mp0 -77.08 -38.21 52.92 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 119.11 0.868 . . . . 0.0 109.97 174.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.869 HG23 HG12 ' A' ' 969' ' ' VAL . 32.7 mt -71.11 -30.68 41.91 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.935 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.096 177.408 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 981' ' ' HIS . 42.7 mt-10 -66.88 -51.77 51.45 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.437 177.511 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . 0.414 ' O ' ' HB3' ' A' ' 989' ' ' LYS . 68.5 mtt -70.79 -42.08 70.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 114.64 -1.163 . . . . 0.0 111.468 -175.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 1.053 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -69.4 -51.64 34.61 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.457 -0.792 . . . . 0.0 112.225 -170.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.848 HE22 ' HB2' ' A' ' 970' ' ' ASP . 3.7 pt20 -62.87 -21.82 66.26 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.375 177.661 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . 0.765 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 12.0 ttmt -70.29 -42.36 72.14 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.565 171.34 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . . . . . . . . . 2.6 mp -55.35 -53.9 50.42 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.874 HD22 HD13 ' A' ' 962' ' ' LEU . 2.3 tt -67.88 -25.7 65.65 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 178.5 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . 0.765 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 25.3 t-20 -53.17 -56.74 14.0 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.29 178.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 3.8 p -79.14 -34.07 43.61 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -177.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.07 -41.99 97.13 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.335 -0.546 . . . . 0.0 111.407 178.301 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 0.63 ' N ' HD21 ' A' 1028 ' ' LEU . 2.3 tm? -64.03 -23.88 67.5 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 122.576 0.35 . . . . 0.0 110.184 173.16 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -70.91 -32.74 69.77 Favored 'General case' 0 C--N 1.313 -0.994 0 C-N-CA 119.274 -0.971 . . . . 0.0 110.835 169.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.518 ' O ' ' HG2' ' A' 1001 ' ' LYS . 74.1 mm-40 -76.29 -38.09 56.59 Favored 'General case' 0 CA--C 1.512 -0.505 0 O-C-N 121.858 -0.526 . . . . 0.0 110.1 177.279 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.636 HD21 ' SD ' ' A' 1021 ' ' MET . 1.1 tm? -56.24 -47.13 79.09 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.339 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.613 ' O ' ' HB2' ' A' 1003 ' ' LYS . 72.7 mt -65.71 -31.82 55.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.728 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -62.67 -38.82 91.85 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.872 0.368 . . . . 0.0 111.676 176.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.518 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 54.8 mmtt -77.5 -43.02 33.51 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 122.529 1.157 . . . . 0.0 108.46 -177.519 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.992 ' HG3' ' HB3' ' A' ' 951' ' ' TYR . 12.0 tpp -57.8 -29.96 65.32 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 113.482 -1.69 . . . . 0.0 109.2 177.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.613 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 15.7 tptt -73.28 -55.11 6.86 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 114.162 -1.381 . . . . 0.0 111.037 -167.155 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.855 ' HB3' HD23 ' A' 1013 ' ' LEU . 3.9 mm? -71.4 -13.66 61.92 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.32 -178.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.744 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -69.86 -45.22 68.23 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 119.366 -0.933 . . . . 0.0 109.477 179.705 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.942 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 3.4 pp0? -75.75 -26.73 57.67 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 120.071 -0.652 . . . . 0.0 111.718 172.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.691 ' HG3' HD13 ' A' 1004 ' ' LEU . 21.9 mm-40 -52.0 -54.61 27.79 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.152 0.501 . . . . 0.0 110.581 174.271 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.806 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 72.1 m-85 -114.98 41.15 2.46 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.229 -0.588 . . . . 0.0 109.96 173.573 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 1.053 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 14.7 p -49.41 -22.16 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.603 172.389 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 20.6 mmt -30.96 -57.13 0.22 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.202 173.096 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 97.9 m -164.98 -72.32 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 O-C-N 123.122 0.263 . . . . 0.0 111.646 173.034 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 32.5 t -50.8 -74.92 0.03 OUTLIER 'General case' 0 C--O 1.24 0.595 0 CA-C-N 115.685 -0.689 . . . . 0.0 112.8 -169.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.855 HD23 ' HB3' ' A' 1004 ' ' LEU . 7.6 mp -50.46 -39.08 46.89 Favored 'General case' 0 CA--C 1.504 -0.812 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -178.235 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 1.053 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.62 -49.25 70.94 Favored 'General case' 0 N--CA 1.442 -0.838 0 O-C-N 123.505 0.503 . . . . 0.0 111.465 -168.186 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.429 ' O ' ' HD3' ' A' 1019 ' ' LYS . 12.1 pt20 -74.67 -38.8 62.33 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.607 -176.466 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 53.5 tt0 -66.75 -53.75 30.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.583 0.706 . . . . 0.0 110.592 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.744 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 5.9 m-85 -65.67 -34.32 77.94 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.73 -1.123 . . . . 0.0 113.651 -174.177 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.572 ' HG2' HD13 ' A' ' 943' ' ' ILE . 51.4 tptt -80.32 -29.19 38.06 Favored 'General case' 0 N--CA 1.461 0.102 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.199 -177.7 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . 0.429 ' HD3' ' O ' ' A' 1015 ' ' GLN . 3.4 mptp? -72.52 -50.73 23.77 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 173.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -54.4 -31.84 55.87 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.086 166.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.636 ' SD ' HD21 ' A' ' 998' ' ' LEU . 10.9 tmm? -65.51 -52.32 53.53 Favored 'General case' 0 C--O 1.217 -0.651 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 174.092 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' 1022 ' ' LEU . 0.0 OUTLIER -74.08 -12.17 60.53 Favored 'General case' 0 C--O 1.218 -0.591 0 C-N-CA 119.258 -0.977 . . . . 0.0 109.806 -176.762 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 92.5 m -82.21 -41.86 19.74 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.205 175.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.548 ' O ' ' HG ' ' A' 1028 ' ' LEU . . . -78.12 -22.04 49.44 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-O 120.972 0.415 . . . . 0.0 109.937 174.134 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.751 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -84.7 -22.05 29.91 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.929 169.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.515 ' O ' HG23 ' A' 1030 ' ' VAL . 47.6 t60 -76.55 -25.62 54.26 Favored 'General case' 0 C--O 1.213 -0.854 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 164.587 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . 0.452 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -69.52 -41.4 76.07 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 122.746 0.419 . . . . 0.0 110.168 163.59 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.63 HD21 ' N ' ' A' ' 995' ' ' LEU . 21.0 mt -60.33 -46.56 89.46 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 170.921 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . 0.426 ' HA ' HG22 ' A' ' 933' ' ' VAL . . . -57.57 -43.04 84.22 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 123.192 0.308 . . . . 0.0 111.456 173.306 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.515 HG23 ' O ' ' A' 1026 ' ' HIS . 4.9 t -66.55 -50.74 64.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-O 120.916 0.389 . . . . 0.0 110.47 -176.663 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.69 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 14.0 m-20 -75.02 -29.1 60.72 Favored 'General case' 0 C--O 1.212 -0.871 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.212 -176.475 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.672 ' HB1' HG22 ' A' ' 929' ' ' VAL . . . -58.97 -45.82 89.58 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 168.438 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . . . . . . . . . 56.1 tttm -65.29 -41.98 93.57 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.768 0.794 . . . . 0.0 109.877 175.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.69 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 38.9 t30 -70.5 -53.76 14.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.002 -1.454 . . . . 0.0 112.09 -172.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 1.053 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 2.5 pp -62.79 -38.57 91.19 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 119.332 -0.366 . . . . 0.0 110.599 -174.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.627 HD22 HG23 ' A' ' 925' ' ' VAL . 4.3 pp -71.43 -36.4 71.27 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 116.933 -1.907 . . . . 0.0 109.734 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.61 ' N ' HD12 ' A' 1036 ' ' LEU . 11.5 t70 -57.92 -39.76 78.77 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.749 174.291 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.644 HG13 ' HE1' ' A' 1053 ' ' HIS . 13.1 t -55.86 -33.49 34.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 114.124 -1.398 . . . . 0.0 111.578 173.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.592 ' HA ' ' HB3' ' A' 1042 ' ' ALA . 1.9 mp -86.44 -33.94 7.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 117.944 0.338 . . . . 0.0 111.486 175.19 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.687 ' HB3' HD12 ' A' ' 919' ' ' ILE . 1.0 OUTLIER -53.18 -49.45 66.64 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 166.424 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.716 ' HA ' HG22 ' A' ' 919' ' ' ILE . 36.2 mt-30 -69.2 -39.92 78.35 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.371 -0.832 . . . . 0.0 111.205 175.223 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.592 ' HB3' ' HA ' ' A' 1039 ' ' ILE . . . -54.63 -49.28 70.89 Favored 'General case' 0 CA--C 1.497 -1.081 0 C-N-CA 122.932 0.493 . . . . 0.0 111.782 -175.637 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.823 ' HB3' HD13 ' A' ' 976' ' ' LEU . 0.0 OUTLIER -63.68 -38.52 91.42 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.818 -178.319 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.548 ' N ' ' HD3' ' A' 1043 ' ' ARG . 56.4 tp -70.05 -38.82 75.91 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 121.768 0.794 . . . . 0.0 109.566 178.56 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.699 ' HD2' ' HA ' ' A' 1052 ' ' PRO . 10.4 tttp -59.01 -62.48 1.85 Allowed 'General case' 0 N--CA 1.437 -1.105 0 CA-C-N 114.341 -1.3 . . . . 0.0 110.563 -178.603 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.488 ' HG2' ' OG1' ' A' ' 980' ' ' THR . 0.0 OUTLIER -67.48 -22.99 65.44 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.134 -169.318 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.461 HG12 ' O ' ' A' 1043 ' ' ARG . 17.9 mm -65.05 -54.06 33.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.51 172.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 6.2 t -138.91 52.41 1.78 Allowed 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 119.747 -0.781 . . . . 0.0 111.682 -175.238 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . 0.539 ' HB2' ' O ' ' A' 1045 ' ' LYS . 73.5 mt-30 -143.08 143.23 31.77 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.916 172.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 26.7 t -98.46 1.89 47.18 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 174.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' 1051 ' ' ARG . 12.3 mmt85 -131.51 152.93 81.32 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.236 -178.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . 0.699 ' HA ' ' HD2' ' A' 1045 ' ' LYS . 3.0 Cg_exo -73.93 131.91 16.25 Favored 'Trans proline' 0 N--CA 1.455 -0.791 0 C-N-CA 122.447 2.098 . . . . 0.0 110.702 168.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . 0.644 ' HE1' HG13 ' A' 1038 ' ' VAL . 4.3 p80 . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 114.59 -1.186 . . . . 0.0 111.692 -176.335 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.719 0 N-CA-C 112.171 -0.372 . . . . 0.0 112.171 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 909' ' ' SER . . . . . 0.769 ' HB2' ' HD3' ' A' ' 910' ' ' PRO . 45.4 m -85.8 -61.69 0.26 Allowed Pre-proline 0 C--N 1.324 -0.503 0 O-C-N 122.752 -0.264 . . . . 0.0 111.599 179.681 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 910' ' ' PRO . . . . . 0.769 ' HD3' ' HB2' ' A' ' 909' ' ' SER . 21.0 Cg_exo -65.48 -48.5 3.2 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 122.312 2.008 . . . . 0.0 113.177 -173.381 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . -72.43 -30.86 63.98 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.722 -0.752 . . . . 0.0 113.125 -173.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 912' ' ' ILE . . . . . 0.406 HG22 ' O ' ' A' ' 912' ' ' ILE . 11.1 mt -105.22 11.7 8.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 121.233 0.539 . . . . 0.0 110.688 -175.799 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 913' ' ' SER . . . . . 0.526 ' HB2' ' O ' ' A' ' 909' ' ' SER . 13.2 t -72.84 -35.63 67.3 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.939 0.399 . . . . 0.0 110.124 178.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 175.16 171.41 39.17 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 120.983 -0.627 . . . . 0.0 111.702 179.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 915' ' ' GLY . . . . . 0.438 ' HA2' ' HD3' ' A' ' 920' ' ' ARG . . . 84.33 -69.94 3.24 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 121.032 -0.604 . . . . 0.0 112.027 177.405 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . 58.31 -108.57 1.53 Allowed Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.023 -177.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 917' ' ' GLY . . . . . 0.633 ' HA3' HG13 ' A' 1047 ' ' ILE . . . -109.41 80.34 0.27 Allowed Glycine 0 N--CA 1.444 -0.833 0 N-CA-C 111.437 -0.665 . . . . 0.0 111.437 177.089 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . 0.647 ' HA2' HD13 ' A' 1044 ' ' LEU . . . -172.89 164.27 36.29 Favored Glycine 0 N--CA 1.446 -0.658 0 N-CA-C 111.717 -0.553 . . . . 0.0 111.717 -177.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 919' ' ' ILE . . . . . 0.693 HG23 ' CG ' ' A' 1040 ' ' ASP . 73.7 mt -69.93 80.97 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-O 121.824 0.821 . . . . 0.0 109.678 177.066 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . 0.438 ' HD3' ' HA2' ' A' ' 915' ' ' GLY . 68.3 ttt180 -158.46 86.74 0.87 Allowed 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.85 -1.068 . . . . 0.0 108.404 178.384 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 26.0 m -141.8 86.04 1.97 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.506 -177.085 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -111.98 43.14 1.62 Allowed 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 106.649 -1.611 . . . . 0.0 106.649 169.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.566 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 12.8 m-20 -84.06 -162.28 0.63 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 113.782 -1.554 . . . . 0.0 111.11 -175.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.766 ' HB3' HG21 ' A' ' 968' ' ' THR . 16.8 tppt? -54.98 -26.1 34.42 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -175.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.525 ' O ' HG23 ' A' ' 929' ' ' VAL . 29.0 m -61.7 -29.8 46.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-O 121.079 0.466 . . . . 0.0 110.304 177.291 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.566 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.0 OUTLIER -78.2 -26.28 47.46 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 176.356 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -76.02 -25.7 55.95 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.035 174.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.571 ' OD1' ' HA ' ' A' ' 965' ' ' LEU . 5.1 m120 -77.29 -29.84 53.94 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 121.663 0.744 . . . . 0.0 109.032 173.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.593 ' HA ' ' HG ' ' A' ' 932' ' ' LEU . 81.8 t -76.68 -29.48 18.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.329 174.642 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . 0.439 ' O ' ' HB3' ' A' ' 934' ' ' LYS . 36.1 m -60.49 -39.98 89.64 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 170.217 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -72.32 -53.25 9.11 Favored Glycine 0 CA--C 1.524 0.629 0 CA-C-N 115.103 -0.953 . . . . 0.0 113.708 178.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.593 ' HG ' ' HA ' ' A' ' 929' ' ' VAL . 2.8 pp -65.05 -47.61 76.76 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -175.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . 0.433 HG23 HG13 ' A' ' 929' ' ' VAL . 73.6 t -63.25 -42.9 98.12 Favored 'Isoleucine or valine' 0 C--O 1.24 0.582 0 CA-C-O 121.407 0.622 . . . . 0.0 110.52 -177.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.759 ' O ' ' HB2' ' A' ' 938' ' ' GLU . 16.0 ttpt -60.51 -40.22 90.62 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.655 178.449 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -58.59 -46.59 86.63 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.499 -0.48 . . . . 0.0 111.083 175.174 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.818 HG22 ' HB1' ' A' 1025 ' ' ALA . 57.8 t -45.05 -83.65 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 123.274 0.63 . . . . 0.0 112.386 -179.075 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . . . . . . . . . 19.4 pt -64.6 -43.41 96.73 Favored 'Isoleucine or valine' 0 C--O 1.248 0.997 0 N-CA-C 112.316 0.488 . . . . 0.0 112.316 -173.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.759 ' HB2' ' O ' ' A' ' 934' ' ' LYS . 6.2 mm-40 -67.84 -51.29 50.17 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.855 -169.576 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.531 ' O ' HG22 ' A' ' 943' ' ' ILE . 30.8 ttm -72.78 -27.81 62.22 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 120.093 -0.643 . . . . 0.0 109.686 -175.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . . . . . . . . . 2.8 m -51.34 -53.41 36.43 Favored 'General case' 0 C--N 1.346 0.441 0 O-C-N 123.97 0.793 . . . . 0.0 112.501 -174.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 14.6 t -104.31 -23.53 13.21 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.705 -175.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.722 ' HB3' ' O ' ' A' ' 938' ' ' GLU . 0.3 OUTLIER -85.05 -56.96 3.29 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.118 -0.633 . . . . 0.0 112.285 -164.935 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.584 HG23 ' HG3' ' A' ' 944' ' ' GLN . 11.5 tt -60.88 -11.26 3.89 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -177.218 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.632 ' HG2' ' HB2' ' A' ' 949' ' ' GLU . 17.6 mt-30 -113.93 97.7 45.61 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.074 -176.325 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -75.64 -37.28 1.79 Allowed 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.287 1.991 . . . . 0.0 111.765 176.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . 0.679 ' HB3' ' HD3' ' A' ' 947' ' ' PRO . . . -160.77 -53.0 0.01 OUTLIER Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.03 -178.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.679 ' HD3' ' HB3' ' A' ' 946' ' ' ALA . 12.4 Cg_exo -70.52 154.17 64.93 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 121.963 1.775 . . . . 0.0 112.065 178.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.859 ' HB3' HG11 ' A' 1009 ' ' VAL . 5.6 Cg_endo -52.45 141.0 52.78 Favored 'Trans proline' 0 CA--C 1.512 -0.592 0 C-N-CA 123.132 2.555 . . . . 0.0 112.699 176.674 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.696 ' HB3' ' CD1' ' A' ' 951' ' ' TYR . 5.3 tt0 -72.11 -18.75 61.88 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.604 172.417 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.585 ' HB2' ' HG2' ' A' ' 953' ' ' PRO . 19.6 mm-40 80.28 -14.87 0.8 Allowed 'General case' 0 C--N 1.347 0.487 0 O-C-N 124.328 1.017 . . . . 0.0 109.679 -165.289 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.904 ' HB3' ' HG3' ' A' 1002 ' ' MET . 20.6 m-30 54.04 -38.19 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 115.789 1.774 . . . . 0.0 115.789 176.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 0.507 ' O ' ' HB ' ' A' ' 955' ' ' VAL . 45.4 t -54.79 -40.6 84.9 Favored Pre-proline 0 C--N 1.32 -0.688 0 O-C-N 122.076 -0.39 . . . . 0.0 111.019 168.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 0.745 ' HA ' ' HD2' ' A' ' 956' ' ' LYS . 8.2 Cg_exo -44.57 -51.32 7.25 Favored 'Trans proline' 0 C--N 1.357 0.985 0 C-N-CA 122.468 2.112 . . . . 0.0 112.836 170.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.53 ' HE1' ' HB3' ' A' ' 939' ' ' MET . 0.4 OUTLIER -62.66 -41.76 99.24 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.884 172.144 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.507 ' HB ' ' O ' ' A' ' 952' ' ' VAL . 54.9 t -52.4 -36.88 22.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.886 176.342 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . 0.745 ' HD2' ' HA ' ' A' ' 953' ' ' PRO . 59.6 mttt -66.12 -41.89 89.92 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 111.599 0.222 . . . . 0.0 111.599 173.15 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -77.32 -44.82 28.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.754 0.311 . . . . 0.0 111.356 -172.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.54 ' O ' ' HG ' ' A' ' 962' ' ' LEU . 14.4 p -75.1 -34.47 31.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 176.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -64.44 -43.72 96.32 Favored Glycine 0 N--CA 1.448 -0.56 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 177.266 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . 0.565 HD12 ' HD2' ' A' ' 963' ' ' ARG . 16.3 tp -63.14 -38.47 91.31 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.925 -0.137 . . . . 0.0 110.678 175.23 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -69.84 -60.02 2.57 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 120.898 0.38 . . . . 0.0 111.012 -177.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.857 HD13 HD22 ' A' ' 995' ' ' LEU . 4.1 pp -56.54 -29.66 62.19 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 173.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.565 ' HD2' HD12 ' A' ' 960' ' ' LEU . 9.9 ptp180 -73.77 -36.39 65.08 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 120.195 1.361 . . . . 0.0 110.637 172.027 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . . . . . . . . . 32.2 m -62.72 -33.52 75.29 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 174.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.571 ' HA ' ' OD1' ' A' ' 928' ' ' ASN . 25.8 tp -61.65 -54.35 44.0 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.487 174.132 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.767 ' HG ' ' NE2' ' A' ' 988' ' ' GLN . 8.0 tt -54.95 -41.04 70.6 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.185 -1.37 . . . . 0.0 109.38 178.826 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . . . . . . . . . . . -68.8 -35.07 76.57 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.034 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.766 HG21 ' HB3' ' A' ' 924' ' ' LYS . 23.2 m -73.17 -39.21 65.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 118.809 0.731 . . . . 0.0 110.675 177.305 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.773 HG12 HG23 ' A' ' 984' ' ' ILE . 27.1 t -67.31 -36.67 77.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 CA-C-O 120.726 0.298 . . . . 0.0 110.519 173.255 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.422 ' O ' ' HD3' ' A' ' 974' ' ' PRO . 20.4 t70 -68.63 -42.37 78.14 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 179.217 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.664 ' O ' HG23 ' A' ' 975' ' ' VAL . 31.7 tp10 -68.34 -24.8 64.86 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 113.857 -1.52 . . . . 0.0 109.69 179.738 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . . . . . . . . . 58.8 m -73.54 -17.59 61.19 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.366 177.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.687 ' HB3' ' HD3' ' A' ' 974' ' ' PRO . 35.0 tp -67.72 -52.81 24.25 Favored Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 119.741 -0.783 . . . . 0.0 110.284 172.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.687 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 19.2 Cg_exo -70.14 -11.31 30.1 Favored 'Trans proline' 0 C--N 1.358 1.041 0 C-N-CA 121.404 1.403 . . . . 0.0 113.502 172.905 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.664 HG23 ' O ' ' A' ' 971' ' ' GLU . 38.8 t -66.15 -55.36 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 173.228 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.543 HD21 HD11 ' A' 1047 ' ' ILE . 18.0 tp -133.78 87.36 36.07 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 175.558 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -79.91 39.26 0.81 Allowed 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 123.772 2.982 . . . . 0.0 113.119 -171.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . 0.717 ' HB3' ' SD ' ' A' 1046 ' ' MET . . . -86.26 47.61 1.49 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.951 0.405 . . . . 0.0 110.944 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.484 ' HB2' ' CE1' ' A' 1053 ' ' HIS . 59.4 m 67.77 17.82 9.76 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 177.159 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.83 ' HB ' ' SD ' ' A' 1046 ' ' MET . 6.0 t -76.81 1.61 16.86 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.856 177.457 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.495 ' O ' ' HG2' ' A' ' 985' ' ' GLU . 1.9 p80 -49.69 -49.14 48.82 Favored 'General case' 0 C--O 1.208 -1.101 0 O-C-N 123.224 0.327 . . . . 0.0 110.984 -177.675 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.65 -21.42 3.95 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 179.426 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.68 ' HG2' ' HB2' ' A' 1042 ' ' ALA . 0.3 OUTLIER -80.08 -49.53 11.63 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-N 118.747 0.703 . . . . 0.0 111.45 171.071 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.773 HG23 HG12 ' A' ' 969' ' ' VAL . 2.9 mp -63.52 -30.94 51.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 178.174 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 981' ' ' HIS . 70.4 mm-40 -58.9 -46.17 88.52 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.083 175.718 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 24.6 mmt -73.13 -42.74 62.56 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.205 -176.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 0.814 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -65.65 -49.32 69.09 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 114.713 -1.131 . . . . 0.0 111.971 -176.384 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.784 ' O ' ' HB2' ' A' ' 992' ' ' ASN . 12.8 mm100 -56.02 -40.81 73.98 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.035 177.533 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . 0.592 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 0.0 OUTLIER -72.35 -39.2 68.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.297 -178.784 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.605 HD23 ' HB3' ' A' 1035 ' ' LEU . 26.7 tp -55.0 -59.12 5.18 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.921 179.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.619 ' HB3' ' CD2' ' A' 1035 ' ' LEU . 3.2 pp -63.08 -31.62 72.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.868 0.842 . . . . 0.0 109.741 179.007 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . 0.784 ' HB2' ' O ' ' A' ' 988' ' ' GLN . 20.6 t-20 -53.58 -57.33 11.13 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 113.564 -1.653 . . . . 0.0 112.747 -174.589 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 25.0 m -79.71 -25.34 41.2 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 -177.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -72.58 -38.03 68.01 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 119.346 -0.941 . . . . 0.0 111.404 177.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 0.857 HD22 HD13 ' A' ' 962' ' ' LEU . 0.5 OUTLIER -66.91 -24.25 66.07 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.132 171.033 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -78.19 -26.3 47.52 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 119.47 -0.892 . . . . 0.0 109.708 172.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . 0.53 ' O ' ' HG2' ' A' 1001 ' ' LYS . 6.8 tp10 -74.41 -42.69 58.79 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 173.636 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.761 HD22 HD11 ' A' 1028 ' ' LEU . 0.0 OUTLIER -56.99 -47.25 81.27 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.649 -178.89 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.644 ' O ' ' HB2' ' A' 1003 ' ' LYS . 82.6 mt -66.64 -39.26 83.38 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.332 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.246 -174.532 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 21.2 m-80 -62.18 -36.75 82.84 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.072 0.463 . . . . 0.0 111.633 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.53 ' HG2' ' O ' ' A' ' 997' ' ' GLU . 72.3 mmtt -78.28 -40.61 36.41 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 122.133 0.968 . . . . 0.0 109.422 -177.42 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.904 ' HG3' ' HB3' ' A' ' 951' ' ' TYR . 5.0 tpt -63.86 -27.32 69.08 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.28 -1.327 . . . . 0.0 109.049 178.168 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.644 ' HB2' ' O ' ' A' ' 999' ' ' ILE . 12.4 tptp -73.28 -53.09 11.71 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.031 -1.44 . . . . 0.0 110.506 -167.4 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.588 ' O ' HD23 ' A' 1013 ' ' LEU . 7.2 mp -77.4 -12.03 59.91 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.142 179.545 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.748 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -67.56 -40.74 84.93 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 119.526 -0.87 . . . . 0.0 109.526 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.76 ' HA ' ' HB ' ' A' 1009 ' ' VAL . 4.3 pp0? -75.04 -32.72 61.63 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 119.115 -0.469 . . . . 0.0 111.69 169.56 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.57 ' HB2' ' HA ' ' A' 1004 ' ' LEU . 10.6 mm-40 -46.37 -49.51 17.76 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.04 0.447 . . . . 0.0 110.588 175.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.904 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 49.7 m-85 -126.86 48.3 2.2 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 119.844 -0.743 . . . . 0.0 110.542 171.246 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 0.954 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 11.9 p -50.94 -21.54 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.593 167.711 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . . . . . . . . . 87.8 mtp -37.9 -49.35 1.22 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.161 -1.382 . . . . 0.0 111.574 172.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -171.76 -81.8 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 177.338 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . . . . . . . . . 2.5 m -49.89 -71.46 0.06 Allowed 'General case' 0 C--O 1.246 0.911 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.829 -168.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.904 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 4.8 mp -46.56 -42.82 16.45 Favored 'General case' 0 CA--C 1.498 -1.047 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 179.539 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 0.954 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.82 -58.01 9.26 Favored 'General case' 0 N--CA 1.438 -1.048 0 C-N-CA 119.827 -0.749 . . . . 0.0 110.769 -166.833 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.622 ' O ' ' HB3' ' A' 1019 ' ' LYS . 40.3 mt-30 -67.83 -34.79 77.42 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.02 -169.452 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . 0.468 ' OE2' ' HE3' ' A' 1019 ' ' LYS . 18.4 tp10 -73.96 -41.64 61.68 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.307 -0.557 . . . . 0.0 111.142 177.517 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.748 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 6.1 m-85 -75.14 -34.4 61.64 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.93 0.871 . . . . 0.0 111.834 -173.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.517 ' HB2' ' NE2' ' A' 1014 ' ' GLN . 13.7 tptm -79.79 -40.86 27.7 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 113.414 -1.721 . . . . 0.0 110.825 -175.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . 0.622 ' HB3' ' O ' ' A' 1015 ' ' GLN . 0.0 OUTLIER -71.38 -35.19 71.0 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 -179.58 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . 0.599 ' N ' ' HD3' ' A' 1019 ' ' LYS . 9.4 tt0 -69.99 -30.25 67.53 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.098 -1.41 . . . . 0.0 110.49 167.328 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.759 ' HG3' ' SD ' ' A' 1002 ' ' MET . 14.8 tmm? -69.02 -54.03 17.32 Favored 'General case' 0 CA--C 1.507 -0.702 0 C-N-CA 120.977 -0.289 . . . . 0.0 111.034 -179.616 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . 0.676 ' HA ' ' HB3' ' A' 1025 ' ' ALA . 0.2 OUTLIER -83.63 -2.72 56.72 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 119.485 -0.886 . . . . 0.0 109.462 -172.43 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 46.1 m -86.11 -34.09 20.73 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 168.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.53 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -79.09 -22.6 45.0 Favored 'General case' 0 C--O 1.221 -0.425 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 173.015 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.818 ' HB1' HG22 ' A' ' 936' ' ' VAL . . . -85.9 -26.56 25.52 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.005 169.567 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.525 ' O ' HG23 ' A' 1030 ' ' VAL . 12.9 t60 -70.86 -30.7 67.17 Favored 'General case' 0 C--O 1.215 -0.762 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 165.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . 0.53 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -64.91 -42.46 94.71 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 123.975 0.91 . . . . 0.0 110.755 163.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.761 HD11 HD22 ' A' ' 998' ' ' LEU . 30.2 mt -58.13 -46.69 85.18 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 119.923 -0.711 . . . . 0.0 109.472 171.507 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . 0.426 ' CB ' HG22 ' A' ' 933' ' ' VAL . . . -59.09 -43.51 91.83 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 173.565 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.581 ' O ' ' HB3' ' A' 1033 ' ' LYS . 12.2 t -68.01 -51.23 51.4 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.211 0 CA-C-O 121.675 0.75 . . . . 0.0 110.863 -176.54 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.4 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 21.3 m-20 -76.76 -29.5 56.14 Favored 'General case' 0 C--O 1.214 -0.814 0 CA-C-N 115.056 -0.974 . . . . 0.0 112.158 -175.114 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.625 ' HA ' ' CD2' ' A' 1035 ' ' LEU . . . -71.28 -27.67 63.59 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.509 -0.476 . . . . 0.0 109.741 171.413 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.581 ' HB3' ' O ' ' A' 1030 ' ' VAL . 84.9 tttt -65.54 -45.92 81.57 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 122.091 0.948 . . . . 0.0 109.22 168.287 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.609 ' O ' ' HB3' ' A' 1037 ' ' ASP . 56.4 t30 -70.87 -46.61 62.32 Favored 'General case' 0 C--O 1.221 -0.44 0 CA-C-N 113.967 -1.469 . . . . 0.0 112.599 -176.026 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 0.814 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 4.0 pp -63.9 -36.38 83.76 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 122.156 -0.34 . . . . 0.0 110.627 -177.128 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.463 HD12 ' N ' ' A' 1037 ' ' ASP . 4.7 pp -72.36 -35.87 68.62 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 117.282 -1.767 . . . . 0.0 109.745 178.173 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.696 ' HA ' ' OD2' ' A' 1040 ' ' ASP . 19.3 t70 -54.88 -30.93 59.18 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 122.999 1.38 . . . . 0.0 110.585 168.716 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.534 ' HB ' ' O ' ' A' 1035 ' ' LEU . 14.3 t -73.57 -36.96 48.94 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.54 177.479 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.708 ' HA ' ' CB ' ' A' 1042 ' ' ALA . 2.0 mp -79.31 -26.05 12.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 C-N-CA 121.123 -0.231 . . . . 0.0 111.573 172.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.696 ' OD2' ' HA ' ' A' 1037 ' ' ASP . 0.2 OUTLIER -59.93 -44.69 94.19 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 171.48 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.408 ' N ' ' OD1' ' A' 1040 ' ' ASP . 12.4 mt-30 -76.55 -31.22 57.45 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.718 174.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.708 ' CB ' ' HA ' ' A' 1039 ' ' ILE . . . -56.29 -55.97 26.84 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 120.973 0.416 . . . . 0.0 111.818 -179.275 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.686 ' HA ' ' CE ' ' A' 1046 ' ' MET . 11.8 ptm180 -65.73 -34.52 78.38 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.535 -176.045 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.647 HD13 ' HA2' ' A' ' 918' ' ' GLY . 49.5 tp -63.62 -52.34 61.26 Favored 'General case' 0 C--O 1.216 -0.707 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.772 171.705 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.745 ' O ' ' HB2' ' A' 1049 ' ' GLN . 25.8 mtpt -58.58 -42.98 89.24 Favored 'General case' 0 C--O 1.215 -0.718 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -172.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.83 ' SD ' ' HB ' ' A' ' 980' ' ' THR . 0.3 OUTLIER -71.79 -26.38 62.4 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.376 -0.529 . . . . 0.0 111.974 -179.063 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.633 HG13 ' HA3' ' A' ' 917' ' ' GLY . 44.9 mm -87.52 -43.7 15.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 121.347 0.594 . . . . 0.0 111.011 176.872 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . . . . . . . . . 27.6 t -84.0 -15.81 46.34 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.114 -0.948 . . . . 0.0 112.473 -171.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . 0.745 ' HB2' ' O ' ' A' 1045 ' ' LYS . 14.4 tp60 -51.4 126.0 15.92 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.762 0.791 . . . . 0.0 111.82 -164.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 8.2 m -62.89 -23.56 67.4 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.007 -1.451 . . . . 0.0 110.506 178.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . 0.412 ' H ' ' HG3' ' A' 1049 ' ' GLN . 32.6 mmt180 -79.64 141.92 56.69 Favored Pre-proline 0 N--CA 1.449 -0.495 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.9 178.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -48.83 114.06 1.11 Allowed 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 123.072 2.514 . . . . 0.0 111.798 175.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . 0.484 ' CE1' ' HB2' ' A' ' 979' ' ' SER . 36.5 t60 . . . . . 0 C--N 1.321 -0.631 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.42 -173.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 908' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.724 0 N-CA-C 111.98 -0.448 . . . . 0.0 111.98 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 909' ' ' SER . . . . . . . . . . . . . 35.6 m 57.63 81.76 0.25 Allowed Pre-proline 0 CA--C 1.533 0.293 0 CA-C-O 121.001 0.429 . . . . 0.0 111.167 -178.468 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 910' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -77.18 55.47 5.06 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 123.394 2.73 . . . . 0.0 112.584 -177.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 911' ' ' GLY . . . . . . . . . . . . . . . 123.77 -75.77 0.38 Allowed Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.515 178.268 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 912' ' ' ILE . . . . . . . . . . . . . 58.8 mt -115.18 -48.91 4.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 120.524 0.202 . . . . 0.0 110.868 -176.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 913' ' ' SER . . . . . . . . . . . . . 29.1 t 72.26 160.2 0.22 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.624 -178.445 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 914' ' ' GLY . . . . . . . . . . . . . . . 125.35 5.08 6.77 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.221 -178.632 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 915' ' ' GLY . . . . . . . . . . . . . . . 85.77 -95.81 2.04 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 121.022 -0.609 . . . . 0.0 112.255 179.225 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 916' ' ' GLY . . . . . . . . . . . . . . . -152.98 -156.72 7.7 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 121.108 -0.567 . . . . 0.0 111.966 -178.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 917' ' ' GLY . . . . . . . . . . . . . . . -96.84 -49.84 1.88 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.125 178.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 918' ' ' GLY . . . . . 0.938 ' HA2' HD22 ' A' 1044 ' ' LEU . . . 79.49 -153.96 37.7 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.955 -0.641 . . . . 0.0 112.977 177.447 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 919' ' ' ILE . . . . . 0.625 ' HA ' ' HB3' ' A' 1040 ' ' ASP . 0.1 OUTLIER -73.8 123.18 28.44 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.697 0 C-N-CA 123.358 0.663 . . . . 0.0 109.582 176.909 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 920' ' ' ARG . . . . . . . . . . . . . 43.6 ttm180 -165.38 -17.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.638 -175.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 921' ' ' SER . . . . . . . . . . . . . 9.2 m -62.37 94.79 0.06 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.195 0.522 . . . . 0.0 112.301 -171.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 922' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -86.38 82.48 7.96 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 176.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 923' ' ' ASP . . . . . 0.649 ' O ' ' HD1' ' A' ' 926' ' ' TYR . 17.3 m-20 -126.53 -168.49 1.87 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.024 -175.511 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 924' ' ' LYS . . . . . 0.526 ' HB3' HG21 ' A' ' 968' ' ' THR . 31.0 mmtp -54.66 -30.85 56.49 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -168.651 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 925' ' ' VAL . . . . . 0.583 ' O ' HG23 ' A' ' 929' ' ' VAL . 35.0 m -56.94 -34.95 45.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.116 0.484 . . . . 0.0 110.641 177.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 926' ' ' TYR . . . . . 0.649 ' HD1' ' O ' ' A' ' 923' ' ' ASP . 0.1 OUTLIER -74.08 -37.28 64.25 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.405 174.952 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 927' ' ' GLU . . . . . 0.494 ' HG3' ' CZ ' ' A' ' 926' ' ' TYR 0.257 1.9 tt0 -78.38 -23.78 46.65 Favored 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 118.399 -1.32 . . . . 0.0 113.758 -177.334 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 928' ' ' ASN . . . . . 0.445 ' ND2' HG22 ' A' ' 964' ' ' THR . 87.1 m-20 -72.2 -27.77 62.77 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 121.22 0.533 . . . . 0.0 110.097 169.504 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 929' ' ' VAL . . . . . 0.588 HG22 ' HB1' ' A' 1032 ' ' ALA . 98.7 t -77.0 -29.38 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.953 171.776 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 930' ' ' THR . . . . . . . . . . . . . 25.7 m -61.48 -40.38 94.33 Favored 'General case' 0 C--N 1.311 -1.088 0 C-N-CA 119.507 -0.877 . . . . 0.0 108.898 171.121 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 931' ' ' GLY . . . . . . . . . . . . . . . -71.57 -53.05 10.53 Favored Glycine 0 CA--C 1.527 0.786 0 CA-C-N 115.172 -0.922 . . . . 0.0 113.689 176.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 932' ' ' LEU . . . . . 0.565 ' CD2' ' HA ' ' A' ' 929' ' ' VAL . 1.8 pp -61.73 -46.67 88.65 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.94 0.718 . . . . 0.0 112.94 -176.19 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 933' ' ' VAL . . . . . . . . . . . . . 73.5 t -68.99 -39.24 79.49 Favored 'Isoleucine or valine' 0 C--O 1.241 0.605 0 CA-C-O 121.154 0.502 . . . . 0.0 110.906 -176.039 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 934' ' ' LYS . . . . . 0.471 ' HD3' ' HG3' ' A' ' 938' ' ' GLU . 5.2 tppp? -55.63 -44.11 76.8 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.679 -178.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 935' ' ' ALA . . . . . . . . . . . . . . . -60.13 -45.19 93.86 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.462 177.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 936' ' ' VAL . . . . . 0.693 HG22 ' HB1' ' A' 1025 ' ' ALA . 85.4 t -45.17 -74.32 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 123.6 0.76 . . . . 0.0 112.879 -176.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 937' ' ' ILE . . . . . 0.511 HG22 HD12 ' A' 1022 ' ' LEU . 14.5 pt -77.32 -42.53 30.76 Favored 'Isoleucine or valine' 0 C--O 1.245 0.849 0 CA-C-N 115.927 -0.579 . . . . 0.0 112.546 -174.171 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 938' ' ' GLU . . . . . 0.608 ' O ' ' HB2' ' A' ' 942' ' ' LYS . 35.4 mm-40 -66.65 -43.41 84.69 Favored 'General case' 0 C--N 1.316 -0.867 0 C-N-CA 120.53 -0.468 . . . . 0.0 111.105 -173.059 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 939' ' ' MET . . . . . 0.431 ' HG2' ' HB ' ' A' ' 943' ' ' ILE . 11.1 ttp -75.59 -27.28 58.48 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 119.225 -0.99 . . . . 0.0 110.615 176.238 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 940' ' ' SER . . . . . 0.655 ' HB2' ' O ' ' A' ' 936' ' ' VAL . 32.5 t -48.81 -53.74 18.0 Favored 'General case' 0 C--O 1.236 0.393 0 O-C-N 123.8 0.687 . . . . 0.0 112.101 -170.452 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 941' ' ' SER . . . . . . . . . . . . . 10.9 p -123.18 -19.57 5.97 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.96 -174.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 942' ' ' LYS . . . . . 0.608 ' HB2' ' O ' ' A' ' 938' ' ' GLU . 2.1 mptp? -82.41 -40.1 21.72 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 119.5 -0.88 . . . . 0.0 110.472 -174.553 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 943' ' ' ILE . . . . . 0.486 ' O ' HD13 ' A' ' 943' ' ' ILE . 0.1 OUTLIER -34.87 -42.29 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 O-C-N 123.979 0.799 . . . . 0.0 112.729 177.608 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 944' ' ' GLN . . . . . 0.456 ' HG3' ' HD2' ' A' ' 945' ' ' PRO . 53.4 tt0 -174.98 143.65 0.78 Allowed Pre-proline 0 CA--C 1.53 0.194 0 CA-C-N 118.255 0.48 . . . . 0.0 110.419 177.043 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 945' ' ' PRO . . . . . 0.463 ' O ' ' HD3' ' A' ' 947' ' ' PRO . 71.5 Cg_exo -52.14 -48.63 20.68 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.657 2.238 . . . . 0.0 111.496 173.785 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 946' ' ' ALA . . . . . . . . . . . . . . . -107.25 85.54 2.16 Favored Pre-proline 0 C--N 1.329 -0.323 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 168.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 947' ' ' PRO . . . . . 0.475 ' HG2' ' NZ ' ' A' 1018 ' ' LYS . 68.9 Cg_endo -87.37 119.96 1.47 Allowed 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 123.074 2.516 . . . . 0.0 113.733 -168.021 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 948' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 947' ' ' PRO . 17.2 Cg_exo -70.74 -169.05 0.35 Allowed 'Trans proline' 0 CA--C 1.509 -0.757 0 C-N-CA 123.247 2.632 . . . . 0.0 112.231 176.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 949' ' ' GLU . . . . . 0.981 ' HB3' ' HB2' ' A' 1006 ' ' GLN . 0.0 OUTLIER -83.34 76.26 9.92 Favored 'General case' 0 CA--C 1.491 -1.323 0 CA-C-O 121.589 0.709 . . . . 0.0 111.138 178.004 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 950' ' ' GLU . . . . . 0.625 ' HA ' ' HG2' ' A' ' 953' ' ' PRO . 21.2 mm-40 -84.16 10.15 10.95 Favored 'General case' 0 C--N 1.295 -1.777 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 156.051 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 951' ' ' TYR . . . . . 0.552 ' CD1' ' N ' ' A' ' 951' ' ' TYR . 0.4 OUTLIER -71.5 -55.93 6.9 Favored 'General case' 0 C--O 1.216 -0.699 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.577 -178.424 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 952' ' ' VAL . . . . . 1.005 HG13 ' HD3' ' A' ' 953' ' ' PRO . 0.2 OUTLIER -59.85 -42.69 92.24 Favored Pre-proline 0 CA--C 1.542 0.665 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.41 172.342 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 953' ' ' PRO . . . . . 1.005 ' HD3' HG13 ' A' ' 952' ' ' VAL . 87.1 Cg_exo -55.21 -38.76 93.43 Favored 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 121.212 1.274 . . . . 0.0 111.735 167.572 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 954' ' ' MET . . . . . 0.46 ' O ' HG22 ' A' ' 958' ' ' VAL . 4.0 ttm -66.38 -30.56 70.97 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.874 176.082 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 955' ' ' VAL . . . . . 0.648 HG23 ' HA ' ' A' ' 952' ' ' VAL . 69.4 t -53.53 -42.99 51.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 174.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 956' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.41 -36.0 80.4 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.464 175.29 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 957' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -78.46 -45.93 20.96 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 111.911 0.338 . . . . 0.0 111.911 -174.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 958' ' ' VAL . . . . . 0.685 ' O ' ' HG ' ' A' ' 962' ' ' LEU . 17.7 m -81.63 -34.7 13.15 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.663 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 959' ' ' GLY . . . . . . . . . . . . . . . -60.13 -35.59 88.11 Favored Glycine 0 N--CA 1.437 -1.241 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 178.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 960' ' ' LEU . . . . . 0.56 HD12 ' HD3' ' A' ' 963' ' ' ARG . 19.5 tp -76.77 -36.57 56.94 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-O 120.697 0.284 . . . . 0.0 110.682 176.219 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 961' ' ' ALA . . . . . . . . . . . . . . . -72.11 -44.21 63.54 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.097 0.475 . . . . 0.0 111.93 -173.11 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 962' ' ' LEU . . . . . 0.89 HD11 ' HG ' ' A' ' 995' ' ' LEU . 4.6 pp -87.16 -18.09 31.21 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.843 -177.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 963' ' ' ARG . . . . . 0.56 ' HD3' HD12 ' A' ' 960' ' ' LEU . 12.0 ptm180 -72.79 -38.01 67.38 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 118.834 -1.147 . . . . 0.0 110.119 165.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 964' ' ' THR . . . . . 0.498 ' N ' ' HG3' ' A' ' 963' ' ' ARG . 23.9 m -65.62 -31.27 72.2 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 178.171 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 965' ' ' LEU . . . . . 0.701 HD23 ' HG ' ' A' ' 991' ' ' LEU . 17.7 tp -62.6 -50.16 72.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.089 171.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 966' ' ' LEU . . . . . 0.789 ' HG ' ' HB2' ' A' ' 988' ' ' GLN . 9.8 tt -64.21 -36.37 83.84 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.08 -0.963 . . . . 0.0 108.489 -174.696 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 967' ' ' ALA . . . . . 0.426 ' HA ' ' HB3' ' A' ' 970' ' ' ASP . . . -71.87 -39.19 69.8 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.925 178.496 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 968' ' ' THR . . . . . 0.526 HG21 ' HB3' ' A' ' 924' ' ' LYS . 2.2 p -61.48 -35.81 78.7 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 118.945 0.793 . . . . 0.0 110.212 174.049 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 969' ' ' VAL . . . . . 0.909 HG12 HG23 ' A' ' 984' ' ' ILE . 49.1 t -74.43 -36.61 42.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.208 174.168 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 970' ' ' ASP . . . . . 0.697 ' HB2' HE22 ' A' ' 988' ' ' GLN . 17.3 t70 -70.13 -42.04 73.14 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 122.04 0.924 . . . . 0.0 109.201 -178.629 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 971' ' ' GLU . . . . . 0.603 ' O ' ' HD2' ' A' ' 974' ' ' PRO . 7.9 tp10 -67.2 -31.18 71.38 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.258 -1.337 . . . . 0.0 109.904 176.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 972' ' ' SER . . . . . 0.479 ' HA ' ' HB ' ' A' ' 975' ' ' VAL . 46.9 m -68.38 -18.04 64.37 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.939 174.642 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 973' ' ' LEU . . . . . 0.907 ' HG ' ' HB2' ' A' ' 981' ' ' HIS . 10.4 tt -66.74 -51.67 38.13 Favored Pre-proline 0 CA--C 1.53 0.194 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 -177.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 974' ' ' PRO . . . . . 0.745 ' HD3' ' HB3' ' A' ' 973' ' ' LEU . 5.0 Cg_exo -79.61 -4.77 13.75 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 121.388 1.392 . . . . 0.0 113.004 172.322 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 975' ' ' VAL . . . . . 0.586 HG23 ' O ' ' A' ' 971' ' ' GLU . 40.1 t -75.98 -54.48 13.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.125 171.608 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 976' ' ' LEU . . . . . 0.623 HD12 HG21 ' A' ' 980' ' ' THR . 97.9 mt -94.86 122.32 60.67 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.451 -178.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 977' ' ' PRO . . . . . 0.49 ' HD3' ' HA ' ' A' ' 976' ' ' LEU . 20.0 Cg_exo -65.95 112.65 2.31 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 123.519 2.813 . . . . 0.0 114.564 -170.046 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 978' ' ' ALA . . . . . . . . . . . . . . . 67.37 -82.19 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 165.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 979' ' ' SER . . . . . 0.422 ' O ' ' HG2' ' A' ' 982' ' ' ARG . 19.7 m -59.63 -37.14 77.84 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -166.284 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 980' ' ' THR . . . . . 0.623 HG21 HD12 ' A' ' 976' ' ' LEU . 54.4 m -69.21 -24.47 64.03 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 120.299 -0.56 . . . . 0.0 111.144 179.167 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 981' ' ' HIS . . . . . 0.907 ' HB2' ' HG ' ' A' ' 973' ' ' LEU . 0.3 OUTLIER -69.0 -18.4 64.05 Favored 'General case' 0 C--O 1.218 -0.554 0 O-C-N 121.934 -0.479 . . . . 0.0 112.187 -174.653 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 982' ' ' ARG . . . . . 0.422 ' HG2' ' O ' ' A' ' 979' ' ' SER . 13.2 ptm180 -83.2 -21.65 33.39 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 119.849 -0.74 . . . . 0.0 110.87 177.557 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 983' ' ' GLU . . . . . 0.545 ' CB ' ' HB2' ' A' 1042 ' ' ALA . 3.0 mp0 -76.15 -33.51 59.38 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 165.046 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 984' ' ' ILE . . . . . 0.909 HG23 HG12 ' A' ' 969' ' ' VAL . 69.6 mt -68.36 -30.39 47.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.569 178.326 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 985' ' ' GLU . . . . . 0.636 ' HG2' ' O ' ' A' ' 981' ' ' HIS . 72.5 mm-40 -62.45 -53.16 58.88 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.269 176.054 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 986' ' ' MET . . . . . . . . . . . . . 20.5 ttt -69.82 -39.98 76.16 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.831 -172.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 987' ' ' ALA . . . . . 1.065 ' HB1' ' HB2' ' A' 1035 ' ' LEU . . . -76.44 -53.41 8.17 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.099 -1.409 . . . . 0.0 112.624 -167.638 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 988' ' ' GLN . . . . . 0.789 ' HB2' ' HG ' ' A' ' 966' ' ' LEU . 3.2 pt20 -65.04 -21.77 66.88 Favored 'General case' 0 C--O 1.226 -0.167 0 C-N-CA 120.126 -0.629 . . . . 0.0 109.592 178.464 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 989' ' ' LYS . . . . . 0.59 ' O ' ' HB3' ' A' ' 992' ' ' ASN . 34.0 tttp -73.3 -43.26 61.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.124 -0.944 . . . . 0.0 112.178 173.78 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 990' ' ' LEU . . . . . 0.595 ' O ' ' HB2' ' A' ' 994' ' ' ASP . 16.0 mt -52.54 -53.73 42.22 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.235 174.34 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 991' ' ' LEU . . . . . 0.707 HD11 ' HB2' ' A' ' 962' ' ' LEU . 0.4 OUTLIER -59.82 -39.54 85.41 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 175.946 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 992' ' ' ASN . . . . . 0.59 ' HB3' ' O ' ' A' ' 989' ' ' LYS . 40.9 t-20 -52.88 -57.29 10.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.006 -0.997 . . . . 0.0 111.565 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 993' ' ' SER . . . . . . . . . . . . . 26.6 p -80.05 -31.24 39.5 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.211 0.448 . . . . 0.0 112.211 -178.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 994' ' ' ASP . . . . . 0.595 ' HB2' ' O ' ' A' ' 990' ' ' LEU . 0.1 OUTLIER -65.91 -42.07 90.62 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 120.272 -0.571 . . . . 0.0 110.87 178.72 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 995' ' ' LEU . . . . . 0.89 ' HG ' HD11 ' A' ' 962' ' ' LEU . 1.8 tm? -59.42 -32.86 70.57 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.486 0.715 . . . . 0.0 110.691 168.108 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 996' ' ' ALA . . . . . . . . . . . . . . . -67.77 -28.34 67.53 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 118.8 -1.16 . . . . 0.0 110.28 174.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 997' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -75.26 -43.11 53.22 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 120.638 0.256 . . . . 0.0 110.337 175.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 998' ' ' LEU . . . . . 0.889 HD13 ' HB2' ' A' 1025 ' ' ALA . 8.3 tp -55.8 -47.55 76.94 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.168 0.509 . . . . 0.0 110.998 -179.059 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 999' ' ' ILE . . . . . 0.536 ' O ' ' HB2' ' A' 1003 ' ' LYS . 39.9 mm -68.12 -34.1 64.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 115.296 -0.866 . . . . 0.0 111.738 -172.099 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1000 ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -63.05 -38.62 91.91 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.179 0.514 . . . . 0.0 111.618 179.095 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1001 ' ' LYS . . . . . 0.517 ' HA ' ' HD1' ' A' 1017 ' ' TYR . 14.3 mptt -83.63 -36.74 23.62 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.826 0.822 . . . . 0.0 109.402 -176.121 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1002 ' ' MET . . . . . 0.465 ' HB2' ' HG2' ' A' 1021 ' ' MET . 46.3 ttm -59.87 -30.81 69.24 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 114.349 -1.296 . . . . 0.0 109.684 174.079 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1003 ' ' LYS . . . . . 0.619 ' O ' ' HG3' ' A' 1006 ' ' GLN . 4.6 tptp -74.24 -53.54 9.56 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 114.694 -1.139 . . . . 0.0 111.699 -170.595 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1004 ' ' LEU . . . . . 0.882 HD23 ' HG3' ' A' 1007 ' ' GLN . 86.4 mt -72.48 -13.69 61.49 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.461 -179.459 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1005 ' ' ALA . . . . . 0.661 ' HB2' ' HB3' ' A' 1017 ' ' TYR . . . -70.36 -42.48 71.75 Favored 'General case' 0 C--O 1.216 -0.692 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 177.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1006 ' ' GLN . . . . . 0.981 ' HB2' ' HB3' ' A' ' 949' ' ' GLU . 5.1 pp0? -75.86 -31.73 59.42 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 119.034 -0.508 . . . . 0.0 111.938 172.699 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1007 ' ' GLN . . . . . 0.882 ' HG3' HD23 ' A' 1004 ' ' LEU . 13.2 mm100 -48.36 -51.43 26.4 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.265 0.555 . . . . 0.0 110.045 175.491 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1008 ' ' TYR . . . . . 0.762 ' HB2' ' HB2' ' A' 1013 ' ' LEU . 69.6 m-85 -120.74 45.85 2.14 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.368 173.178 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1009 ' ' VAL . . . . . 1.099 ' HA ' ' HB2' ' A' 1014 ' ' GLN . 10.8 p -52.2 -20.54 1.91 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 CA-C-N 114.847 -1.069 . . . . 0.0 110.183 170.14 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1010 ' ' MET . . . . . 0.45 ' O ' ' HB ' ' A' 1011 ' ' THR . 24.3 mmt -38.53 -44.09 0.92 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 113.843 -1.526 . . . . 0.0 111.298 172.69 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1011 ' ' THR . . . . . 0.497 HG23 ' N ' ' A' 1012 ' ' SER . 8.1 t -178.76 -65.16 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 171.619 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1012 ' ' SER . . . . . 0.497 ' N ' HG23 ' A' 1011 ' ' THR . 6.9 m -57.65 -73.85 0.07 Allowed 'General case' 0 C--O 1.242 0.676 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -167.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1013 ' ' LEU . . . . . 0.762 ' HB2' ' HB2' ' A' 1008 ' ' TYR . 7.8 mp -49.89 -37.1 29.88 Favored 'General case' 0 CA--C 1.504 -0.821 0 CA-C-N 116.016 -0.538 . . . . 0.0 112.226 178.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1014 ' ' GLN . . . . . 1.099 ' HB2' ' HA ' ' A' 1009 ' ' VAL . 0.0 OUTLIER -54.88 -48.73 72.62 Favored 'General case' 0 N--CA 1.443 -0.815 0 O-C-N 123.633 0.583 . . . . 0.0 111.472 -167.088 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A 1015 ' ' GLN . . . . . 0.642 ' O ' ' HB3' ' A' 1019 ' ' LYS . 3.7 pt20 -76.27 -36.83 58.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.967 -176.102 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1016 ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -74.11 -40.57 62.59 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.765 0.793 . . . . 0.0 110.836 -176.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1017 ' ' TYR . . . . . 0.661 ' HB3' ' HB2' ' A' 1005 ' ' ALA . 5.3 m-85 -78.31 -37.92 43.59 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 115.441 -0.799 . . . . 0.0 112.7 -176.706 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1018 ' ' LYS . . . . . 0.612 ' HA ' ' CB ' ' A' 1021 ' ' MET . 35.7 ttpt -81.96 -25.52 34.75 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.733 -175.425 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1019 ' ' LYS . . . . . 0.642 ' HB3' ' O ' ' A' 1015 ' ' GLN . 0.0 OUTLIER -73.33 -32.47 64.59 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 174.883 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A 1020 ' ' GLN . . . . . 0.475 ' N ' ' HD3' ' A' 1019 ' ' LYS . 49.1 mt-30 -68.32 -32.89 73.33 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.662 -1.154 . . . . 0.0 110.652 162.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1021 ' ' MET . . . . . 0.612 ' CB ' ' HA ' ' A' 1018 ' ' LYS . 18.2 tmm? -64.9 -53.55 44.83 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 -179.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1022 ' ' LEU . . . . . 0.511 HD12 HG22 ' A' ' 937' ' ' ILE . 0.2 OUTLIER -78.15 -11.83 59.95 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 119.248 -0.981 . . . . 0.0 109.821 -173.069 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A 1023 ' ' THR . . . . . . . . . . . . . 63.0 m -86.57 -33.95 20.06 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.761 175.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1024 ' ' ALA . . . . . 0.484 ' O ' ' HB3' ' A' 1027 ' ' ALA . . . -79.32 -23.58 43.39 Favored 'General case' 0 C--O 1.221 -0.432 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 172.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1025 ' ' ALA . . . . . 0.889 ' HB2' HD13 ' A' ' 998' ' ' LEU . . . -86.28 -24.74 25.83 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.619 170.215 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1026 ' ' HIS . . . . . 0.545 ' O ' HG23 ' A' 1030 ' ' VAL . 47.0 t60 -73.37 -28.5 62.07 Favored 'General case' 0 C--O 1.217 -0.644 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 164.287 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1027 ' ' ALA . . . . . 0.484 ' HB3' ' O ' ' A' 1024 ' ' ALA . . . -66.19 -40.9 90.76 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 123.586 0.755 . . . . 0.0 110.418 163.419 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1028 ' ' LEU . . . . . 0.766 HD12 HD22 ' A' ' 998' ' ' LEU . 25.4 mt -61.83 -43.72 98.28 Favored 'General case' 0 C--N 1.313 -0.983 0 C-N-CA 119.919 -0.712 . . . . 0.0 109.89 170.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1029 ' ' ALA . . . . . . . . . . . . . . . -58.29 -40.85 83.03 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.645 0.26 . . . . 0.0 110.884 171.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1030 ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' 1026 ' ' HIS . 4.7 t -67.27 -52.05 46.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 121.111 0.482 . . . . 0.0 110.742 -176.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1031 ' ' ASP . . . . . 0.654 ' HA ' ' HB3' ' A' 1034 ' ' ASN . 1.4 m-20 -77.43 -27.85 52.36 Favored 'General case' 0 C--O 1.207 -1.144 0 CA-C-N 115.758 -0.656 . . . . 0.0 112.435 -177.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1032 ' ' ALA . . . . . 0.621 ' O ' HD12 ' A' 1036 ' ' LEU . . . -66.76 -32.7 74.16 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 121.769 -0.582 . . . . 0.0 109.438 169.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1033 ' ' LYS . . . . . 0.412 ' HB3' ' O ' ' A' 1030 ' ' VAL . 87.7 tttt -68.51 -39.66 81.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.894 0.854 . . . . 0.0 109.523 170.216 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1034 ' ' ASN . . . . . 0.654 ' HB3' ' HA ' ' A' 1031 ' ' ASP . 36.6 t30 -71.21 -52.69 17.65 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 114.787 -1.097 . . . . 0.0 111.444 -177.267 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1035 ' ' LEU . . . . . 1.065 ' HB2' ' HB1' ' A' ' 987' ' ' ALA . 3.7 pp -64.14 -42.2 96.88 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 118.911 -0.566 . . . . 0.0 111.671 -171.29 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1036 ' ' LEU . . . . . 0.671 HD13 ' H ' ' A' 1037 ' ' ASP . 0.0 OUTLIER -71.76 -33.05 68.32 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 116.416 -2.114 . . . . 0.0 109.056 -178.573 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A 1037 ' ' ASP . . . . . 0.671 ' H ' HD13 ' A' 1036 ' ' LEU . 22.0 t70 -57.28 -44.93 84.46 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.073 171.034 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1038 ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' 1034 ' ' ASN . 37.4 t -56.15 -38.29 53.32 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.61 0 CA-C-N 114.193 -1.367 . . . . 0.0 111.812 175.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1039 ' ' ILE . . . . . 0.69 HD11 ' HA ' ' A' ' 984' ' ' ILE . 1.6 mp -80.61 -32.39 13.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 118.451 0.569 . . . . 0.0 111.814 175.332 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1040 ' ' ASP . . . . . 0.625 ' HB3' ' HA ' ' A' ' 919' ' ' ILE . 0.3 OUTLIER -62.19 -38.57 89.59 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.55 0.691 . . . . 0.0 109.859 170.526 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A 1041 ' ' GLN . . . . . 0.406 ' O ' ' HB2' ' A' 1045 ' ' LYS . 25.5 mt-30 -76.11 -33.13 59.46 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.779 173.372 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1042 ' ' ALA . . . . . 0.555 ' O ' ' HG2' ' A' 1046 ' ' MET . . . -55.89 -55.46 32.36 Favored 'General case' 0 CA--C 1.501 -0.94 0 C-N-CA 123.101 0.56 . . . . 0.0 111.984 178.249 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1043 ' ' ARG . . . . . 0.71 ' HD3' ' N ' ' A' 1044 ' ' LEU . 0.0 OUTLIER -65.03 -34.61 78.84 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 -176.877 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A 1044 ' ' LEU . . . . . 0.938 HD22 ' HA2' ' A' ' 918' ' ' GLY . 30.8 tp -66.07 -58.47 5.41 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 115.05 -0.977 . . . . 0.0 109.054 177.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1045 ' ' LYS . . . . . 0.567 ' HA ' ' OG ' ' A' 1048 ' ' SER . 16.6 ttpt -52.21 -42.72 63.78 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.648 1.179 . . . . 0.0 112.562 -178.727 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1046 ' ' MET . . . . . 0.555 ' HG2' ' O ' ' A' 1042 ' ' ALA . 8.6 ptm -67.59 -20.51 65.38 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 119.132 -1.027 . . . . 0.0 111.883 179.148 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1047 ' ' ILE . . . . . 0.411 HG12 ' O ' ' A' 1043 ' ' ARG . 41.3 mm -95.84 -32.06 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-O 120.837 0.351 . . . . 0.0 111.228 174.203 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1048 ' ' SER . . . . . 0.567 ' OG ' ' HA ' ' A' 1045 ' ' LYS . 78.3 p -83.87 -29.45 27.23 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -173.515 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1049 ' ' GLN . . . . . 0.498 ' HA ' ' OE1' ' A' 1049 ' ' GLN . 9.6 mm-40 -59.54 131.27 50.44 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 120.92 0.39 . . . . 0.0 110.664 179.462 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1050 ' ' SER . . . . . . . . . . . . . 35.7 p -78.92 -6.18 55.56 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.438 -175.131 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1051 ' ' ARG . . . . . 0.913 ' HB3' ' HD3' ' A' 1052 ' ' PRO . 52.8 ttp180 -154.75 -75.81 0.01 OUTLIER Pre-proline 0 CA--C 1.54 0.558 0 N-CA-C 112.777 0.658 . . . . 0.0 112.777 176.848 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1052 ' ' PRO . . . . . 0.913 ' HD3' ' HB3' ' A' 1051 ' ' ARG . 73.9 Cg_endo -98.17 115.8 0.11 Allowed 'Trans proline' 0 N--CA 1.452 -0.953 0 C-N-CA 121.921 1.747 . . . . 0.0 114.628 -166.36 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 1053 ' ' HIS . . . . . 0.514 ' HD2' ' HB3' ' A' 1046 ' ' MET . 26.1 t60 . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.542 170.351 . . . . . . . . 1 1 . 1 stop_ save_