data_2kvt_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 2kvt _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 . . . . . 0 CA--C 1.539 0.551 0 CA-C-O 120.866 0.365 . . . . 74.219999999999999 111.798 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -129.05 175.81 8.39 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 116.138 -0.483 . . . . 65.209999999999994 111.655 179.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 41.1 p90 -153.52 179.78 8.49 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 121.095 0.474 . . . . 73.25 111.336 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 58.1 mt -117.96 146.05 23.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-N 116.48 -0.327 . . . . 73.349999999999994 111.497 -177.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 57.4 t -128.09 121.1 55.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 122.546 0.338 . . . . 71.140000000000001 110.947 176.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 77.2 p -87.93 115.32 25.31 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 111.85 0.315 . . . . 72.230000000000004 111.85 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 37.4 pt -121.07 175.59 4.67 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-O 121.204 0.526 . . . . 73.040000000000006 111.772 -179.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.431 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 45.4 mt-10 -125.21 141.55 52.03 Favored 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 116.05 -0.523 . . . . 74.140000000000001 110.801 176.369 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -131.81 175.85 8.85 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.035 0.445 . . . . 74.549999999999997 111.724 178.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.27 -136.72 12.85 Favored Glycine 0 CA--C 1.525 0.687 0 C-N-CA 121.086 -0.578 . . . . 65.329999999999998 113.455 176.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -87.71 146.87 40.08 Favored Pre-proline 0 CA--C 1.538 0.485 0 C-N-CA 122.424 0.29 . . . . 75.409999999999997 111.54 -176.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -53.09 -31.51 54.66 Favored 'Trans proline' 0 C--N 1.354 0.859 0 C-N-CA 122.927 2.418 . . . . 51.420000000000002 113.088 -178.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -96.41 -42.64 3.39 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 121.14 -0.552 . . . . 42.439999999999998 112.709 175.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -99.69 85.24 3.07 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.144 0.497 . . . . 72.430000000000007 111.234 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.431 ' HB ' ' HB3' ' A' ' 17' ' ' GLU . 75.1 p -91.95 152.77 19.87 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 121.178 0.513 . . . . 75.219999999999999 112.349 -179.65 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 61.9 t -121.16 145.67 27.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 CA-C-N 115.902 -0.59 . . . . 64.099999999999994 110.505 176.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 41.7 m -78.5 127.97 32.9 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.256 0.465 . . . . 74.409999999999997 112.256 -176.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 44.4 m95 -132.13 151.21 51.9 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.235 0.54 . . . . 74.439999999999998 111.916 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -118.8 119.12 33.44 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.976 -0.557 . . . . 73.040000000000006 111.498 -179.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -100.58 129.84 46.57 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 120.967 0.413 . . . . 73.310000000000002 111.689 177.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 65.4 tp -88.77 111.72 22.33 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.398 -0.365 . . . . 74.0 110.592 174.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 71.7 mtt-85 -127.24 153.87 45.57 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.707 0.289 . . . . 74.5 110.595 178.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -134.14 145.18 49.04 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.809 0.3 . . . . 72.430000000000007 111.809 -176.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -62.64 -17.35 60.25 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 121.44 0.638 . . . . 71.239999999999995 111.156 176.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 29.6 m80 -120.29 128.81 25.64 Favored Pre-proline 0 CA--C 1.542 0.652 0 CA-C-N 115.736 -0.666 . . . . 70.230000000000004 110.777 -176.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -80.11 -17.6 26.39 Favored 'Cis proline' 0 CA--C 1.541 0.851 0 C-N-CA 123.815 -1.327 . . . . 74.420000000000002 113.276 0.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -143.35 143.34 23.85 Favored Pre-proline 0 N--CA 1.471 0.583 0 C-N-CA 122.439 0.296 . . . . 71.140000000000001 110.822 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -70.37 -8.61 24.02 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 122.513 2.142 . . . . 74.109999999999999 112.981 -174.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -97.1 -0.97 46.18 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 120.911 0.386 . . . . 75.409999999999997 111.229 175.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.6 t -72.64 103.87 3.72 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.103 0.477 . . . . 72.329999999999998 111.667 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 58.4 tp -82.99 122.62 28.54 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.989 -0.55 . . . . 74.140000000000001 110.295 176.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.4 mm -88.42 -54.16 8.36 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-O 120.987 0.423 . . . . 72.040000000000006 111.393 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 44.2 t -159.48 156.69 28.71 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 116.376 -0.375 . . . . 64.319999999999993 111.404 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -119.29 139.31 52.13 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.855 0.359 . . . . 65.420000000000002 111.036 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 48.2 m80 -143.32 143.07 22.88 Favored Pre-proline 0 N--CA 1.472 0.642 0 CA-C-N 116.643 -0.253 . . . . 75.519999999999996 111.377 -179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -75.35 -15.1 20.17 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 122.436 2.091 . . . . 70.140000000000001 113.355 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 44.6 p -116.91 148.69 41.12 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 121.118 0.485 . . . . 71.0 111.992 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.29 -42.71 99.11 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.075 -0.511 . . . . 51.219999999999999 112.165 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.2 tp60 -56.86 -46.42 81.8 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 111.89 0.33 . . . . 72.420000000000002 111.89 -178.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -59.75 -34.22 72.68 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 120.839 0.352 . . . . 75.430000000000007 111.462 177.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.97 -43.98 73.87 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 120.969 0.414 . . . . 73.150000000000006 111.458 178.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 66.2 mtt -65.33 -42.76 92.61 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.256 0.55 . . . . 72.319999999999993 111.311 177.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.42 ' O ' ' HD2' ' A' ' 56' ' ' ARG . 12.8 t70 -63.64 -47.99 79.09 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.919 -0.582 . . . . 73.099999999999994 110.563 178.408 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.57 -39.35 80.03 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.314 -0.403 . . . . 72.430000000000007 111.29 176.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.432 ' HZ3' ' CD ' ' A' ' 58' ' ' GLU . 49.5 tttp -55.11 -44.32 74.87 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.326 -0.397 . . . . 72.129999999999995 110.718 174.361 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -63.1 -41.7 99.44 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 122.327 -0.233 . . . . 74.239999999999995 111.605 175.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.428 ' HA ' ' HE ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -56.27 -32.78 64.85 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 122.194 -0.317 . . . . 73.099999999999994 111.809 176.811 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -77.75 -37.59 48.84 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 111.878 0.325 . . . . 63.399999999999999 111.878 177.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.432 ' CD ' ' HZ3' ' A' ' 54' ' ' LYS . 50.8 mt-10 -92.27 -22.8 19.56 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.084 0.772 . . . . 72.450000000000003 113.084 -172.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 . . . . . 0 CA--C 1.543 0.681 0 CA-C-O 120.935 0.398 . . . . 73.120000000000005 111.4 179.037 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 . . . . . 0 CA--C 1.539 0.555 0 CA-C-O 120.895 0.379 . . . . 74.150000000000006 110.958 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.487 ' O ' ' HE3' ' A' ' 54' ' ' LYS . . . -101.52 143.92 30.91 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 120.725 0.297 . . . . 51.119999999999997 111.339 176.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 49.7 p90 -139.65 144.3 37.57 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 121.181 0.515 . . . . 75.430000000000007 111.725 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 62.3 mt -95.34 140.49 16.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-N 116.153 -0.476 . . . . 71.319999999999993 111.333 -178.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.0 t -122.47 140.52 46.04 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 C-N-CA 122.586 0.354 . . . . 73.099999999999994 111.05 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.4 p -102.86 113.47 26.93 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.036 0.446 . . . . 74.040000000000006 111.942 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.432 HD12 ' NE2' ' A' ' 29' ' ' GLN . 37.4 pt -120.96 176.01 4.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-O 121.103 0.478 . . . . 55.530000000000001 111.702 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.428 ' HB2' ' HB ' ' A' ' 24' ' ' THR . 12.3 pt-20 -142.27 132.11 24.28 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.266 -0.425 . . . . 74.329999999999998 110.836 177.158 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -117.22 161.04 20.12 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-O 120.833 0.349 . . . . 71.340000000000003 111.876 -178.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.19 -147.16 17.19 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 121.471 -0.395 . . . . 64.329999999999998 113.583 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.42 ' O ' HG23 ' A' ' 24' ' ' THR . 94.9 mttt -89.1 151.95 47.5 Favored Pre-proline 0 N--CA 1.473 0.68 0 N-CA-C 112.187 0.44 . . . . 74.510000000000005 112.187 -173.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -53.59 123.09 12.5 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 122.345 2.03 . . . . 72.200000000000003 111.932 175.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.33 -50.84 3.89 Favored Glycine 0 CA--C 1.528 0.883 0 C-N-CA 121.05 -0.595 . . . . 55.009999999999998 112.48 -175.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -95.33 76.75 3.4 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.259 0.552 . . . . 65.430000000000007 110.896 177.311 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.428 ' HB ' ' HB2' ' A' ' 17' ' ' GLU . 33.0 p -118.09 161.42 19.87 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.718 0.636 . . . . 70.25 112.718 -177.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 62.0 t -108.76 130.33 61.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-N 115.793 -0.639 . . . . 74.319999999999993 110.617 178.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.7 m -76.07 115.29 15.63 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 120.774 0.321 . . . . 73.409999999999997 111.737 -178.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 88.7 m95 -117.36 144.3 45.07 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.173 0.511 . . . . 75.209999999999994 111.52 177.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -111.01 115.39 29.39 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.053 -0.521 . . . . 75.420000000000002 110.817 176.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.522 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 91.4 mt-30 -97.49 125.4 42.15 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 120.727 0.298 . . . . 72.140000000000001 111.647 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.7 tp -90.49 115.08 27.36 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 122.281 -0.262 . . . . 70.099999999999994 110.336 173.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 58.3 mtt-85 -122.95 151.61 41.65 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 116.771 -0.195 . . . . 73.209999999999994 110.925 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -122.43 167.74 12.94 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 120.885 0.374 . . . . 71.420000000000002 111.782 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.3 p-10 -85.59 -30.55 23.22 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-O 121.097 0.475 . . . . 74.230000000000004 111.352 178.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -117.29 145.64 36.45 Favored Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 122.89 0.476 . . . . 72.25 110.799 176.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -72.28 -13.99 17.07 Favored 'Cis proline' 0 CA--C 1.543 0.951 0 C-N-CA 124.365 -1.098 . . . . 73.439999999999998 113.516 2.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -151.42 150.73 27.52 Favored Pre-proline 0 CA--C 1.539 0.551 0 CA-C-N 116.558 -0.292 . . . . 74.430000000000007 110.691 177.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -58.98 -24.73 74.61 Favored 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 122.747 2.298 . . . . 74.5 112.918 -178.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -82.68 3.02 30.73 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.741 -0.663 . . . . 72.540000000000006 111.897 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 89.2 p -64.81 105.09 0.93 Allowed 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 121.196 0.522 . . . . 45.340000000000003 111.851 -176.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 54.5 tp -91.92 111.09 22.49 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.169 -0.469 . . . . 73.150000000000006 110.35 175.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 44.7 mm -77.49 -51.81 17.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 CA-C-N 116.356 -0.384 . . . . 72.209999999999994 111.386 -179.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 94.5 p -168.77 159.03 9.46 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.049 0.452 . . . . 62.149999999999999 111.954 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.522 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 45.8 mt-10 -114.79 121.42 43.24 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.961 -0.563 . . . . 72.209999999999994 110.465 175.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -126.59 141.95 41.71 Favored Pre-proline 0 N--CA 1.47 0.574 0 O-C-N 122.081 -0.387 . . . . 75.439999999999998 111.721 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -71.78 -27.08 18.48 Favored 'Trans proline' 0 CA--C 1.542 0.888 0 C-N-CA 122.573 2.182 . . . . 70.450000000000003 113.616 -177.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 28.1 p -106.07 148.14 28.11 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.066 0.46 . . . . 74.219999999999999 111.781 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.441 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -64.14 -31.75 73.06 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.308 -0.406 . . . . 74.530000000000001 111.335 175.252 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 27.9 tp60 -57.01 -54.49 46.14 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 116.465 -0.334 . . . . 74.510000000000005 111.319 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -56.18 -42.45 77.11 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 120.897 0.379 . . . . 72.530000000000001 111.33 177.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.53 -41.68 99.02 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.873 0.368 . . . . 72.150000000000006 111.678 179.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.441 ' HG3' ' O ' ' A' ' 47' ' ' ALA . 66.0 mtt -64.97 -49.11 71.6 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.368 -0.378 . . . . 75.340000000000003 110.944 177.183 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -62.22 -37.62 86.06 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 111.779 0.288 . . . . 73.420000000000002 111.779 178.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.68 -43.36 89.5 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.514 -0.312 . . . . 74.310000000000002 111.048 176.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.487 ' HE3' ' O ' ' A' ' 11' ' ' ALA . 87.6 tttt -61.58 -53.97 49.26 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.466 -0.334 . . . . 73.530000000000001 111.109 176.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -56.9 -45.88 82.32 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.358 -0.383 . . . . 74.230000000000004 111.266 178.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 55.1 ttm-85 -56.74 -44.73 81.99 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.055 0.455 . . . . 71.420000000000002 110.929 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -63.26 -48.38 78.43 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.966 -0.561 . . . . 75.040000000000006 110.577 175.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -76.98 15.41 0.68 Allowed 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.743 0.646 . . . . 72.349999999999994 112.743 -175.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 52.0 m-20 . . . . . 0 CA--C 1.537 0.464 0 O-C-N 122.178 -0.326 . . . . 75.010000000000005 110.818 170.103 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 . . . . . 0 CA--C 1.537 0.456 0 CA-C-O 120.984 0.421 . . . . 73.230000000000004 111.767 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.445 ' HB1' ' CD2' ' A' ' 57' ' ' TYR . . . -128.78 152.47 48.42 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.981 -0.554 . . . . 72.120000000000005 111.511 179.188 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 33.9 p90 -142.27 168.79 18.91 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 120.856 0.36 . . . . 74.340000000000003 111.745 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 59.6 mt -109.81 136.87 44.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 N-CA-C 112.053 0.39 . . . . 63.43 112.053 -174.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 78.4 t -127.0 131.87 70.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 CA-C-N 116.46 -0.336 . . . . 70.530000000000001 110.731 175.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 68.2 p -89.91 123.05 33.51 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.312 0.486 . . . . 75.340000000000003 112.312 -177.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.47 HD11 ' NE2' ' A' ' 29' ' ' GLN . 37.1 pt -123.0 175.26 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 CA-C-N 116.326 -0.397 . . . . 72.400000000000006 110.495 173.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -134.61 137.89 44.08 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-O 120.935 0.398 . . . . 74.420000000000002 111.959 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 53.1 mttp -124.11 176.76 6.18 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 116.179 -0.464 . . . . 72.329999999999998 110.248 174.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.47 -142.48 15.87 Favored Glycine 0 CA--C 1.529 0.949 0 C-N-CA 121.214 -0.517 . . . . 50.32 113.635 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.599 ' HZ1' ' HB3' ' A' ' 20' ' ' LYS . 9.4 mtpm? -104.01 146.37 32.41 Favored Pre-proline 0 N--CA 1.473 0.722 0 C-N-CA 122.574 0.35 . . . . 74.049999999999997 111.571 -178.34 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_exo -45.51 125.48 7.62 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 122.98 2.453 . . . . 73.239999999999995 113.039 178.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.94 -65.93 3.65 Favored Glycine 0 CA--C 1.525 0.682 0 C-N-CA 120.904 -0.665 . . . . 62.399999999999999 112.237 -175.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -83.05 68.55 9.57 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.284 0.564 . . . . 74.329999999999998 110.652 177.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 71.5 p -103.8 159.62 15.48 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 121.264 0.554 . . . . 74.400000000000006 112.288 -176.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 86.8 t -109.73 127.07 66.83 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-N 115.931 -0.577 . . . . 75.209999999999994 110.178 174.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 59.0 m -79.68 115.59 19.38 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.095 0.474 . . . . 64.420000000000002 111.719 -178.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 73.6 m95 -102.71 132.31 48.93 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.104 -0.498 . . . . 74.109999999999999 110.953 177.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -97.1 114.4 26.06 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.001 0.429 . . . . 73.010000000000005 110.907 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.729 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 92.0 mt-30 -95.3 120.75 36.07 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.123 -0.489 . . . . 73.200000000000003 111.696 -178.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 58.2 tp -85.09 105.3 15.72 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.309 -0.405 . . . . 71.319999999999993 110.418 175.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.458 ' NH2' ' HA ' ' A' ' 38' ' ' ASP . 15.2 mtp-105 -111.49 139.97 46.48 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.336 -0.393 . . . . 74.420000000000002 110.945 -177.307 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -109.86 149.17 30.26 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 120.932 0.396 . . . . 74.420000000000002 111.324 177.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -77.36 -22.76 51.26 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 112.422 0.527 . . . . 75.200000000000003 112.422 -175.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -128.22 148.26 66.97 Favored Pre-proline 0 N--CA 1.472 0.659 0 O-C-N 122.113 -0.367 . . . . 64.340000000000003 111.13 179.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -70.31 -42.28 0.79 Allowed 'Cis proline' 0 C--N 1.359 1.116 0 C-N-CA 124.215 -1.161 . . . . 75.530000000000001 113.32 0.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -103.65 145.8 31.3 Favored Pre-proline 0 N--CA 1.469 0.482 0 N-CA-C 110.293 -0.262 . . . . 74.439999999999998 110.293 175.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -62.85 -6.41 9.22 Favored 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 122.288 1.992 . . . . 74.430000000000007 113.124 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.458 ' HA ' ' NH2' ' A' ' 31' ' ' ARG . 5.5 m-20 -103.9 14.93 29.79 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.098 0.407 . . . . 63.140000000000001 112.098 178.665 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.7 m -65.52 87.27 0.08 Allowed 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.893 0.378 . . . . 74.430000000000007 111.093 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 59.0 tp -72.55 103.06 3.41 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 121.108 0.48 . . . . 74.150000000000006 111.081 178.05 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.2 mm -71.62 -43.36 71.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 CA-C-N 116.202 -0.453 . . . . 72.319999999999993 111.174 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.6 t -174.12 149.54 1.45 Allowed 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 112.069 0.396 . . . . 74.049999999999997 112.069 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.729 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 45.1 mt-10 -108.13 134.22 51.31 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 116.209 -0.451 . . . . 54.520000000000003 110.521 173.052 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 37.9 m80 -136.33 145.07 50.31 Favored Pre-proline 0 CA--C 1.538 0.504 0 O-C-N 122.236 -0.29 . . . . 75.230000000000004 111.311 178.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -73.66 -15.81 24.13 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 122.479 2.119 . . . . 74.129999999999995 112.851 179.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 34.8 p -115.97 142.33 46.93 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 120.936 0.398 . . . . 74.340000000000003 111.372 178.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.462 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -64.15 -35.6 81.3 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 120.967 0.413 . . . . 64.230000000000004 110.855 176.779 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.26 -49.34 72.29 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.282 -0.417 . . . . 73.349999999999994 111.529 178.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -62.49 -38.53 90.25 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 120.881 0.372 . . . . 73.530000000000001 111.126 177.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.32 -40.91 98.62 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 120.93 0.395 . . . . 73.530000000000001 111.221 178.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.462 ' HG3' ' O ' ' A' ' 47' ' ' ALA . 86.8 mtp -69.49 -44.42 71.14 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.018 0.437 . . . . 74.239999999999995 111.329 178.288 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.587 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 12.4 t70 -65.79 -41.68 91.68 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 120.967 0.413 . . . . 70.450000000000003 111.122 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.24 -36.58 84.57 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.019 0.437 . . . . 61.530000000000001 110.773 175.141 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 43.7 tttp -56.9 -49.14 76.46 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 115.986 -0.552 . . . . 73.200000000000003 111.345 175.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.587 ' HG2' ' O ' ' A' ' 52' ' ' ASP . 17.0 pttm -61.59 -43.97 97.88 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 121.084 -0.246 . . . . 71.010000000000005 110.854 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -65.2 -35.36 80.83 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 120.601 0.239 . . . . 72.409999999999997 111.497 -178.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.445 ' CD2' ' HB1' ' A' ' 11' ' ' ALA . 66.6 t80 -64.15 -47.56 79.4 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.867 0.365 . . . . 75.409999999999997 110.895 175.13 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -71.97 -21.57 61.57 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 116.288 -0.415 . . . . 64.400000000000006 111.512 -177.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 . . . . . 0 CA--C 1.543 0.69 0 N-CA-C 110.371 -0.233 . . . . 71.329999999999998 110.371 167.641 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 . . . . . 0 N--CA 1.471 0.623 0 N-CA-C 112.05 0.389 . . . . 74.319999999999993 112.05 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -138.03 162.07 35.08 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 120.801 0.334 . . . . 72.019999999999996 111.704 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 33.3 p90 -141.68 141.21 33.34 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 121.187 0.517 . . . . 71.409999999999997 111.952 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 62.4 mt -92.81 137.07 23.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-N 116.182 -0.463 . . . . 74.319999999999993 111.836 -177.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 48.2 t -123.65 137.62 56.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 C-N-CA 122.724 0.409 . . . . 74.150000000000006 110.854 177.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 77.8 p -98.07 129.74 44.89 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 112.376 0.51 . . . . 75.150000000000006 112.376 -177.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 41.3 pt -124.5 171.72 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-N 116.293 -0.412 . . . . 74.439999999999998 110.823 177.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -129.66 128.35 42.39 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.011 0.434 . . . . 72.430000000000007 111.909 -178.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -120.44 169.24 10.5 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 116.418 -0.356 . . . . 73.25 110.821 177.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.71 -141.76 15.52 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 120.957 -0.64 . . . . 37.82 114.049 177.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -94.49 141.3 23.28 Favored Pre-proline 0 CA--C 1.541 0.626 0 N-CA-C 111.997 0.369 . . . . 62.130000000000003 111.997 -173.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -55.63 99.6 0.07 OUTLIER 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.583 2.188 . . . . 72.409999999999997 111.935 175.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 116.21 -52.64 0.66 Allowed Glycine 0 CA--C 1.525 0.674 0 N-CA-C 111.537 -0.625 . . . . 43.240000000000002 111.537 -173.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.7 mm-40 -99.41 78.14 2.17 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.124 0.488 . . . . 73.150000000000006 110.67 173.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 81.6 p -105.89 164.73 11.72 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.342 0.592 . . . . 70.319999999999993 112.094 -177.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 61.7 t -121.49 118.43 55.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 115.797 -0.638 . . . . 72.450000000000003 109.633 173.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 87.9 m -76.07 115.33 15.67 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 120.945 0.402 . . . . 71.519999999999996 111.665 -177.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 36.9 m95 -97.37 151.08 20.29 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.079 -0.51 . . . . 74.230000000000004 111.271 177.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -109.67 115.0 29.06 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 116.204 -0.453 . . . . 73.010000000000005 111.34 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.607 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 92.6 mt-30 -98.26 130.21 44.97 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.002 -0.545 . . . . 74.140000000000001 111.041 178.083 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.5 tp -92.95 107.92 19.59 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 120.86 0.362 . . . . 72.329999999999998 111.121 175.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -102.95 163.97 11.89 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 120.917 0.389 . . . . 74.319999999999993 110.48 175.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -144.11 140.63 29.54 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.46 -0.336 . . . . 74.409999999999997 111.466 177.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -63.89 -17.79 63.55 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.014 0.435 . . . . 73.530000000000001 111.737 176.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 48.4 m80 -127.82 133.88 25.6 Favored Pre-proline 0 CA--C 1.544 0.745 0 CA-C-N 116.313 -0.403 . . . . 74.049999999999997 111.339 -174.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -77.96 -53.04 0.16 OUTLIER 'Cis proline' 0 CA--C 1.544 1.018 0 C-N-CA 123.853 -1.311 . . . . 72.549999999999997 113.334 -2.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.42 ' HE2' ' HD2' ' A' ' 37' ' ' PRO . 14.1 mmmm -77.92 141.49 63.63 Favored Pre-proline 0 CA--C 1.54 0.584 0 O-C-N 122.008 -0.433 . . . . 74.129999999999995 110.43 177.067 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.42 ' HD2' ' HE2' ' A' ' 36' ' ' LYS . 14.9 Cg_endo -56.22 -28.11 69.53 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 122.382 2.055 . . . . 75.439999999999998 112.871 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -99.05 22.73 9.92 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 116.558 -0.292 . . . . 72.400000000000006 111.7 177.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.0 t -57.85 94.99 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 121.014 0.435 . . . . 70.209999999999994 111.548 -178.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 58.8 tp -85.41 113.89 22.04 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.175 -0.466 . . . . 74.439999999999998 110.641 178.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.7 mm -81.27 -55.41 8.17 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 CA-C-N 116.61 -0.268 . . . . 72.230000000000004 111.624 -179.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 45.4 m -164.67 155.13 14.36 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-O 120.923 0.392 . . . . 71.420000000000002 111.631 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.607 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 45.2 mt-10 -105.45 139.45 40.06 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.189 -0.46 . . . . 75.530000000000001 110.296 174.271 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . 0.407 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 34.7 m80 -137.06 148.07 61.29 Favored Pre-proline 0 N--CA 1.473 0.702 0 N-CA-C 112.115 0.413 . . . . 74.219999999999999 112.115 179.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 44' ' ' HIS . 22.4 Cg_exo -63.65 -49.41 4.32 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 123.056 2.504 . . . . 73.239999999999995 113.499 178.872 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 34.0 p -101.64 158.97 15.71 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.352 0.596 . . . . 73.310000000000002 112.095 -178.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.42 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -64.68 -40.11 94.82 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.812 -0.631 . . . . 75.420000000000002 111.561 179.008 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.3 tp60 -58.94 -46.04 88.96 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.541 -0.3 . . . . 73.219999999999999 111.407 -178.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -56.36 -42.76 78.32 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 121.401 0.619 . . . . 62.130000000000003 111.001 175.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.88 -38.91 90.02 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.016 -0.538 . . . . 75.340000000000003 111.612 179.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.42 ' HG3' ' O ' ' A' ' 47' ' ' ALA . 73.6 mtp -70.98 -39.63 72.36 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.6 -0.273 . . . . 64.409999999999997 111.556 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.531 ' HA ' ' HD3' ' A' ' 55' ' ' LYS . 13.2 m-20 -59.92 -40.81 90.13 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 120.917 0.389 . . . . 53.229999999999997 111.343 174.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.8 -44.92 91.87 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.976 0.417 . . . . 73.430000000000007 110.942 174.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -56.88 -46.49 81.82 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.083 0.468 . . . . 74.439999999999998 110.896 176.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.531 ' HD3' ' HA ' ' A' ' 52' ' ' ASP . 47.3 mtpt -55.12 -53.94 49.51 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.77 -0.65 . . . . 74.140000000000001 111.174 175.187 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 13.8 mtp180 -56.69 -26.56 56.89 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 111.992 0.367 . . . . 70.099999999999994 111.992 178.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -80.03 -47.15 15.34 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 111.645 0.239 . . . . 75.400000000000006 111.645 176.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -84.17 -16.13 44.58 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.687 0.625 . . . . 72.530000000000001 112.687 -173.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 . . . . . 0 CA--C 1.541 0.628 0 O-C-N 122.311 -0.243 . . . . 74.209999999999994 110.97 176.429 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 . . . . . 0 N--CA 1.47 0.554 0 CA-C-O 120.89 0.376 . . . . 74.420000000000002 111.62 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.568 ' HA ' ' HA ' ' A' ' 32' ' ' ALA . . . -131.72 156.87 45.16 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 116.156 -0.474 . . . . 74.25 111.663 176.864 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 55.5 p90 -149.22 169.56 20.48 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 121.04 0.448 . . . . 74.140000000000001 111.63 178.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 69.2 mt -113.04 130.12 67.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 N-CA-C 112.238 0.458 . . . . 72.319999999999993 112.238 -175.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.479 HG22 ' HD2' ' A' ' 31' ' ' ARG . 60.1 t -111.5 124.59 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-N 116.395 -0.366 . . . . 75.420000000000002 111.083 177.376 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 68.2 p -90.2 113.0 24.71 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 122.029 -0.419 . . . . 75.310000000000002 111.986 -178.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.428 HD13 ' NE2' ' A' ' 29' ' ' GLN . 32.4 pt -115.87 160.06 15.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 120.64 0.257 . . . . 75.540000000000006 111.101 176.697 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -124.39 121.61 35.4 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.131 0.491 . . . . 75.5 111.266 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.438 ' HZ1' ' HB3' ' A' ' 18' ' ' LYS . 5.3 mtpm? -118.0 175.28 5.75 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 116.011 -0.541 . . . . 74.239999999999995 110.678 -178.007 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.29 -136.88 12.94 Favored Glycine 0 CA--C 1.526 0.733 0 C-N-CA 120.564 -0.827 . . . . 62.43 113.62 177.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.57 ' HD2' ' N ' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -96.28 156.45 36.92 Favored Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 122.526 0.33 . . . . 71.129999999999995 111.47 -175.16 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -56.38 123.28 13.47 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.686 2.257 . . . . 61.119999999999997 112.424 174.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 80.38 -60.73 4.5 Favored Glycine 0 CA--C 1.526 0.746 0 C-N-CA 120.88 -0.676 . . . . 74.129999999999995 112.494 -176.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -80.15 73.5 6.97 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.514 0.673 . . . . 64.420000000000002 110.628 176.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 78.2 p -100.01 167.96 10.16 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.558 -0.746 . . . . 75.420000000000002 112.638 -175.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 59.2 t -118.36 126.06 74.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.241 -0.89 . . . . 70.140000000000001 109.455 170.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 35.5 m -81.13 114.67 20.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.917 0.389 . . . . 70.439999999999998 110.866 -179.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -108.88 131.0 55.44 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.094 0.473 . . . . 75.450000000000003 110.847 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -98.1 114.27 26.41 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 116.361 -0.381 . . . . 74.209999999999994 110.953 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.458 ' HB2' ' HB ' ' A' ' 14' ' ' VAL . 68.8 mt-30 -88.6 117.78 27.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.369 -0.378 . . . . 75.310000000000002 111.645 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.6 tp -81.16 103.94 11.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.914 0.388 . . . . 72.310000000000002 110.195 173.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.479 ' HD2' HG22 ' A' ' 14' ' ' VAL . 58.8 mtt180 -114.27 171.41 7.63 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.518 -0.31 . . . . 74.209999999999994 110.752 178.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.568 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . . . -126.77 150.59 49.04 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.117 0.484 . . . . 75.329999999999998 111.865 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -72.17 -25.31 61.64 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.168 0.509 . . . . 72.420000000000002 111.43 175.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -132.45 141.83 42.7 Favored Pre-proline 0 CA--C 1.544 0.745 0 CA-C-N 116.2 -0.454 . . . . 73.400000000000006 111.105 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -77.17 -30.36 6.04 Favored 'Cis proline' 0 C--N 1.355 0.872 0 C-N-CA 124.068 -1.221 . . . . 73.129999999999995 113.31 0.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -124.53 143.73 44.11 Favored Pre-proline 0 CA--C 1.54 0.584 0 CA-C-O 120.568 0.223 . . . . 74.230000000000004 111.532 -176.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -55.26 -27.78 58.84 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.718 2.278 . . . . 74.439999999999998 113.22 177.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -92.9 13.44 20.49 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.098 0.407 . . . . 75.310000000000002 112.098 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.7 m -68.4 83.84 0.26 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.159 0.504 . . . . 75.219999999999999 110.336 174.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 58.1 tp -82.94 122.32 28.12 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 116.015 -0.539 . . . . 72.109999999999999 111.772 -177.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 45.9 mm -87.67 -49.98 14.11 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-N 116.284 -0.416 . . . . 74.049999999999997 111.495 179.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.7 t -172.74 148.79 1.93 Allowed 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 111.851 0.315 . . . . 75.299999999999997 111.851 -177.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -103.61 133.55 48.44 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.027 0.441 . . . . 73.140000000000001 110.856 175.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . 0.539 ' HB3' ' HB3' ' A' ' 49' ' ' GLU . 45.0 m-70 -128.63 143.53 48.76 Favored Pre-proline 0 N--CA 1.47 0.542 0 O-C-N 122.287 -0.258 . . . . 75.540000000000006 111.473 -178.011 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -71.87 -26.93 18.33 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 C-N-CA 122.827 2.351 . . . . 74.329999999999998 114.492 -174.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 25.6 p -114.47 151.18 33.65 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.85 -0.531 . . . . 74.549999999999997 111.964 -178.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.04 -39.71 86.87 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.196 -0.456 . . . . 70.0 111.62 177.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.9 tp60 -61.77 -42.58 99.17 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 120.665 0.269 . . . . 75.140000000000001 110.942 178.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.539 ' HB3' ' HB3' ' A' ' 44' ' ' HIS . 12.0 mm-40 -56.24 -47.06 79.25 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.993 0.425 . . . . 65.540000000000006 111.355 174.393 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.82 -50.91 69.1 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.136 -0.484 . . . . 64.129999999999995 111.959 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 93.5 mmm -63.15 -39.38 94.49 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 111.894 0.331 . . . . 73.430000000000007 111.894 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.44 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 32.8 t70 -64.06 -49.69 71.33 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.952 0.406 . . . . 74.299999999999997 110.844 179.51 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.23 -37.71 86.43 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.1 0.476 . . . . 73.530000000000001 111.306 175.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.7 tttm -56.01 -47.47 77.73 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.027 -0.533 . . . . 65.409999999999997 111.264 177.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -58.98 -43.76 91.46 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.025 0.441 . . . . 75.140000000000001 111.482 176.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.44 ' HG3' ' O ' ' A' ' 52' ' ' ASP . 51.5 mtt-85 -62.27 -32.97 73.75 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.167 -0.47 . . . . 74.319999999999993 111.359 -179.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.447 ' CD2' ' HB1' ' A' ' 11' ' ' ALA . 57.2 t80 -76.89 -44.08 33.27 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.442 -0.345 . . . . 72.510000000000005 111.775 177.451 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -80.18 5.75 13.63 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.517 0.562 . . . . 75.129999999999995 112.517 -175.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.8 t70 . . . . . 0 CA--C 1.547 0.83 0 N-CA-C 109.532 -0.544 . . . . 63.420000000000002 109.532 174.925 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 . . . . . 0 CA--C 1.542 0.668 0 CA-C-O 121.487 0.661 . . . . 75.310000000000002 112.489 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.418 ' HB2' ' O ' ' A' ' 31' ' ' ARG . . . -139.31 -174.8 3.97 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.53 -0.759 . . . . 74.420000000000002 111.048 -177.803 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -152.33 145.72 24.8 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.066 0.46 . . . . 71.019999999999996 111.605 178.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 70.2 mt -101.56 131.09 50.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-N 116.348 -0.387 . . . . 73.530000000000001 111.417 -179.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 59.9 t -105.84 127.31 60.96 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-N 116.394 -0.366 . . . . 73.209999999999994 111.05 177.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.6 p -91.29 112.68 24.69 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.741 0.305 . . . . 71.510000000000005 111.712 -178.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.459 HD13 ' HE3' ' A' ' 18' ' ' LYS . 29.3 pt -115.77 170.53 5.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 116.476 -0.329 . . . . 73.400000000000006 110.97 177.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.426 ' HB2' ' HB ' ' A' ' 24' ' ' THR . 9.9 pt-20 -133.17 126.47 31.72 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.442 0.639 . . . . 74.439999999999998 111.58 176.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.459 ' HE3' HD13 ' A' ' 16' ' ' ILE . 98.5 mttt -114.61 178.15 4.39 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.848 -0.614 . . . . 71.349999999999994 111.203 -178.171 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.32 -136.93 12.96 Favored Glycine 0 CA--C 1.527 0.811 0 C-N-CA 121.107 -0.568 . . . . 70.140000000000001 113.309 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 48.7 mmtm -119.18 154.23 53.54 Favored Pre-proline 0 CA--C 1.539 0.537 0 O-C-N 122.663 -0.316 . . . . 74.010000000000005 111.337 -178.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -49.09 127.5 17.47 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 122.609 2.206 . . . . 74.340000000000003 112.76 176.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.51 -51.91 3.35 Favored Glycine 0 CA--C 1.526 0.758 0 C-N-CA 120.942 -0.647 . . . . 74.319999999999993 112.369 -175.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -99.66 74.32 1.86 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.871 0.367 . . . . 70.310000000000002 111.08 177.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.426 ' HB ' ' HB2' ' A' ' 17' ' ' GLU . 76.9 p -103.08 145.64 29.6 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.384 0.611 . . . . 74.530000000000001 112.156 -178.452 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 54.0 t -108.93 124.88 65.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 CA-C-N 115.801 -0.636 . . . . 64.219999999999999 110.176 174.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.2 m -75.31 115.55 15.07 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.629 0.252 . . . . 73.299999999999997 111.238 -178.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 82.0 m95 -108.51 132.8 53.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.267 0.556 . . . . 73.319999999999993 111.235 177.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -99.28 115.03 28.22 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.976 -0.556 . . . . 75.200000000000003 110.858 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.466 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 83.9 mt-30 -98.44 114.65 27.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.086 -0.506 . . . . 64.010000000000005 111.552 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 60.6 tp -79.22 111.3 15.31 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.858 0.361 . . . . 71.540000000000006 110.572 176.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.418 ' O ' ' HB2' ' A' ' 11' ' ' ALA . 66.8 mtt180 -118.76 169.25 10.0 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.675 0.274 . . . . 73.409999999999997 110.885 178.185 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -140.66 143.91 35.39 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.93 0.395 . . . . 71.540000000000006 111.711 -178.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -68.75 -20.17 64.36 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 116.189 -0.46 . . . . 64.310000000000002 111.975 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 70.8 m80 -119.49 133.64 23.8 Favored Pre-proline 0 CA--C 1.543 0.681 0 CA-C-N 116.245 -0.434 . . . . 72.120000000000005 111.24 -176.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -80.18 -24.13 12.91 Favored 'Cis proline' 0 CA--C 1.539 0.766 0 C-N-CA 123.877 -1.301 . . . . 72.030000000000001 113.103 -0.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -131.68 129.5 22.07 Favored Pre-proline 0 N--CA 1.47 0.546 0 CA-C-N 116.615 -0.266 . . . . 74.329999999999998 110.995 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -67.72 7.74 0.53 Allowed 'Trans proline' 0 CA--C 1.544 0.993 0 C-N-CA 122.643 2.229 . . . . 73.420000000000002 113.445 -179.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.9 m-20 -101.17 -3.75 28.52 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 122.153 -0.342 . . . . 63.43 111.082 175.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.6 t -77.06 142.14 39.96 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.014 0.435 . . . . 74.209999999999994 112.064 -176.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 56.1 tp -115.73 123.59 48.67 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.128 -0.487 . . . . 72.409999999999997 111.051 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 44.4 mm -88.02 -53.95 8.85 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 N-CA-C 111.739 0.274 . . . . 73.430000000000007 111.739 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.8 t -163.43 154.15 16.22 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 112.319 0.488 . . . . 74.409999999999997 112.319 -178.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.466 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 46.4 mt-10 -113.91 132.57 55.88 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 116.333 -0.394 . . . . 74.239999999999995 110.757 177.43 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -141.16 139.73 19.74 Favored Pre-proline 0 N--CA 1.473 0.711 0 O-C-N 122.221 -0.3 . . . . 73.430000000000007 111.539 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo -72.64 -15.68 27.13 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 122.642 2.228 . . . . 75.120000000000005 113.641 -177.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 44.2 p -116.82 148.78 40.91 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 120.914 0.388 . . . . 65.230000000000004 111.534 177.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.71 -31.2 72.06 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.867 0.365 . . . . 75.049999999999997 111.439 177.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.41 ' O ' ' HB2' ' A' ' 52' ' ' ASP . 0.1 OUTLIER -60.62 -52.33 65.63 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.271 -0.422 . . . . 71.420000000000002 110.571 179.43 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -55.97 -45.85 78.8 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 120.897 0.379 . . . . 74.310000000000002 111.803 178.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.81 -49.24 78.49 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 120.99 0.424 . . . . 71.120000000000005 111.447 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.431 ' O ' ' HG3' ' A' ' 55' ' ' LYS . 24.2 mmt -64.23 -33.84 76.72 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.195 0.522 . . . . 60.32 111.101 175.167 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.8 ' HA ' ' HE2' ' A' ' 55' ' ' LYS . 3.6 t70 -61.97 -46.29 89.9 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.93 -0.577 . . . . 71.040000000000006 110.846 -177.469 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.95 -33.39 72.05 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 116.016 -0.538 . . . . 74.150000000000006 111.231 175.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 65.7 tttm -61.49 -37.22 82.88 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.193 -0.458 . . . . 70.129999999999995 111.346 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.8 ' HE2' ' HA ' ' A' ' 52' ' ' ASP . 51.1 mtmt -51.97 -55.37 20.78 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.742 0.306 . . . . 72.120000000000005 111.242 177.041 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 15.8 mtp180 -67.05 -26.71 66.89 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.002 0.371 . . . . 64.329999999999998 112.002 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -66.19 -32.45 73.89 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.035 0.445 . . . . 73.209999999999994 110.535 173.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -77.92 -45.37 24.23 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.952 0.406 . . . . 61.530000000000001 110.845 175.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 . . . . . 0 CA--C 1.549 0.908 0 N-CA-C 112.256 0.465 . . . . 64.299999999999997 112.256 177.917 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 . . . . . 0 CA--C 1.538 0.485 0 CA-C-O 121.096 0.474 . . . . 73.099999999999994 110.932 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.408 ' O ' ' HE3' ' A' ' 54' ' ' LYS . . . -134.5 178.65 6.82 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 121.062 0.458 . . . . 73.519999999999996 111.824 -175.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 33.0 p90 -144.41 141.46 29.66 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.338 0.589 . . . . 75.530000000000001 111.383 178.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 57.3 mt -91.58 125.53 44.27 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 CA-C-N 116.075 -0.511 . . . . 75.530000000000001 111.786 -177.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.433 HG23 ' HD2' ' A' ' 31' ' ' ARG . 83.8 t -106.1 132.4 53.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 CA-C-O 120.862 0.363 . . . . 74.109999999999999 111.047 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 67.8 p -93.19 120.86 33.94 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.306 0.484 . . . . 71.010000000000005 112.306 -178.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 37.8 pt -123.89 171.83 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 CA-C-O 120.763 0.316 . . . . 74.239999999999995 110.877 176.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.545 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 45.6 mt-10 -136.0 127.68 28.99 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.22 0.533 . . . . 73.019999999999996 111.623 178.047 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -104.99 174.69 5.77 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.266 -0.424 . . . . 73.010000000000005 110.83 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.41 -140.27 14.83 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 120.789 -0.719 . . . . 64.340000000000003 113.864 177.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.529 ' HB2' ' HB2' ' A' ' 23' ' ' GLN . 1.9 mptp? -102.29 154.43 37.41 Favored Pre-proline 0 N--CA 1.471 0.618 0 C-N-CA 122.43 0.292 . . . . 64.519999999999996 111.328 -176.135 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -54.91 112.81 1.14 Allowed 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 122.346 2.031 . . . . 75.310000000000002 111.885 172.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 94.72 -45.51 2.16 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 121.265 -0.493 . . . . 74.200000000000003 112.323 -175.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.529 ' HB2' ' HB2' ' A' ' 20' ' ' LYS . 27.8 mm-40 -96.52 71.63 2.69 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.322 0.582 . . . . 75.439999999999998 110.521 175.54 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.545 ' HB ' ' HB3' ' A' ' 17' ' ' GLU . 40.1 p -101.84 168.63 9.31 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.964 0.727 . . . . 71.329999999999998 112.964 -174.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 57.7 t -127.31 125.37 65.84 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 CA-C-N 115.217 -0.901 . . . . 75.120000000000005 110.159 176.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 90.6 m -68.86 124.74 24.51 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.384 0.513 . . . . 75.519999999999996 112.384 -177.284 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -130.29 150.71 51.41 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.109 0.48 . . . . 75.140000000000001 111.292 176.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -117.34 115.26 24.9 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.222 -0.445 . . . . 63.399999999999999 111.436 -179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.618 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 70.9 mt-30 -94.48 107.33 19.31 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.914 0.388 . . . . 72.239999999999995 111.087 175.253 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.6 tp -74.81 111.66 10.23 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.634 -0.257 . . . . 73.230000000000004 110.594 175.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.433 ' HD2' HG23 ' A' ' 14' ' ' VAL . 74.4 mtt180 -116.43 142.61 46.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.781 0.324 . . . . 75.140000000000001 111.004 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -109.6 140.23 43.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.836 0.35 . . . . 73.310000000000002 111.662 -178.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.547 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 26.6 t70 -68.74 -21.58 64.36 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.136 0.494 . . . . 65.540000000000006 111.482 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 78.9 m-70 -123.58 136.43 27.24 Favored Pre-proline 0 CA--C 1.543 0.7 0 CA-C-N 116.461 -0.336 . . . . 74.420000000000002 111.483 -176.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -67.36 -51.57 0.16 OUTLIER 'Cis proline' 0 C--N 1.359 1.1 0 C-N-CA 124.287 -1.13 . . . . 73.109999999999999 113.363 -0.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 31.5 mtmm -109.23 139.25 20.85 Favored Pre-proline 0 N--CA 1.472 0.629 0 O-C-N 122.298 -0.251 . . . . 73.140000000000001 110.897 176.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.547 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 77.2 Cg_exo -52.05 -29.78 37.74 Favored 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 123.182 2.588 . . . . 71.349999999999994 114.45 -177.222 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -78.34 6.78 7.59 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 112.222 0.453 . . . . 74.25 112.222 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 43.8 t -70.41 93.35 0.87 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.001 0.429 . . . . 60.439999999999998 111.511 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 59.8 tp -71.71 114.17 9.52 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 116.4 -0.364 . . . . 43.43 110.848 176.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.0 mm -79.02 -45.8 24.06 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-N 116.227 -0.442 . . . . 74.150000000000006 111.459 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 86.2 p -176.1 149.19 0.86 Allowed 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 112.473 0.546 . . . . 64.450000000000003 112.473 178.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.618 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 49.1 mt-10 -95.95 136.65 36.11 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 116.182 -0.463 . . . . 73.129999999999995 110.884 173.344 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 52.1 m80 -142.66 143.19 25.1 Favored Pre-proline 0 N--CA 1.471 0.623 0 C-N-CA 122.18 0.192 . . . . 73.150000000000006 111.393 177.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -71.75 -18.99 28.1 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.387 2.058 . . . . 71.519999999999996 112.921 -178.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 66.4 p -119.19 150.08 40.65 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.128 0.49 . . . . 73.209999999999994 111.524 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.444 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -67.77 -33.37 74.71 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.224 -0.444 . . . . 61.020000000000003 111.144 177.616 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -59.46 -48.34 82.04 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.28 -0.418 . . . . 72.409999999999997 111.629 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -63.34 -34.43 77.7 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.801 0.334 . . . . 71.329999999999998 111.862 177.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.51 -40.3 92.86 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 120.904 0.383 . . . . 74.230000000000004 110.786 174.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.444 ' HG3' ' O ' ' A' ' 47' ' ' ALA . 64.7 mtt -67.08 -34.41 77.59 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.285 -0.416 . . . . 75.129999999999995 111.42 176.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.488 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 12.7 t70 -57.27 -53.19 60.97 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.05 0.452 . . . . 73.349999999999994 110.823 176.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.07 -31.56 72.15 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 116.239 -0.437 . . . . 70.109999999999999 111.331 178.369 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.435 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 87.8 tttt -62.59 -49.01 76.95 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 116.241 -0.436 . . . . 71.420000000000002 110.95 175.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -59.43 -43.64 93.06 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 116.277 -0.419 . . . . 72.010000000000005 111.217 176.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.488 ' HG3' ' O ' ' A' ' 52' ' ' ASP . 78.5 mtp180 -59.03 -38.71 79.92 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.81 0.338 . . . . 72.299999999999997 111.174 176.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -64.93 -39.55 93.68 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-O 121.062 0.458 . . . . 73.510000000000005 110.979 175.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 54' ' ' LYS . 42.3 mt-10 -69.52 -36.25 76.25 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.168 -0.469 . . . . 73.329999999999998 111.569 179.372 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 . . . . . 0 CA--C 1.543 0.69 0 C-N-CA 122.42 0.288 . . . . 73.340000000000003 111.129 174.61 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 . . . . . 0 N--CA 1.473 0.699 0 N-CA-C 112.016 0.376 . . . . 54.020000000000003 112.016 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.423 ' O ' ' HE2' ' A' ' 54' ' ' LYS . . . -120.85 155.58 33.8 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.837 0.351 . . . . 54.130000000000003 111.335 175.368 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 26.2 p90 -139.04 142.24 38.24 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.168 0.508 . . . . 73.109999999999999 111.588 178.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 64.8 mt -94.02 131.13 41.79 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 116.12 -0.491 . . . . 74.140000000000001 111.51 -178.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 67.3 t -117.91 127.79 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-O 120.817 0.342 . . . . 71.209999999999994 111.18 178.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 75.3 p -86.79 112.81 22.07 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.136 0.493 . . . . 74.209999999999994 111.95 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.5 pt -114.85 176.83 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 116.084 -0.507 . . . . 70.340000000000003 110.57 174.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.552 ' HB2' ' HB ' ' A' ' 24' ' ' THR . 10.2 pt-20 -140.83 126.91 19.51 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.266 0.555 . . . . 72.310000000000002 111.879 177.511 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -104.94 170.25 7.98 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.115 -0.493 . . . . 74.219999999999999 110.745 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 98.88 -168.33 22.36 Favored Glycine 0 CA--C 1.527 0.84 0 C-N-CA 120.846 -0.692 . . . . 38.57 113.562 177.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -70.04 143.12 91.14 Favored Pre-proline 0 N--CA 1.472 0.65 0 N-CA-C 112.064 0.394 . . . . 75.319999999999993 112.064 -178.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -54.32 119.45 6.38 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.465 2.11 . . . . 74.140000000000001 111.815 176.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.2 -47.71 1.34 Allowed Glycine 0 CA--C 1.526 0.74 0 C-N-CA 121.322 -0.466 . . . . 38.57 112.373 -174.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -99.33 60.43 1.17 Allowed 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.047 0.451 . . . . 73.120000000000005 110.65 176.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.552 ' HB ' ' HB2' ' A' ' 17' ' ' GLU . 38.6 p -98.52 154.46 17.88 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 113.029 0.751 . . . . 63.200000000000003 113.029 -174.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 56.9 t -110.8 127.12 68.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-N 115.618 -0.719 . . . . 70.439999999999998 110.458 175.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 88.2 m -72.96 115.33 12.14 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 112.25 0.463 . . . . 75.5 112.25 -178.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 56.7 m95 -110.07 141.37 43.01 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.227 -0.442 . . . . 71.530000000000001 111.104 176.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -103.29 115.27 30.24 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.529 -0.305 . . . . 75.200000000000003 110.876 178.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.572 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 90.0 mt-30 -94.33 119.22 32.77 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 120.959 0.409 . . . . 55.420000000000002 111.572 176.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.2 tp -84.51 110.97 19.08 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 120.863 0.363 . . . . 75.299999999999997 110.122 174.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 47.0 mtp180 -118.92 166.64 12.58 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.473 -0.33 . . . . 73.209999999999994 110.673 -176.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -133.04 144.03 49.78 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 111.68 0.252 . . . . 54.420000000000002 111.68 178.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -79.41 -28.52 41.79 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 111.963 0.357 . . . . 74.040000000000006 111.963 178.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 85.7 m-70 -107.01 128.34 26.27 Favored Pre-proline 0 CA--C 1.542 0.67 0 CA-C-N 116.605 -0.27 . . . . 72.329999999999998 111.385 -175.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -85.84 -22.36 13.32 Favored 'Cis proline' 0 C--N 1.354 0.864 0 C-N-CA 123.969 -1.263 . . . . 70.109999999999999 113.249 -2.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -117.7 141.94 29.82 Favored Pre-proline 0 N--CA 1.469 0.51 0 CA-C-N 116.32 -0.4 . . . . 74.450000000000003 111.114 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_exo -61.19 -24.44 79.07 Favored 'Trans proline' 0 N--CA 1.479 0.631 0 C-N-CA 122.594 2.196 . . . . 70.120000000000005 112.088 177.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -82.13 10.84 5.98 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.504 -0.771 . . . . 54.509999999999998 111.982 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 51.7 m -73.56 89.31 1.7 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.065 0.459 . . . . 61.439999999999998 111.007 177.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 60.8 tp -85.57 125.1 32.84 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.19 -0.459 . . . . 73.040000000000006 110.861 178.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.6 mm -92.25 -53.92 8.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-O 120.741 0.305 . . . . 72.099999999999994 111.561 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 84.0 p -168.71 152.37 5.51 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 112.194 0.442 . . . . 73.209999999999994 112.194 -178.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.572 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 49.2 mt-10 -105.15 135.65 46.11 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 116.215 -0.448 . . . . 74.549999999999997 110.587 174.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 37.9 m80 -138.41 136.79 19.46 Favored Pre-proline 0 CA--C 1.539 0.534 0 O-C-N 122.394 -0.191 . . . . 75.409999999999997 111.497 179.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -76.57 -4.31 14.85 Favored 'Trans proline' 0 CA--C 1.54 0.824 0 C-N-CA 122.622 2.214 . . . . 73.239999999999995 113.569 -177.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 71.1 p -129.73 144.08 51.12 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.095 0.474 . . . . 74.439999999999998 111.24 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.76 -38.73 86.24 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.239 -0.437 . . . . 73.319999999999993 111.531 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.553 HE21 ' N ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -55.2 -49.32 72.21 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.642 0.258 . . . . 74.219999999999999 111.11 178.335 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.553 ' N ' HE21 ' A' ' 48' ' ' GLN . 10.7 mm-40 -63.28 -35.92 81.96 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 120.936 0.398 . . . . 74.310000000000002 111.664 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.37 -52.91 50.46 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.048 0.452 . . . . 72.540000000000006 111.203 176.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 87.8 mtp -62.09 -37.7 86.07 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 116.012 -0.54 . . . . 74.25 111.347 177.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.461 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 20.2 t70 -61.09 -52.23 65.78 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.874 -0.603 . . . . 64.140000000000001 110.924 178.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.56 -39.94 92.93 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.241 -0.436 . . . . 63.229999999999997 111.398 176.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.423 ' HE2' ' O ' ' A' ' 11' ' ' ALA . 61.0 tttm -56.27 -54.92 39.6 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 120.93 0.395 . . . . 74.150000000000006 111.448 179.35 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 52' ' ' ASP . 22.4 pttm -58.28 -40.81 82.88 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.563 -0.29 . . . . 73.409999999999997 110.328 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 69.5 mtp180 -67.21 -25.69 66.24 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 111.985 0.365 . . . . 71.120000000000005 111.985 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 75.4 t80 -77.02 -29.67 55.45 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 120.909 0.385 . . . . 64.299999999999997 111.509 174.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -102.54 -15.71 16.34 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.445 0.905 . . . . 74.010000000000005 113.445 -177.14 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 . . . . . 0 N--CA 1.475 0.792 0 O-C-N 121.993 -0.442 . . . . 64.319999999999993 112.039 179.225 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.62 0 N-CA-C 110.197 -0.297 . . . . 63.539999999999999 110.197 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.473 ' HB3' ' HG3' ' A' ' 54' ' ' LYS . . . -113.06 166.28 11.57 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.674 0.273 . . . . 74.5 111.009 176.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 22.6 p90 -155.78 143.56 19.67 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.248 0.547 . . . . 72.439999999999998 111.907 177.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 57.1 mt -96.85 111.32 26.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 CA-C-N 115.949 -0.568 . . . . 73.200000000000003 112.277 -175.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 72.4 t -106.26 126.89 61.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 122.518 0.327 . . . . 72.439999999999998 111.188 178.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 61.7 p -87.23 124.12 32.98 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 122.201 -0.312 . . . . 74.019999999999996 111.544 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.501 HD11 ' NE2' ' A' ' 29' ' ' GLN . 43.3 pt -114.63 154.37 16.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 CA-C-O 121.005 0.431 . . . . 75.430000000000007 111.705 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -100.74 109.68 21.72 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.19 -0.459 . . . . 71.420000000000002 111.733 -179.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.474 ' HE2' HD13 ' A' ' 16' ' ' ILE . 67.6 mttm -104.47 177.7 4.77 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 120.756 0.312 . . . . 75.400000000000006 110.285 175.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 88.32 -136.58 13.83 Favored Glycine 0 CA--C 1.527 0.793 0 C-N-CA 120.682 -0.77 . . . . 73.400000000000006 113.721 176.013 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -102.4 160.59 25.89 Favored Pre-proline 0 CA--C 1.54 0.578 0 CA-C-O 120.739 0.305 . . . . 73.129999999999995 111.669 -177.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -60.42 132.44 43.58 Favored 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 122.034 1.823 . . . . 74.329999999999998 111.685 169.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 80.37 -61.49 4.42 Favored Glycine 0 CA--C 1.528 0.864 0 C-N-CA 120.794 -0.717 . . . . 71.129999999999995 112.426 -175.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -87.39 75.8 9.17 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 121.449 0.642 . . . . 72.439999999999998 110.426 174.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 65.4 p -94.46 165.04 12.75 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.608 0.718 . . . . 72.439999999999998 112.632 -177.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 40.4 t -122.2 110.44 27.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-N 115.33 -0.85 . . . . 73.140000000000001 109.58 172.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 59.0 m -78.03 115.57 17.86 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.986 0.422 . . . . 74.450000000000003 111.963 -177.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.402 ' CD1' ' HD2' ' A' ' 18' ' ' LYS . 40.4 m95 -108.44 140.03 42.33 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.084 0.469 . . . . 74.239999999999995 111.561 178.562 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -92.35 114.31 26.82 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.228 -0.442 . . . . 70.510000000000005 110.931 178.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.67 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 76.6 mt-30 -97.84 116.99 31.16 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.341 -0.39 . . . . 74.430000000000007 111.553 178.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 49.8 tp -85.61 103.75 14.72 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 120.768 0.318 . . . . 73.200000000000003 110.183 173.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -103.71 148.24 26.29 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 110.319 -0.252 . . . . 74.140000000000001 110.319 178.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -124.02 149.11 46.44 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 112.139 0.422 . . . . 63.43 112.139 -178.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.595 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 34.4 t70 -66.38 -25.07 66.61 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 113.344 0.868 . . . . 72.319999999999993 113.344 -173.357 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 43.8 m-70 -122.06 142.5 36.68 Favored Pre-proline 0 N--CA 1.475 0.809 0 O-C-N 121.739 -0.601 . . . . 72.329999999999998 111.729 -178.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -74.42 -28.92 7.04 Favored 'Cis proline' 0 C--N 1.359 1.087 0 C-N-CA 124.182 -1.174 . . . . 64.109999999999999 113.385 0.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm -121.21 143.79 38.14 Favored Pre-proline 0 N--CA 1.467 0.408 0 N-CA-C 110.152 -0.314 . . . . 75.0 110.152 174.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.595 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 11.0 Cg_endo -52.36 -31.88 49.3 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.025 2.483 . . . . 72.349999999999994 114.62 -171.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -99.79 20.83 13.45 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 112.618 0.599 . . . . 72.219999999999999 112.618 -177.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 26.7 m -62.18 101.15 0.2 Allowed 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 121.266 0.555 . . . . 42.43 110.975 174.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.414 HD11 ' HB3' ' A' ' 29' ' ' GLN . 50.9 tp -72.41 106.51 4.56 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.764 -0.653 . . . . 73.299999999999997 112.259 -177.287 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 47.3 mm -65.31 -54.29 30.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-N 116.274 -0.421 . . . . 72.519999999999996 111.099 176.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 42.1 t -169.22 149.77 4.22 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 112.043 0.386 . . . . 74.349999999999994 112.043 -178.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.67 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 46.1 mt-10 -103.03 125.12 49.64 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 116.251 -0.431 . . . . 73.340000000000003 110.802 176.493 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 84.7 m-70 -128.2 148.62 68.46 Favored Pre-proline 0 N--CA 1.477 0.905 0 N-CA-C 111.797 0.295 . . . . 75.019999999999996 111.797 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -73.61 -21.25 19.47 Favored 'Trans proline' 0 CA--C 1.544 1.018 0 C-N-CA 122.547 2.165 . . . . 72.549999999999997 113.451 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 33.4 p -118.73 152.36 36.29 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 120.927 0.394 . . . . 73.439999999999998 111.654 179.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.41 -35.21 77.32 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.313 -0.403 . . . . 73.200000000000003 111.394 176.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -53.6 -49.12 68.46 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 120.767 0.318 . . . . 70.430000000000007 111.834 -179.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -58.76 -44.07 90.48 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 120.991 0.424 . . . . 74.140000000000001 111.743 178.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.38 -40.72 85.71 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 116.273 -0.421 . . . . 73.219999999999999 111.77 179.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 65.7 mtt -64.47 -43.22 94.86 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.856 0.36 . . . . 73.099999999999994 110.964 177.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -55.09 -51.1 67.46 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.076 0.465 . . . . 73.109999999999999 110.602 175.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.62 -35.58 78.3 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.011 -0.54 . . . . 71.299999999999997 111.487 179.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.473 ' HG3' ' HB3' ' A' ' 11' ' ' ALA . 63.2 tttm -63.6 -56.02 19.14 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 116.487 -0.324 . . . . 74.200000000000003 111.315 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 11.9 mptt -59.14 -43.72 92.02 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.102 0.477 . . . . 73.409999999999997 111.103 176.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 51.2 ttm-85 -65.85 -30.67 71.32 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.087 -0.506 . . . . 64.510000000000005 111.478 -178.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -67.88 -41.87 82.14 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 116.224 -0.443 . . . . 71.319999999999993 110.96 175.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -77.78 -8.58 58.2 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 112.696 0.628 . . . . 73.439999999999998 112.696 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 38.0 t70 . . . . . 0 CA--C 1.546 0.799 0 CA-C-O 121.014 0.435 . . . . 75.209999999999994 111.189 179.035 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 . . . . . 0 CA--C 1.537 0.464 0 CA-C-O 120.89 0.376 . . . . 75.040000000000006 111.678 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -129.49 158.04 40.33 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.114 -0.494 . . . . 54.219999999999999 111.119 177.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 39.5 p90 -151.37 155.24 38.26 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.099 0.476 . . . . 63.409999999999997 112.004 -177.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 60.1 mt -98.12 128.39 49.6 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 N-CA-C 112.401 0.519 . . . . 73.439999999999998 112.401 -176.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 48.7 t -115.67 141.7 31.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 122.604 0.362 . . . . 75.040000000000006 110.944 176.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 60.8 p -102.1 128.47 48.55 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 121.166 0.508 . . . . 74.439999999999998 112.005 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.517 HD11 ' NE2' ' A' ' 29' ' ' GLN . 41.9 pt -132.72 176.35 9.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-O 121.005 0.431 . . . . 75.439999999999998 111.094 176.674 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.535 ' HB2' ' HB ' ' A' ' 24' ' ' THR . 9.1 pt-20 -137.23 137.96 39.63 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.097 0.475 . . . . 73.439999999999998 111.674 177.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -127.53 164.91 20.92 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.113 -0.494 . . . . 73.25 111.016 179.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.74 -140.16 14.76 Favored Glycine 0 CA--C 1.533 1.18 0 N-CA-C 114.698 0.639 . . . . 73.340000000000003 114.698 175.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -86.1 157.11 57.18 Favored Pre-proline 0 N--CA 1.473 0.687 0 N-CA-C 112.279 0.474 . . . . 75.439999999999998 112.279 -173.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.35 141.4 68.1 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 122.092 1.861 . . . . 73.439999999999998 111.82 174.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.2 -61.75 3.79 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 120.949 -0.643 . . . . 74.25 112.477 -176.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -92.23 71.78 5.34 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 121.277 0.56 . . . . 74.129999999999995 111.099 176.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.535 ' HB ' ' HB2' ' A' ' 17' ' ' GLU . 63.1 p -93.88 159.2 15.29 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.737 -0.665 . . . . 64.340000000000003 111.236 178.883 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 61.0 t -108.98 127.78 65.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-N 116.521 -0.309 . . . . 64.299999999999997 111.028 178.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 37.8 m -76.78 116.11 17.15 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.773 0.32 . . . . 72.439999999999998 111.849 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -112.31 131.08 55.71 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.051 0.453 . . . . 75.329999999999998 111.281 176.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -96.9 114.13 25.72 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.034 0.445 . . . . 74.299999999999997 110.637 177.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.517 ' NE2' HD11 ' A' ' 16' ' ' ILE . 92.5 mt-30 -94.37 119.28 32.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.053 -0.521 . . . . 54.43 111.546 179.429 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.8 tp -83.45 107.36 15.89 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.197 -0.297 . . . . 74.5 110.197 172.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 50.9 mtt180 -111.86 161.31 16.5 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 120.918 0.389 . . . . 71.120000000000005 111.231 179.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -123.25 166.88 14.51 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 120.988 0.423 . . . . 53.420000000000002 111.343 178.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -86.79 -37.71 17.55 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 116.381 -0.372 . . . . 62.149999999999999 111.841 -178.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 43.6 m80 -115.22 147.79 39.29 Favored Pre-proline 0 N--CA 1.475 0.777 0 C-N-CA 122.439 0.296 . . . . 74.200000000000003 111.555 178.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -82.7 -2.19 52.3 Favored 'Cis proline' 0 C--N 1.355 0.918 0 C-N-CA 124.147 -1.189 . . . . 74.540000000000006 112.851 -2.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -140.66 135.54 15.77 Favored Pre-proline 0 N--CA 1.466 0.372 0 CA-C-N 115.742 -0.663 . . . . 64.409999999999997 110.246 177.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -61.73 -20.95 70.98 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 121.939 1.759 . . . . 74.530000000000001 111.687 175.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -80.38 -3.03 48.08 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 115.632 -0.713 . . . . 73.120000000000005 111.629 177.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 42.5 t -60.79 96.61 0.05 OUTLIER 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 121.05 0.452 . . . . 75.129999999999995 112.176 -175.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 64.9 tp -81.39 106.47 13.38 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.067 0.46 . . . . 73.340000000000003 111.062 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.2 mm -71.6 -51.73 30.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 116.386 -0.37 . . . . 73.239999999999995 111.135 179.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 43.2 t -171.53 149.55 2.67 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 116.382 -0.372 . . . . 72.319999999999993 111.747 178.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.473 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 52.0 mt-10 -102.1 141.26 35.22 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 116.452 -0.34 . . . . 74.540000000000006 110.885 177.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 64.2 m80 -144.07 141.22 18.0 Favored Pre-proline 0 CA--C 1.539 0.53 0 O-C-N 122.304 -0.247 . . . . 74.219999999999999 111.269 178.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.49 -12.64 24.95 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 122.431 2.087 . . . . 72.040000000000006 113.156 -178.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 80.3 p -122.58 141.88 51.23 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-O 121.051 0.453 . . . . 73.430000000000007 111.212 177.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.28 -31.84 72.44 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.356 -0.384 . . . . 65.219999999999999 111.696 -179.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.51 -46.98 73.62 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 120.704 0.288 . . . . 70.299999999999997 110.755 177.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -60.92 -39.48 89.58 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.996 0.427 . . . . 74.319999999999993 111.575 175.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.68 -37.89 89.13 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 116.331 -0.395 . . . . 72.140000000000001 111.023 176.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 67.3 mtt -68.44 -51.97 37.81 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.594 -0.276 . . . . 74.310000000000002 111.515 177.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -57.36 -41.35 79.97 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 120.773 0.32 . . . . 70.150000000000006 111.854 178.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.07 -40.19 87.0 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 120.85 0.357 . . . . 61.5 111.132 175.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.426 ' HZ1' ' CD ' ' A' ' 58' ' ' GLU . 52.5 tttp -62.77 -58.64 6.73 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 122.669 0.387 . . . . 71.200000000000003 112.024 178.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -56.45 -36.39 68.97 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 121.207 0.527 . . . . 72.099999999999994 111.655 -179.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 32.5 ttp180 -80.44 -26.5 38.35 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 116.007 -0.542 . . . . 75.109999999999999 111.798 -178.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -81.6 -42.72 19.65 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.752 0.31 . . . . 73.340000000000003 111.537 178.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.426 ' CD ' ' HZ1' ' A' ' 54' ' ' LYS . 55.0 mt-10 -64.42 -9.71 20.1 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 121.491 0.662 . . . . 72.420000000000002 111.155 179.073 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.8 t70 . . . . . 0 CA--C 1.548 0.897 0 CA-C-N 115.406 -0.815 . . . . 61.329999999999998 109.657 171.502 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 . . . . . 0 CA--C 1.537 0.46 0 CA-C-O 120.595 0.236 . . . . 74.109999999999999 111.264 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.526 ' O ' ' HE2' ' A' ' 54' ' ' LYS . . . -106.73 146.31 30.97 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 120.614 0.245 . . . . 73.439999999999998 111.427 179.345 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 40.2 p90 -144.98 153.24 41.29 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.162 0.506 . . . . 74.209999999999994 112.132 179.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.2 mt -96.18 135.21 31.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-N 116.095 -0.502 . . . . 72.239999999999995 111.951 -178.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 95.4 t -123.9 134.56 66.15 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-N 116.143 -0.48 . . . . 75.5 110.897 177.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 65.3 p -96.45 124.96 40.62 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 120.899 0.38 . . . . 74.120000000000005 111.807 -178.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.406 HD11 ' NE2' ' A' ' 29' ' ' GLN . 35.2 pt -126.14 170.79 15.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-N 116.317 -0.401 . . . . 75.400000000000006 111.462 179.22 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -128.49 135.11 49.0 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 116.351 -0.386 . . . . 74.409999999999997 110.858 178.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -122.43 158.11 30.45 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 120.896 0.379 . . . . 75.030000000000001 111.844 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.62 -138.79 14.08 Favored Glycine 0 CA--C 1.529 0.931 0 CA-C-N 116.268 -0.424 . . . . 63.509999999999998 113.966 177.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 54.2 mttp -94.64 155.46 39.43 Favored Pre-proline 0 CA--C 1.541 0.609 0 N-CA-C 111.926 0.343 . . . . 74.140000000000001 111.926 -174.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -52.96 130.3 37.22 Favored 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 122.879 2.386 . . . . 72.540000000000006 113.185 -178.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 77.46 -64.47 3.22 Favored Glycine 0 CA--C 1.523 0.55 0 C-N-CA 121.123 -0.561 . . . . 74.530000000000001 112.822 -178.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -80.93 71.53 7.89 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.272 0.558 . . . . 63.310000000000002 110.942 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 45.6 p -106.6 172.24 6.92 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.429 0.633 . . . . 75.310000000000002 112.201 -176.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 91.1 t -111.25 128.66 67.58 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-N 115.745 -0.662 . . . . 75.129999999999995 109.981 169.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 87.2 m -83.94 115.37 22.27 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.122 0.487 . . . . 74.519999999999996 111.762 -176.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 65.1 m95 -109.07 149.76 28.81 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 116.132 -0.485 . . . . 73.109999999999999 111.612 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -112.94 116.06 29.39 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.237 -0.438 . . . . 72.109999999999999 111.078 -179.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.698 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 85.4 mt-30 -101.02 133.33 45.67 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.297 -0.411 . . . . 75.409999999999997 111.882 -179.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.437 HD12 ' HB2' ' A' ' 11' ' ' ALA . 56.7 tp -91.66 111.35 22.82 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 110.145 -0.317 . . . . 73.150000000000006 110.145 172.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 37.5 mtp180 -115.12 148.67 38.68 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 110.17 -0.307 . . . . 73.540000000000006 110.17 -178.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -115.06 160.81 19.19 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.923 0.712 . . . . 73.519999999999996 112.923 -175.057 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -71.16 -36.0 71.86 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 115.461 -0.79 . . . . 75.219999999999999 112.498 -177.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.478 ' HA ' ' C ' ' A' ' 35' ' ' PRO . 45.6 m-70 -137.45 157.14 74.49 Favored Pre-proline 0 CA--C 1.544 0.724 0 C-N-CA 122.289 0.235 . . . . 74.340000000000003 111.473 -179.365 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.478 ' C ' ' HA ' ' A' ' 34' ' ' HIS . 24.5 Cg_endo -60.47 -47.98 0.18 OUTLIER 'Cis proline' 0 C--N 1.363 1.334 0 C-N-CA 124.906 -0.872 . . . . 72.400000000000006 113.85 2.387 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -112.85 150.12 42.31 Favored Pre-proline 0 CA--C 1.538 0.489 0 CA-C-O 120.466 0.174 . . . . 74.209999999999994 110.702 175.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -65.82 -22.85 56.04 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 122.091 1.86 . . . . 71.25 112.602 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -75.88 -9.32 58.51 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 116.434 -0.348 . . . . 64.430000000000007 111.159 178.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 98.5 p -53.91 116.68 2.67 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 121.407 0.622 . . . . 63.200000000000003 112.267 -176.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 57.8 tp -95.09 117.43 30.17 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.156 -0.474 . . . . 64.129999999999995 111.006 177.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 50.3 mm -78.73 -54.23 12.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-O 120.909 0.385 . . . . 74.530000000000001 110.944 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 36.9 t -168.94 162.14 11.03 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.024 0.44 . . . . 74.040000000000006 111.729 179.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.698 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 40.6 mt-10 -116.85 138.12 51.73 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 116.003 -0.544 . . . . 72.340000000000003 110.887 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 50.4 m80 -143.25 147.27 39.81 Favored Pre-proline 0 N--CA 1.472 0.647 0 CA-C-O 120.597 0.236 . . . . 74.349999999999994 111.102 178.074 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -77.38 -4.37 14.64 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.571 2.181 . . . . 70.219999999999999 113.268 -178.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 31.1 p -128.0 144.4 51.1 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 120.831 0.348 . . . . 74.040000000000006 111.185 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.413 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -66.37 -33.71 76.34 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 120.829 0.347 . . . . 52.130000000000003 111.104 177.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -55.67 -52.13 64.9 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 116.264 -0.425 . . . . 75.030000000000001 111.116 179.331 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -58.32 -41.0 83.57 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.063 0.459 . . . . 74.010000000000005 111.533 177.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.75 -38.65 88.76 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.938 0.399 . . . . 72.439999999999998 111.27 178.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.472 ' O ' ' HG3' ' A' ' 55' ' ' LYS . 66.2 mtt -68.48 -43.51 76.76 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 116.277 -0.42 . . . . 74.200000000000003 110.884 176.344 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -54.68 -44.11 73.07 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.274 0.559 . . . . 74.209999999999994 111.236 177.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.07 -39.16 75.79 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 116.155 -0.475 . . . . 71.140000000000001 111.56 176.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.526 ' HE2' ' O ' ' A' ' 11' ' ' ALA . 62.2 tttm -56.09 -50.09 72.0 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 121.081 0.467 . . . . 75.349999999999994 110.928 177.723 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 51' ' ' MET . 62.7 mttm -61.15 -47.65 85.26 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.983 -0.553 . . . . 72.209999999999994 111.241 179.479 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 41.9 ttp180 -65.69 -25.18 67.21 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 115.969 -0.559 . . . . 73.010000000000005 111.713 -177.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -79.0 -51.58 9.4 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 121.131 0.491 . . . . 72.420000000000002 111.339 176.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.468 ' CD ' ' HZ1' ' A' ' 54' ' ' LYS . 50.7 mt-10 -67.4 -32.43 73.33 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 116.351 -0.386 . . . . 75.409999999999997 111.75 -177.171 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 . . . . . 0 CA--C 1.536 0.432 0 N-CA-C 110.134 -0.321 . . . . 70.140000000000001 110.134 171.252 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.724 0 CA-C-O 121.123 0.487 . . . . 71.209999999999994 111.91 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -138.7 -174.85 3.94 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 116.174 -0.466 . . . . 63.409999999999997 111.7 -179.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -159.56 169.66 23.34 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.92 0.39 . . . . 75.400000000000006 111.325 179.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.9 mt -112.12 139.15 38.11 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 CA-C-O 120.995 0.426 . . . . 74.109999999999999 111.7 179.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.495 HG22 ' HD2' ' A' ' 31' ' ' ARG . 89.3 t -115.62 136.31 52.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 CA-C-N 116.444 -0.344 . . . . 71.519999999999996 110.79 175.863 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 50.7 p -104.09 113.2 26.57 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 112.184 0.439 . . . . 71.239999999999995 112.184 -178.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 38.8 pt -114.06 168.09 6.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 CA-C-N 116.432 -0.349 . . . . 72.450000000000003 110.994 176.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -126.12 134.68 51.27 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 121.218 0.532 . . . . 74.150000000000006 111.611 -177.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -129.15 160.24 33.49 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 116.231 -0.441 . . . . 72.420000000000002 111.294 178.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.52 -137.22 13.13 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 121.132 -0.556 . . . . 63.109999999999999 113.91 177.393 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -87.66 144.28 35.05 Favored Pre-proline 0 N--CA 1.469 0.507 0 O-C-N 122.682 -0.305 . . . . 63.299999999999997 111.64 -176.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -50.81 -43.78 44.81 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 122.987 2.458 . . . . 75.219999999999999 113.685 -177.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.08 -61.23 3.31 Favored Glycine 0 CA--C 1.526 0.725 0 C-N-CA 121.117 -0.564 . . . . 44.509999999999998 112.747 179.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -100.06 84.09 2.8 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.111 0.481 . . . . 64.510000000000005 111.161 178.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 48.2 p -85.69 159.13 19.88 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.405 0.622 . . . . 74.120000000000005 111.936 178.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 57.4 t -109.3 124.11 65.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 CA-C-N 115.899 -0.591 . . . . 74.439999999999998 109.983 173.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 85.8 m -80.91 115.27 20.31 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.11 0.481 . . . . 74.420000000000002 111.643 -178.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 60.7 m95 -105.75 131.25 53.33 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.027 -0.533 . . . . 74.340000000000003 110.999 176.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 51.9 m-85 -97.09 114.18 25.82 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.138 -0.483 . . . . 62.140000000000001 111.087 -178.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.543 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 87.7 mt-30 -91.83 108.81 20.18 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.223 -0.444 . . . . 70.510000000000005 111.186 176.531 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.0 tp -71.1 109.54 5.23 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.026 0.441 . . . . 61.009999999999998 110.434 172.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.495 ' HD2' HG22 ' A' ' 14' ' ' VAL . 58.5 mtt180 -125.17 158.11 34.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.145 0.498 . . . . 74.200000000000003 111.406 -178.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -118.14 157.44 26.92 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.236 -0.438 . . . . 75.109999999999999 110.325 172.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.455 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 29.4 t70 -86.82 -20.12 28.01 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.441 0.638 . . . . 75.340000000000003 110.486 174.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 48.5 m80 -126.65 138.78 33.19 Favored Pre-proline 0 CA--C 1.542 0.644 0 CA-C-N 115.9 -0.591 . . . . 73.439999999999998 110.858 -179.084 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -82.69 -1.34 52.59 Favored 'Cis proline' 0 CA--C 1.542 0.882 0 C-N-CA 124.292 -1.128 . . . . 74.200000000000003 113.417 0.011 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -136.99 142.77 39.68 Favored Pre-proline 0 N--CA 1.469 0.515 0 CA-C-N 116.311 -0.404 . . . . 71.109999999999999 110.409 177.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.455 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 55.6 Cg_endo -71.15 -37.13 6.33 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 122.264 1.976 . . . . 73.200000000000003 112.817 -177.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -89.0 24.44 2.09 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.984 -0.448 . . . . 74.319999999999993 111.725 176.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.9 p -65.26 97.38 0.27 Allowed 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.223 0.535 . . . . 75.099999999999994 110.904 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 37.7 tp -78.85 102.83 8.41 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 120.99 0.424 . . . . 75.019999999999996 111.143 -178.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 39.3 mm -84.33 -47.86 17.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-O 120.983 0.42 . . . . 73.340000000000003 111.205 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 43.7 t -164.3 157.08 17.28 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 116.426 -0.352 . . . . 74.129999999999995 111.945 -178.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.543 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 45.2 mt-10 -130.36 125.03 33.61 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 122.453 0.301 . . . . 75.340000000000003 110.816 176.256 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 33.4 m80 -139.6 146.17 46.71 Favored Pre-proline 0 N--CA 1.473 0.71 0 CA-C-O 120.693 0.283 . . . . 72.200000000000003 111.615 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -76.28 -12.14 19.12 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.573 2.182 . . . . 65.310000000000002 113.411 -176.053 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 32.2 p -118.54 142.89 47.16 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 120.897 0.38 . . . . 71.140000000000001 111.219 178.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.73 -33.21 75.34 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 120.612 0.244 . . . . 71.040000000000006 111.401 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 26.0 tp60 -53.85 -48.17 70.24 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.471 -0.331 . . . . 73.409999999999997 111.505 177.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -62.73 -42.67 99.77 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.889 0.376 . . . . 74.150000000000006 111.545 177.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.58 -43.94 92.27 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.333 -0.394 . . . . 72.129999999999995 111.575 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 90.8 mtp -67.08 -39.21 86.77 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.362 -0.381 . . . . 74.409999999999997 111.399 179.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.408 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 37.9 t70 -63.56 -40.35 96.77 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 120.961 0.41 . . . . 75.349999999999994 111.157 177.405 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -75.49 -32.8 60.68 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 116.132 -0.486 . . . . 61.140000000000001 111.433 177.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.423 ' HZ1' ' CD ' ' A' ' 58' ' ' GLU . 65.4 tttm -59.55 -52.21 66.54 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.471 -0.331 . . . . 72.420000000000002 111.242 179.191 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.408 ' HG2' ' O ' ' A' ' 52' ' ' ASP . 19.3 pttm -58.45 -25.97 62.82 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.383 0.611 . . . . 75.120000000000005 110.985 177.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -78.08 -44.78 25.29 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.8 -0.637 . . . . 74.409999999999997 111.397 -179.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -68.32 -37.03 80.16 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.915 0.388 . . . . 75.310000000000002 111.377 178.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.423 ' CD ' ' HZ1' ' A' ' 54' ' ' LYS . 54.7 mt-10 -78.56 13.87 1.47 Allowed 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.436 -0.347 . . . . 63.140000000000001 111.915 -178.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 16.8 t0 . . . . . 0 CA--C 1.544 0.742 0 N-CA-C 110.118 -0.327 . . . . 71.049999999999997 110.118 175.647 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 . . . . . 0 N--CA 1.472 0.645 0 N-CA-C 112.418 0.525 . . . . 62.229999999999997 112.418 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.51 160.42 21.77 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.086 -0.506 . . . . 74.230000000000004 111.594 178.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 50.6 p90 -142.59 145.38 33.49 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.471 -0.331 . . . . 72.120000000000005 110.819 177.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 62.2 mt -104.01 131.32 53.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-O 121.074 0.464 . . . . 75.420000000000002 111.838 -178.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 63.0 t -116.03 125.49 73.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 CA-C-N 116.246 -0.434 . . . . 51.530000000000001 111.043 177.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 42.9 p -87.19 120.84 28.88 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 120.975 0.417 . . . . 74.200000000000003 111.39 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.448 HD11 ' NE2' ' A' ' 29' ' ' GLN . 35.1 pt -118.08 166.9 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-O 120.863 0.363 . . . . 73.400000000000006 111.348 178.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.435 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 44.0 mt-10 -125.1 114.82 19.56 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.494 -0.321 . . . . 62.229999999999997 110.865 178.486 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -122.45 174.16 7.21 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 116.608 -0.269 . . . . 64.319999999999993 111.661 -177.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.71 -136.89 12.94 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 121.013 -0.613 . . . . 73.129999999999995 112.808 -178.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -79.21 153.91 77.04 Favored Pre-proline 0 CA--C 1.539 0.545 0 O-C-N 122.469 -0.43 . . . . 73.109999999999999 111.22 178.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -57.78 -44.23 42.71 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.396 2.064 . . . . 74.310000000000002 112.474 176.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -82.89 -46.01 6.46 Favored Glycine 0 CA--C 1.528 0.853 0 C-N-CA 121.301 -0.476 . . . . 43.210000000000001 112.839 177.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -96.83 79.5 2.94 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.1 0.476 . . . . 74.430000000000007 111.286 178.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.435 ' HB ' ' HB3' ' A' ' 17' ' ' GLU . 69.3 p -88.23 146.18 25.49 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.969 -0.56 . . . . 74.150000000000006 111.54 178.194 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 54.8 t -109.47 128.6 65.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.917 -0.583 . . . . 73.439999999999998 110.33 174.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 94.6 m -79.21 114.22 17.97 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.135 0.493 . . . . 73.209999999999994 111.082 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -110.07 131.29 55.19 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 116.146 -0.479 . . . . 74.25 111.52 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -93.28 114.21 26.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.834 0.35 . . . . 74.349999999999994 110.538 176.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.805 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 72.9 mt-30 -98.01 113.65 25.56 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.412 -0.358 . . . . 72.219999999999999 111.668 -179.342 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 54.8 tp -79.53 116.72 19.91 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.352 -0.385 . . . . 74.409999999999997 110.513 174.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.414 HH11 ' HD3' ' A' ' 31' ' ' ARG . 51.7 mtt180 -129.26 170.5 13.53 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.869 0.366 . . . . 75.25 111.97 -177.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -136.01 167.09 21.88 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.981 0.42 . . . . 73.519999999999996 111.129 175.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -95.53 -9.74 31.57 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 112.271 0.471 . . . . 74.040000000000006 112.271 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 39.9 m80 -142.81 149.53 50.18 Favored Pre-proline 0 CA--C 1.541 0.606 0 O-C-N 122.357 -0.214 . . . . 73.239999999999995 110.95 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -70.54 -21.98 10.61 Favored 'Cis proline' 0 C--N 1.356 0.95 0 C-N-CA 124.392 -1.087 . . . . 70.430000000000007 113.244 -0.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -118.55 135.28 23.57 Favored Pre-proline 0 N--CA 1.47 0.557 0 CA-C-N 116.705 -0.225 . . . . 73.019999999999996 110.708 176.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.0 -27.21 84.37 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 122.219 1.946 . . . . 64.109999999999999 111.592 174.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -77.77 -2.39 36.09 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 115.2 -0.909 . . . . 74.230000000000004 112.504 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 90.2 p -58.44 110.46 0.98 Allowed 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.271 0.558 . . . . 73.310000000000002 112.327 -173.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 56.4 tp -104.03 114.45 28.71 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.918 -0.583 . . . . 75.209999999999994 110.463 176.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.3 mm -83.64 -53.6 10.91 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 116.288 -0.415 . . . . 74.340000000000003 111.935 -177.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 40.6 t -162.78 157.53 21.64 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.389 0.514 . . . . 70.120000000000005 112.389 -175.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.805 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 37.4 mt-10 -120.96 118.41 29.79 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 116.243 -0.435 . . . . 73.019999999999996 110.753 177.135 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 61.8 m170 -123.49 143.6 41.9 Favored Pre-proline 0 N--CA 1.475 0.791 0 O-C-N 122.375 -0.203 . . . . 74.0 111.278 -178.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -70.1 -22.93 29.85 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 122.632 2.221 . . . . 74.430000000000007 114.13 -176.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.443 ' OG1' ' HB2' ' A' ' 49' ' ' GLU . 59.6 p -120.74 153.78 36.52 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.11 0.481 . . . . 71.510000000000005 111.508 178.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.17 -45.32 70.31 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.262 -0.426 . . . . 73.200000000000003 111.811 -177.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.81 -50.58 70.14 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 120.954 0.407 . . . . 64.319999999999993 110.637 179.346 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.443 ' HB2' ' OG1' ' A' ' 46' ' ' THR . 0.7 OUTLIER -56.28 -39.59 72.92 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 121.357 0.599 . . . . 73.310000000000002 110.45 178.718 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.74 -41.29 75.47 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 116.292 -0.413 . . . . 45.340000000000003 111.857 177.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 85.1 mtp -67.59 -34.67 77.49 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 112.075 0.398 . . . . 73.319999999999993 112.075 -178.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.657 ' HA ' ' HE3' ' A' ' 55' ' ' LYS . 4.6 t70 -64.5 -30.86 71.89 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-O 121.128 0.489 . . . . 75.030000000000001 110.934 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -75.88 -40.3 54.78 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.343 0.592 . . . . 72.430000000000007 110.618 170.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 66.4 tttm -54.84 -47.51 74.06 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 115.563 -0.744 . . . . 75.439999999999998 111.691 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.657 ' HE3' ' HA ' ' A' ' 52' ' ' ASP . 18.6 ptpt -57.71 -38.86 75.98 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 116.558 -0.292 . . . . 74.530000000000001 111.521 179.347 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 80.1 ttt180 -73.79 -26.02 60.42 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 120.821 0.343 . . . . 75.239999999999995 111.798 -178.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -73.33 -51.27 18.08 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 120.854 0.359 . . . . 74.310000000000002 110.999 175.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -73.02 -34.51 66.4 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.241 -0.436 . . . . 72.120000000000005 112.096 -176.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 . . . . . 0 CA--C 1.549 0.906 0 CA-C-N 116.365 -0.38 . . . . 51.130000000000003 111.434 179.198 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.542 ' HA ' ' HG2' ' A' ' 58' ' ' GLU . 13.2 pt-20 . . . . . 0 CA--C 1.539 0.538 0 CA-C-O 120.884 0.374 . . . . 71.430000000000007 110.736 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.443 ' HB2' ' CD2' ' A' ' 57' ' ' TYR . . . -124.29 171.87 9.54 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 120.794 0.33 . . . . 70.420000000000002 111.534 179.259 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 36.9 p90 -147.36 157.62 43.65 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.139 0.495 . . . . 71.310000000000002 111.923 178.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 58.6 mt -100.4 137.26 28.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 CA-C-N 116.073 -0.512 . . . . 74.150000000000006 111.838 -177.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 61.1 t -117.07 127.44 74.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-N 116.163 -0.471 . . . . 74.230000000000004 110.571 177.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 65.1 p -95.06 114.41 26.21 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.017 0.437 . . . . 73.510000000000005 111.861 -178.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.4 pt -121.51 172.18 9.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 121.021 0.439 . . . . 74.239999999999995 111.259 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.404 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 1.6 mp0 -128.91 148.84 50.95 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 120.856 0.36 . . . . 61.149999999999999 111.057 177.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -134.15 166.68 22.21 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-O 120.844 0.354 . . . . 74.420000000000002 111.441 178.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.53 -143.17 16.17 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 121.234 -0.508 . . . . 71.430000000000007 113.734 178.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -81.26 142.93 51.43 Favored Pre-proline 0 N--CA 1.471 0.577 0 O-C-N 122.575 -0.368 . . . . 72.150000000000006 111.636 -178.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -53.44 116.93 3.3 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.371 2.048 . . . . 63.130000000000003 112.365 176.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 97.61 -67.41 0.8 Allowed Glycine 0 CA--C 1.526 0.751 0 C-N-CA 121.249 -0.501 . . . . 61.119999999999997 112.283 -174.37 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -80.95 75.56 7.91 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 121.361 0.6 . . . . 74.430000000000007 110.277 176.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.404 ' HB ' ' HB3' ' A' ' 17' ' ' GLU . 64.7 p -107.84 163.91 12.71 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.596 -0.729 . . . . 61.420000000000002 112.895 -173.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 59.0 t -110.14 127.65 66.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-N 115.489 -0.778 . . . . 74.430000000000007 110.201 171.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 51.4 m -82.26 118.86 23.44 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.402 0.519 . . . . 72.230000000000004 112.402 -175.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 67.7 m95 -110.37 149.42 30.27 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.191 -0.458 . . . . 75.5 111.512 178.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -110.2 114.63 28.27 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.878 0.371 . . . . 74.140000000000001 111.193 178.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.719 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 72.8 mt-30 -95.59 121.57 37.43 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.919 0.39 . . . . 75.140000000000001 111.542 178.23 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.6 tp -83.02 109.89 17.5 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.571 -0.286 . . . . 74.409999999999997 110.322 173.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 53.2 mtt180 -123.4 162.17 23.3 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.448 0.642 . . . . 74.420000000000002 112.184 -178.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -140.83 -179.35 6.01 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.516 -0.765 . . . . 74.040000000000006 110.72 175.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.504 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 20.4 m-20 -103.1 -0.98 29.87 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.203 0.525 . . . . 54.439999999999998 111.209 175.512 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -123.72 129.54 24.79 Favored Pre-proline 0 CA--C 1.544 0.725 0 CA-C-N 116.354 -0.384 . . . . 71.510000000000005 111.066 -178.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -78.76 -14.86 30.23 Favored 'Cis proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.757 -1.351 . . . . 74.5 113.206 -1.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -129.03 143.32 48.31 Favored Pre-proline 0 N--CA 1.472 0.663 0 C-N-CA 122.445 0.298 . . . . 75.219999999999999 111.101 -178.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.504 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 53.8 Cg_exo -54.54 -28.9 57.43 Favored 'Trans proline' 0 CA--C 1.545 1.073 0 C-N-CA 122.338 2.025 . . . . 72.5 113.023 174.26 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -88.98 16.64 6.7 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-O 121.03 0.443 . . . . 63.039999999999999 111.309 177.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 83.1 p -66.52 96.13 0.36 Allowed 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.45 0.643 . . . . 63.240000000000002 111.474 -179.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 56.7 tp -87.26 107.6 18.57 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.071 -0.513 . . . . 73.310000000000002 110.539 176.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 44.0 mm -73.47 -53.96 16.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 120.914 0.388 . . . . 75.239999999999995 111.054 178.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 70.1 m -163.55 149.94 11.87 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 120.953 0.406 . . . . 70.109999999999999 111.691 -178.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.719 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 42.4 mt-10 -108.2 119.22 38.85 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 116.181 -0.463 . . . . 74.5 110.511 174.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . 0.461 ' HB3' ' HB2' ' A' ' 49' ' ' GLU . 37.7 m170 -128.23 151.14 75.8 Favored Pre-proline 0 CA--C 1.543 0.696 0 N-CA-C 112.187 0.439 . . . . 64.409999999999997 112.187 -176.608 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.35 -31.89 8.71 Favored 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 122.857 2.371 . . . . 73.540000000000006 114.358 -176.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.44 ' OG1' ' HG2' ' A' ' 49' ' ' GLU . 43.9 p -115.06 152.05 33.18 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.192 0.52 . . . . 65.25 111.886 -177.266 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.48 -29.94 70.29 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.009 -0.541 . . . . 71.140000000000001 110.758 175.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 25.0 tp60 -59.09 -51.33 70.52 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.475 -0.33 . . . . 63.200000000000003 111.281 175.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.461 ' HB2' ' HB3' ' A' ' 44' ' ' HIS . 78.9 mm-40 -62.96 -30.93 71.96 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.086 0.469 . . . . 54.219999999999999 111.475 178.591 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.89 -47.93 34.49 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.392 -0.367 . . . . 62.439999999999998 111.35 177.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 90.1 mmm -64.59 -43.43 93.87 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 112.307 0.484 . . . . 74.319999999999993 112.307 -178.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.508 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 16.8 t70 -59.31 -51.14 71.24 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.821 0.343 . . . . 73.420000000000002 111.11 -179.343 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.39 -36.45 84.01 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.273 0.559 . . . . 64.150000000000006 111.296 176.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.523 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 43.7 tttp -53.94 -49.96 67.53 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.855 -0.612 . . . . 75.239999999999995 111.469 176.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -65.71 -27.02 68.03 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.231 0.456 . . . . 74.420000000000002 112.231 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.508 ' HG3' ' O ' ' A' ' 52' ' ' ASP . 44.9 mtt180 -72.94 -29.08 62.82 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 120.943 0.402 . . . . 75.040000000000006 111.073 177.259 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.443 ' CD2' ' HB2' ' A' ' 11' ' ' ALA . 89.5 t80 -77.35 -37.05 53.11 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.287 0.565 . . . . 75.439999999999998 110.849 174.125 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.542 ' HG2' ' HA ' ' A' ' 10' ' ' GLU . 56.6 mt-10 -76.97 -25.45 52.8 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.006 -0.543 . . . . 65.150000000000006 111.639 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.1 t70 . . . . . 0 CA--C 1.54 0.571 0 CA-C-O 120.698 0.285 . . . . 62.399999999999999 110.345 175.856 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 . . . . . 0 CA--C 1.537 0.46 0 CA-C-O 120.882 0.372 . . . . 61.219999999999999 110.518 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -93.31 153.84 18.33 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.914 0.388 . . . . 74.450000000000003 110.838 178.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 45.2 p90 -141.09 159.34 42.41 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.188 0.518 . . . . 74.540000000000006 111.569 -179.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 67.2 mt -99.74 138.05 25.33 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-N 115.947 -0.569 . . . . 71.349999999999994 111.511 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 59.2 t -119.95 121.16 65.27 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 122.509 0.323 . . . . 75.430000000000007 110.766 176.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 32.5 p -86.77 112.59 21.84 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.463 0.542 . . . . 75.349999999999994 112.463 -178.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.5 pt -113.92 175.87 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-N 116.296 -0.411 . . . . 73.319999999999993 110.523 175.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -138.53 128.43 25.26 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.125 0.488 . . . . 74.310000000000002 111.44 179.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -115.67 159.9 20.75 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 116.531 -0.304 . . . . 63.43 111.561 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.56 -153.74 19.29 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 121.294 -0.479 . . . . 63.149999999999999 113.845 178.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -79.84 155.49 75.46 Favored Pre-proline 0 CA--C 1.54 0.566 0 O-C-N 122.668 -0.313 . . . . 73.439999999999998 111.294 -176.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -52.97 -37.68 78.66 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 122.487 2.125 . . . . 70.030000000000001 113.002 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -84.69 -48.08 5.11 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 121.106 -0.569 . . . . 74.140000000000001 112.619 175.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -99.46 83.38 2.8 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.224 0.535 . . . . 72.140000000000001 111.691 178.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 75.2 p -99.64 155.89 17.36 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.769 -0.65 . . . . 74.420000000000002 111.457 175.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 48.8 t -116.97 128.08 74.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 CA-C-N 116.089 -0.505 . . . . 74.540000000000006 110.246 174.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 36.1 m -74.44 115.35 13.87 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.762 0.315 . . . . 73.030000000000001 111.444 -179.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 67.3 m95 -113.53 131.08 56.21 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.086 0.469 . . . . 70.319999999999993 111.265 177.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -100.76 114.13 27.62 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.109 -0.496 . . . . 74.010000000000005 110.813 -179.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.458 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 78.0 mt-30 -96.29 120.58 36.85 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.885 0.374 . . . . 75.150000000000006 111.637 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 55.9 tp -83.3 107.48 15.86 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 120.737 0.304 . . . . 72.019999999999996 110.259 175.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 54.4 mtt180 -120.92 166.28 14.03 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.158 0.504 . . . . 72.310000000000002 111.787 -178.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -139.02 158.57 43.96 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.935 -0.575 . . . . 72.200000000000003 111.114 178.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -80.8 -21.72 40.67 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 116.521 -0.309 . . . . 71.319999999999993 111.686 -179.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -112.27 144.3 30.55 Favored Pre-proline 0 CA--C 1.542 0.65 0 N-CA-C 111.573 0.212 . . . . 73.010000000000005 111.573 -177.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -74.67 -28.47 7.44 Favored 'Cis proline' 0 CA--C 1.542 0.881 0 C-N-CA 123.794 -1.336 . . . . 71.439999999999998 112.98 -4.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.412 ' HB3' ' HD2' ' A' ' 37' ' ' PRO . 58.1 mttp -131.23 160.28 67.76 Favored Pre-proline 0 CA--C 1.541 0.603 0 C-N-CA 122.426 0.29 . . . . 73.239999999999995 110.941 176.028 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.412 ' HD2' ' HB3' ' A' ' 36' ' ' LYS . 28.8 Cg_endo -61.43 -7.03 7.84 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 C-N-CA 122.573 2.182 . . . . 71.099999999999994 113.173 177.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -77.79 -7.12 56.15 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.554 -0.294 . . . . 73.030000000000001 111.422 176.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 68.6 m -65.44 92.17 0.13 Allowed 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.523 0.564 . . . . 74.219999999999999 112.523 -175.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 48.7 tp -100.06 105.11 16.73 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.067 -0.515 . . . . 74.099999999999994 109.974 172.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.477 ' N ' HD12 ' A' ' 41' ' ' ILE . 2.3 mp -71.06 -53.87 19.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 CA-C-N 116.383 -0.371 . . . . 62.329999999999998 111.397 -175.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 71.1 p -169.58 149.8 3.98 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.178 0.513 . . . . 70.030000000000001 111.397 -179.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.458 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 45.2 mt-10 -100.56 140.66 34.5 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.274 -0.421 . . . . 75.430000000000007 110.795 177.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 83.0 m-70 -136.74 135.91 20.89 Favored Pre-proline 0 CA--C 1.538 0.516 0 O-C-N 122.219 -0.301 . . . . 72.200000000000003 111.183 -178.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.0 -5.57 16.47 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 122.594 2.196 . . . . 64.409999999999997 113.58 -179.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 35.8 p -136.14 155.08 50.7 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-O 120.933 0.397 . . . . 74.209999999999994 111.345 177.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.55 -41.14 89.13 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.287 -0.415 . . . . 74.219999999999999 111.725 178.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 20.1 tp60 -56.55 -51.68 67.67 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 111.396 0.147 . . . . 74.409999999999997 111.396 177.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -61.39 -29.09 69.71 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 120.93 0.395 . . . . 62.420000000000002 111.82 179.144 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.54 -47.45 40.76 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 120.889 0.376 . . . . 72.319999999999993 111.464 176.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 65.6 mtt -65.89 -35.9 81.92 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.008 0.432 . . . . 73.219999999999999 111.451 178.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -60.52 -49.93 75.58 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.34 0.59 . . . . 64.329999999999998 110.37 176.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.27 -39.32 94.25 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.803 -0.635 . . . . 74.340000000000003 111.758 176.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 44.1 tttp -54.76 -48.55 72.49 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.709 0.29 . . . . 72.140000000000001 111.76 178.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 47.4 mtmt -61.56 -48.75 79.57 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.179 0.514 . . . . 75.010000000000005 111.223 177.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 45.2 mtp180 -65.5 -26.07 67.75 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.944 -0.571 . . . . 74.329999999999998 111.97 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -71.21 -46.95 60.1 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.965 0.412 . . . . 75.140000000000001 111.214 176.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -81.49 -21.64 38.53 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 112.387 0.514 . . . . 63.25 112.387 -178.408 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 . . . . . 0 CA--C 1.544 0.717 0 CA-C-O 120.768 0.318 . . . . 75.409999999999997 111.146 175.154 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 . . . . . 0 N--CA 1.469 0.488 0 CA-C-O 120.886 0.374 . . . . 63.310000000000002 110.849 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -131.61 154.66 48.66 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 116.161 -0.472 . . . . 65.010000000000005 110.706 178.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 13.1 p90 -135.11 146.13 48.54 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.272 0.558 . . . . 72.019999999999996 111.932 -177.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 62.9 mt -91.06 117.35 34.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 115.81 -0.632 . . . . 74.030000000000001 111.359 -177.356 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.523 HG22 ' HD2' ' A' ' 31' ' ' ARG . 61.9 t -105.61 126.63 60.86 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 CA-C-O 120.782 0.325 . . . . 74.510000000000005 111.277 -179.203 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 66.4 p -93.53 115.71 28.22 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 120.763 0.316 . . . . 74.450000000000003 111.228 178.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 42.3 pt -111.69 166.86 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 CA-C-O 121.004 0.431 . . . . 62.340000000000003 111.61 -179.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -115.34 114.98 25.85 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.257 -0.429 . . . . 64.400000000000006 111.787 -177.305 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -108.8 165.12 11.8 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 122.095 -0.378 . . . . 75.150000000000006 110.677 174.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.3 -137.09 13.06 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 121.024 -0.608 . . . . 55.450000000000003 113.652 -179.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -102.17 158.54 31.58 Favored Pre-proline 0 N--CA 1.473 0.684 0 N-CA-C 112.032 0.382 . . . . 75.140000000000001 112.032 -175.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -60.69 124.31 14.76 Favored 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 122.18 1.92 . . . . 71.150000000000006 111.714 173.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 89.27 -47.8 3.35 Favored Glycine 0 CA--C 1.525 0.692 0 C-N-CA 120.859 -0.686 . . . . 71.439999999999998 112.406 -176.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -99.08 79.15 2.31 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.347 0.594 . . . . 74.120000000000005 110.41 175.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 77.6 p -107.84 156.56 19.02 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.684 -0.689 . . . . 60.149999999999999 112.371 -175.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 63.6 t -113.27 132.31 62.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-N 115.639 -0.709 . . . . 72.420000000000002 110.359 175.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 95.0 m -79.73 117.28 20.49 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 120.912 0.387 . . . . 72.150000000000006 111.833 -179.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 76.9 m95 -114.87 131.62 56.79 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 116.377 -0.374 . . . . 75.329999999999998 111.163 175.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -92.81 114.73 27.36 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.946 0.403 . . . . 75.219999999999999 111.131 -178.305 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.634 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 86.0 mt-30 -102.08 130.13 48.58 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.472 -0.331 . . . . 73.109999999999999 111.393 177.447 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.8 tp -87.51 104.51 16.54 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.779 0.323 . . . . 65.430000000000007 110.441 174.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.523 ' HD2' HG22 ' A' ' 14' ' ' VAL . 86.5 mtt180 -111.48 154.72 24.3 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.555 -0.293 . . . . 74.209999999999994 110.953 179.079 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.29 140.25 51.49 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 120.574 0.226 . . . . 74.409999999999997 111.375 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -62.62 -24.54 67.64 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.157 0.429 . . . . 73.25 112.157 -179.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.469 ' HA ' ' C ' ' A' ' 35' ' ' PRO . 83.5 m-70 -122.18 134.22 24.69 Favored Pre-proline 0 CA--C 1.541 0.633 0 O-C-N 122.329 -0.232 . . . . 73.030000000000001 111.154 179.654 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.469 ' C ' ' HA ' ' A' ' 34' ' ' HIS . 22.2 Cg_exo -65.42 -42.12 0.66 Allowed 'Cis proline' 0 C--N 1.358 1.037 0 C-N-CA 124.643 -0.982 . . . . 70.140000000000001 113.709 3.393 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -137.0 145.85 52.27 Favored Pre-proline 0 N--CA 1.471 0.59 0 O-C-N 122.376 -0.202 . . . . 74.239999999999995 110.688 178.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -50.84 -22.0 9.28 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 C-N-CA 122.933 2.422 . . . . 74.430000000000007 113.914 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -84.23 10.89 9.23 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-O 121.052 0.453 . . . . 72.409999999999997 111.677 178.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 66.5 m -81.1 100.31 8.97 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.098 0.475 . . . . 71.209999999999994 111.109 178.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 56.3 tp -87.1 116.52 25.22 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.193 -0.458 . . . . 73.430000000000007 111.366 -179.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 47.8 mm -76.76 -54.87 12.31 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-O 120.663 0.268 . . . . 74.540000000000006 110.835 176.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 64.0 m -165.8 154.1 11.12 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.603 0.361 . . . . 73.319999999999993 111.404 179.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.634 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 50.8 mt-10 -100.31 150.11 22.92 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.03 0.443 . . . . 72.310000000000002 111.448 176.409 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . 0.457 ' ND1' ' HB3' ' A' ' 49' ' ' GLU . 89.7 m-70 -147.08 142.2 16.73 Favored Pre-proline 0 CA--C 1.542 0.649 0 CA-C-N 116.454 -0.339 . . . . 75.299999999999997 111.215 176.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -74.6 -25.09 13.08 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 122.31 2.006 . . . . 73.510000000000005 113.243 177.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 31.2 p -114.9 151.01 34.74 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-O 121.179 0.514 . . . . 75.409999999999997 111.737 -179.311 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.23 -44.25 92.44 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.062 -0.517 . . . . 73.209999999999994 112.303 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 24.0 tp60 -53.45 -42.56 67.27 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 111.744 0.275 . . . . 73.349999999999994 111.744 -179.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.457 ' HB3' ' ND1' ' A' ' 44' ' ' HIS . 47.1 mt-10 -61.31 -43.13 99.39 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.899 0.38 . . . . 74.310000000000002 111.342 176.087 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.08 -43.67 97.9 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.059 0.457 . . . . 74.129999999999995 111.385 178.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 58.6 mtt -63.76 -38.12 89.92 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.336 0.589 . . . . 71.140000000000001 110.958 176.152 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.448 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 34.0 t70 -62.95 -51.85 65.31 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.761 -0.654 . . . . 73.519999999999996 110.971 177.592 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.16 -42.72 86.56 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 116.091 -0.504 . . . . 71.439999999999998 111.443 177.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -55.65 -49.79 71.96 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.243 -0.435 . . . . 73.209999999999994 111.052 175.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 23.5 mtpp -60.06 -28.97 68.23 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.305 -0.407 . . . . 72.219999999999999 112.056 178.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.448 ' HG3' ' O ' ' A' ' 52' ' ' ASP . 72.7 mtt180 -73.58 -40.68 63.71 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 122.062 -0.399 . . . . 62.439999999999998 110.561 176.439 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -63.5 -33.32 75.33 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.341 0.591 . . . . 73.329999999999998 110.523 176.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -80.53 -34.37 35.62 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.909 -0.587 . . . . 74.120000000000005 111.836 176.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 28.3 t70 . . . . . 0 CA--C 1.544 0.717 0 CA-C-O 120.962 0.411 . . . . 65.319999999999993 111.177 -176.006 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 . . . . . 0 N--CA 1.468 0.469 0 CA-C-O 120.89 0.376 . . . . 75.5 111.282 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -145.54 155.05 42.83 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.395 -0.366 . . . . 72.120000000000005 111.012 176.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 40.5 p90 -149.36 161.54 41.87 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.14 0.495 . . . . 75.310000000000002 111.628 -178.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 65.4 mt -101.89 136.86 31.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-O 121.077 0.465 . . . . 74.129999999999995 112.106 -177.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.447 HG23 ' HD2' ' A' ' 31' ' ' ARG . 98.4 t -119.07 126.38 75.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 116.353 -0.385 . . . . 72.319999999999993 110.802 176.391 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 46.8 p -86.64 114.42 23.33 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.587 0.232 . . . . 74.129999999999995 111.615 -179.137 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.5 HD12 ' NE2' ' A' ' 29' ' ' GLN . 37.8 pt -112.83 168.91 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 CA-C-O 121.19 0.519 . . . . 75.340000000000003 111.872 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -114.59 124.84 52.87 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.756 -0.656 . . . . 54.130000000000003 111.416 -179.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -119.25 159.61 23.75 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.764 0.316 . . . . 75.519999999999996 110.932 172.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.26 -146.21 17.6 Favored Glycine 0 CA--C 1.528 0.868 0 C-N-CA 121.314 -0.469 . . . . 65.519999999999996 113.401 -179.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -95.22 148.96 35.5 Favored Pre-proline 0 N--CA 1.471 0.606 0 N-CA-C 112.088 0.403 . . . . 73.340000000000003 112.088 -175.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -56.49 124.35 16.04 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.201 1.934 . . . . 65.120000000000005 112.065 176.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 95.17 -52.79 1.86 Allowed Glycine 0 CA--C 1.527 0.786 0 C-N-CA 121.133 -0.556 . . . . 74.239999999999995 112.384 -174.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 31.4 mm-40 -99.8 64.8 1.28 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.148 0.499 . . . . 73.329999999999998 110.882 176.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 59.9 p -92.05 167.63 11.95 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.376 0.608 . . . . 73.319999999999993 112.43 -175.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 60.8 t -124.34 124.7 69.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 CA-C-N 115.707 -0.679 . . . . 74.439999999999998 109.95 175.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 94.4 m -77.46 114.86 16.73 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.123 0.487 . . . . 60.409999999999997 112.015 -177.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 72.6 m95 -110.58 140.47 44.87 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.926 -0.579 . . . . 74.109999999999999 110.784 175.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -97.74 113.76 25.6 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 120.884 0.373 . . . . 74.0 111.298 -177.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.639 ' HG2' ' HG3' ' A' ' 43' ' ' GLU . 79.4 mt-30 -91.5 125.85 36.39 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.815 0.341 . . . . 74.430000000000007 111.362 177.726 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 60.4 tp -83.25 116.92 22.62 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.664 0.268 . . . . 74.109999999999999 110.495 173.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.447 ' HD2' HG23 ' A' ' 14' ' ' VAL . 99.0 mtt180 -126.94 164.7 20.88 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 120.926 0.393 . . . . 73.310000000000002 111.217 178.214 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -139.82 140.15 36.53 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.504 -0.316 . . . . 74.019999999999996 111.094 176.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.508 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 29.0 t70 -61.05 -38.61 86.78 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.313 0.578 . . . . 71.120000000000005 110.869 177.337 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 -105.96 130.54 22.84 Favored Pre-proline 0 CA--C 1.541 0.611 0 CA-C-N 116.105 -0.498 . . . . 72.019999999999996 110.392 177.09 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -77.45 -34.49 3.27 Favored 'Cis proline' 0 CA--C 1.545 1.033 0 C-N-CA 123.885 -1.298 . . . . 73.430000000000007 114.156 3.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -130.76 130.96 22.99 Favored Pre-proline 0 N--CA 1.474 0.766 0 O-C-N 122.393 -0.192 . . . . 74.510000000000005 110.943 -178.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.508 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 91.2 Cg_exo -45.47 -51.34 8.1 Favored 'Trans proline' 0 CA--C 1.542 0.916 0 C-N-CA 123.419 2.746 . . . . 73.519999999999996 114.49 -174.814 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -79.34 24.67 0.34 Allowed 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 112.703 0.631 . . . . 71.239999999999995 112.703 -177.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 45.2 p -66.6 89.77 0.15 Allowed 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.161 0.505 . . . . 74.530000000000001 111.413 177.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 38.2 tp -72.7 104.1 3.83 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 120.887 0.375 . . . . 64.209999999999994 111.476 178.087 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.3 mm -74.88 -54.1 15.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 116.272 -0.422 . . . . 73.319999999999993 110.754 175.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 29.3 t -175.76 149.87 0.99 Allowed 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 116.351 -0.386 . . . . 53.130000000000003 111.904 -178.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.639 ' HG3' ' HG2' ' A' ' 29' ' ' GLN . 1.9 mp0 -89.39 125.99 35.37 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 116.534 -0.303 . . . . 72.230000000000004 110.381 173.525 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 11.9 m170 -116.52 146.93 38.61 Favored Pre-proline 0 CA--C 1.542 0.638 0 C-N-CA 122.574 0.349 . . . . 61.020000000000003 111.008 179.519 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -67.0 -40.37 11.94 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.827 2.352 . . . . 75.239999999999995 114.173 -173.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.504 ' OG1' ' HB2' ' A' ' 49' ' ' GLU . 29.9 p -120.37 153.51 36.4 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 122.064 -0.398 . . . . 73.209999999999994 111.243 -179.435 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.21 -41.71 79.95 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 120.896 0.379 . . . . 74.310000000000002 111.251 178.02 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.27 -43.75 98.37 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 116.288 -0.415 . . . . 74.019999999999996 110.752 176.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.504 ' HB2' ' OG1' ' A' ' 46' ' ' THR . 0.6 OUTLIER -61.44 -33.1 73.16 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.343 0.592 . . . . 53.399999999999999 110.727 178.524 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.96 -42.76 56.99 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 116.212 -0.449 . . . . 73.030000000000001 111.371 176.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.559 ' SD ' ' HD3' ' A' ' 54' ' ' LYS . 22.2 mmt -57.29 -35.74 70.18 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 116.313 -0.403 . . . . 73.409999999999997 111.753 176.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -54.47 -43.83 72.06 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 116.133 -0.485 . . . . 75.319999999999993 111.088 177.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.08 -40.08 53.94 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.158 0.504 . . . . 72.200000000000003 111.408 175.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.559 ' HD3' ' SD ' ' A' ' 51' ' ' MET . 42.3 tttp -53.89 -49.76 67.84 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 115.872 -0.603 . . . . 75.530000000000001 112.004 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 60.6 mttp -53.7 -57.97 8.9 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 111.844 0.312 . . . . 74.310000000000002 111.844 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 53.0 mtp180 -62.24 -26.4 68.36 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 112.003 0.371 . . . . 64.530000000000001 112.003 -178.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -71.45 -34.47 70.28 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.002 0.43 . . . . 75.409999999999997 110.936 176.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.464 ' CD ' ' HZ2' ' A' ' 54' ' ' LYS . 44.1 mt-10 -86.25 -20.19 28.83 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.086 -0.507 . . . . 70.209999999999994 111.48 179.549 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 . . . . . 0 CA--C 1.543 0.68 0 CA-C-N 116.398 -0.365 . . . . 73.019999999999996 110.855 172.793 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.458 ' HA ' ' HG2' ' A' ' 58' ' ' GLU . 42.1 tt0 . . . . . 0 CA--C 1.539 0.542 0 CA-C-O 120.975 0.417 . . . . 73.030000000000001 111.698 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.434 ' O ' ' NZ ' ' A' ' 54' ' ' LYS . . . -124.89 175.06 7.54 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.049 -0.523 . . . . 72.129999999999995 110.96 177.415 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 41.2 p90 -148.47 153.09 38.0 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.098 0.475 . . . . 74.329999999999998 111.693 177.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 63.5 mt -101.66 135.51 37.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 116.107 -0.497 . . . . 74.329999999999998 111.557 -176.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.41 HG23 ' HD2' ' A' ' 31' ' ' ARG . 61.6 t -119.28 138.71 49.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-N 116.585 -0.28 . . . . 74.129999999999995 111.23 178.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 80.3 p -101.24 117.33 34.77 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 120.522 0.201 . . . . 73.239999999999995 111.506 178.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.489 HD11 ' NE2' ' A' ' 29' ' ' GLN . 42.8 pt -120.11 168.47 12.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-O 120.871 0.367 . . . . 75.349999999999994 111.614 178.573 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.411 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 47.4 mt-10 -116.12 126.87 54.3 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 116.357 -0.383 . . . . 72.530000000000001 111.193 177.233 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.415 ' HE3' HD12 ' A' ' 16' ' ' ILE . 95.1 mttt -130.4 166.63 20.06 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.781 0.325 . . . . 74.540000000000006 111.329 176.039 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.08 -136.88 12.94 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 121.186 -0.531 . . . . 53.450000000000003 113.164 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.403 ' HB2' ' HB2' ' A' ' 23' ' ' GLN . 75.5 mmtt -75.27 147.01 82.39 Favored Pre-proline 0 CA--C 1.539 0.52 0 O-C-N 122.437 -0.449 . . . . 74.430000000000007 111.332 179.093 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_exo -53.06 -46.89 30.73 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 122.781 2.32 . . . . 74.129999999999995 113.076 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -84.33 -52.91 3.42 Favored Glycine 0 CA--C 1.526 0.745 0 C-N-CA 121.118 -0.563 . . . . 73.239999999999995 112.825 175.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.403 ' HB2' ' HB2' ' A' ' 20' ' ' LYS . 32.9 mm-40 -83.81 77.27 9.92 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.119 0.485 . . . . 62.210000000000001 111.032 177.131 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.411 ' HB ' ' HB3' ' A' ' 17' ' ' GLU . 53.0 p -88.4 152.12 22.12 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.182 0.515 . . . . 72.540000000000006 111.745 179.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 58.0 t -114.84 129.4 71.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.033 -0.531 . . . . 74.200000000000003 109.976 174.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 31.2 m -75.36 115.58 15.17 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 120.697 0.284 . . . . 72.540000000000006 111.498 -179.298 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 77.9 m95 -106.58 132.3 52.74 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.053 0.454 . . . . 64.420000000000002 110.877 175.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -97.17 114.5 26.21 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.298 0.57 . . . . 75.400000000000006 111.138 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.728 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 95.5 mt-30 -97.46 122.29 40.33 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.678 -0.692 . . . . 73.030000000000001 111.723 -178.698 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.9 tp -83.24 109.87 17.59 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 120.788 0.328 . . . . 71.420000000000002 110.299 171.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.41 ' HD2' HG23 ' A' ' 14' ' ' VAL . 87.5 mtt-85 -121.41 158.63 27.9 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.053 0.454 . . . . 73.230000000000004 111.728 -178.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -146.01 146.49 31.01 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.241 -0.436 . . . . 73.209999999999994 111.211 178.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.463 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 3.9 m-20 -62.67 -22.6 66.59 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.058 0.456 . . . . 72.049999999999997 111.847 177.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.535 ' HA ' ' C ' ' A' ' 35' ' ' PRO . 35.3 m80 -125.82 141.39 39.18 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-N 116.365 -0.379 . . . . 75.549999999999997 110.52 179.064 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.535 ' C ' ' HA ' ' A' ' 34' ' ' HIS . 31.7 Cg_exo -59.93 -56.62 0.13 OUTLIER 'Cis proline' 0 N--CA 1.49 1.293 0 CA-C-N 119.662 0.915 . . . . 64.530000000000001 114.368 4.135 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -109.68 147.4 36.05 Favored Pre-proline 0 N--CA 1.471 0.576 0 O-C-N 122.231 -0.293 . . . . 73.430000000000007 111.229 179.011 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.463 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 75.9 Cg_exo -50.6 -31.13 30.62 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 122.948 2.432 . . . . 74.150000000000006 113.809 -179.344 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -98.74 20.87 12.25 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 120.839 0.352 . . . . 73.230000000000004 111.682 -179.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.4 t -72.42 107.4 4.97 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.019 0.437 . . . . 73.109999999999999 111.665 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 36.1 tp -92.48 109.82 21.22 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 116.114 -0.493 . . . . 74.510000000000005 111.027 177.051 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.8 mm -73.71 -54.61 14.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 116.115 -0.493 . . . . 74.230000000000004 111.747 -177.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.0 t -164.13 149.46 10.52 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 112.3 0.482 . . . . 71.120000000000005 112.3 -176.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.728 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 88.3 mt-10 -108.93 139.34 43.92 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.277 -0.419 . . . . 71.430000000000007 110.856 175.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 89.6 m-70 -138.77 140.32 26.97 Favored Pre-proline 0 CA--C 1.538 0.503 0 O-C-N 122.3 -0.25 . . . . 75.239999999999995 111.531 178.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -71.86 -24.13 21.47 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 122.458 2.105 . . . . 52.420000000000002 113.517 -179.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 30.4 p -113.07 143.7 43.89 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 121.085 0.469 . . . . 75.299999999999997 111.713 179.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.95 -34.69 73.6 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.053 -0.521 . . . . 73.400000000000006 111.9 177.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.5 -48.96 76.07 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 120.577 0.227 . . . . 72.310000000000002 110.894 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -58.66 -42.5 88.56 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.092 0.472 . . . . 74.450000000000003 111.199 177.424 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.71 -41.25 98.13 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.939 -0.573 . . . . 74.540000000000006 111.726 -179.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 67.1 mtt -65.06 -49.31 70.6 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 120.934 0.397 . . . . 62.310000000000002 111.004 177.379 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.541 ' HA ' ' HE2' ' A' ' 55' ' ' LYS . 11.2 m-20 -57.67 -41.29 81.24 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 121.056 0.455 . . . . 73.049999999999997 111.767 176.161 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.79 -43.42 93.26 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.953 0.406 . . . . 71.409999999999997 111.026 177.339 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.434 ' NZ ' ' O ' ' A' ' 11' ' ' ALA . 59.5 tttp -60.48 -52.43 65.23 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 116.316 -0.402 . . . . 72.049999999999997 111.781 178.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.541 ' HE2' ' HA ' ' A' ' 52' ' ' ASP . 63.7 pttt -64.81 -33.92 77.14 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 120.938 0.399 . . . . 75.129999999999995 111.567 -179.147 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 51.6 ttt180 -77.89 -26.29 49.08 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.948 0.404 . . . . 65.129999999999995 111.001 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -72.27 -43.26 64.55 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.05 0.452 . . . . 75.200000000000003 110.855 175.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.458 ' HG2' ' HA ' ' A' ' 10' ' ' GLU . 81.0 mt-10 -75.6 -33.64 60.56 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.935 -0.575 . . . . 73.400000000000006 111.849 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.5 m-20 . . . . . 0 CA--C 1.544 0.739 0 CA-C-O 120.859 0.362 . . . . 71.319999999999993 111.162 175.729 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 . . . . . 0 N--CA 1.474 0.739 0 CA-C-O 120.674 0.273 . . . . 72.349999999999994 111.318 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.485 ' O ' ' HE2' ' A' ' 54' ' ' LYS . . . -140.95 162.31 35.77 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 120.87 0.367 . . . . 61.130000000000003 111.889 -179.337 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -151.63 149.63 29.35 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.097 0.475 . . . . 75.219999999999999 111.63 178.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 60.2 mt -101.56 134.49 41.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-N 116.35 -0.386 . . . . 74.519999999999996 111.895 -176.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.4 t -129.18 122.85 57.12 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 116.289 -0.414 . . . . 64.519999999999996 110.49 176.062 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 45.9 p -86.91 129.45 34.88 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 120.817 0.341 . . . . 74.099999999999994 111.579 -178.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.506 HD11 ' NE2' ' A' ' 29' ' ' GLN . 43.3 pt -113.33 175.07 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-O 120.955 0.407 . . . . 72.340000000000003 111.423 178.039 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.45 ' HB2' ' HB ' ' A' ' 24' ' ' THR . 9.4 pt-20 -118.16 129.83 55.74 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 121.231 0.538 . . . . 71.109999999999999 111.754 178.905 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -124.97 178.51 5.47 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 116.384 -0.371 . . . . 71.230000000000004 110.933 175.198 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 84.29 -136.79 15.11 Favored Glycine 0 CA--C 1.526 0.733 0 C-N-CA 120.927 -0.654 . . . . 74.519999999999996 114.414 172.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -74.63 150.0 86.38 Favored Pre-proline 0 CA--C 1.542 0.635 0 N-CA-C 112.053 0.39 . . . . 71.450000000000003 112.053 -173.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -58.68 -38.07 91.06 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 122.701 2.267 . . . . 53.409999999999997 112.957 179.087 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -92.3 -52.14 2.25 Favored Glycine 0 CA--C 1.524 0.642 0 C-N-CA 121.173 -0.537 . . . . 71.010000000000005 112.492 177.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -93.35 80.87 4.41 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.493 0.663 . . . . 73.349999999999994 110.818 177.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.45 ' HB ' ' HB2' ' A' ' 17' ' ' GLU . 71.7 p -80.75 151.17 28.96 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.457 -0.792 . . . . 72.239999999999995 111.816 179.602 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 53.7 t -108.54 136.46 44.15 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 CA-C-N 116.176 -0.466 . . . . 72.329999999999998 110.852 -179.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 67.6 m -85.28 120.07 26.35 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.068 0.461 . . . . 73.319999999999993 112.125 -175.468 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 61.6 m95 -119.66 131.62 55.48 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.047 0.451 . . . . 70.409999999999997 111.28 175.286 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -91.57 114.71 27.31 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 116.358 -0.383 . . . . 75.340000000000003 111.187 -178.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.528 ' HG2' ' HG3' ' A' ' 43' ' ' GLU . 72.4 mt-30 -95.82 120.31 35.86 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.562 -0.29 . . . . 74.049999999999997 111.571 177.687 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 55.2 tp -85.67 103.47 14.51 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.872 0.368 . . . . 74.530000000000001 110.426 173.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 55.4 mtt180 -106.5 141.85 37.12 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.464 -0.334 . . . . 72.219999999999999 110.325 178.169 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.41 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . . . -109.6 167.9 9.8 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.808 0.67 . . . . 74.450000000000003 112.808 -173.275 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -77.36 -54.48 6.41 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 115.631 -0.713 . . . . 71.129999999999995 111.98 -176.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.5 ' HB3' ' HA ' ' A' ' 35' ' ' PRO . 60.0 m-70 -123.43 164.05 30.59 Favored Pre-proline 0 CA--C 1.547 0.83 0 C-N-CA 122.597 0.359 . . . . 71.329999999999998 110.929 178.694 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.5 ' HA ' ' HB3' ' A' ' 34' ' ' HIS . 36.8 Cg_endo -64.76 -50.16 0.17 OUTLIER 'Cis proline' 0 C--N 1.362 1.278 0 C-N-CA 124.825 -0.906 . . . . 74.25 113.572 1.158 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -98.6 149.05 35.36 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 122.169 0.188 . . . . 75.030000000000001 110.548 173.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -67.87 -14.9 42.76 Favored 'Trans proline' 0 CA--C 1.537 0.64 0 C-N-CA 122.212 1.942 . . . . 73.030000000000001 112.502 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -88.61 1.05 55.72 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.98 -0.555 . . . . 71.150000000000006 111.874 -179.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 64.0 m -56.78 92.52 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 112.259 0.466 . . . . 72.230000000000004 112.259 -175.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 49.6 tp -83.88 107.23 16.14 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 116.265 -0.425 . . . . 73.420000000000002 110.508 176.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 45.0 mm -69.44 -53.7 23.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 116.312 -0.404 . . . . 64.439999999999998 111.641 -177.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.9 t -175.24 149.64 1.08 Allowed 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 121.038 0.447 . . . . 73.329999999999998 112.01 -179.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.528 ' HG3' ' HG2' ' A' ' 29' ' ' GLN . 2.2 mp0 -100.42 130.81 46.55 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 116.044 -0.525 . . . . 75.040000000000006 110.595 176.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -134.95 147.04 61.13 Favored Pre-proline 0 N--CA 1.473 0.69 0 CA-C-O 120.839 0.352 . . . . 72.430000000000007 111.584 -179.047 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.84 -18.59 19.04 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 122.825 2.35 . . . . 73.340000000000003 114.146 -174.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 30.6 p -116.88 151.67 36.1 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.093 0.473 . . . . 71.319999999999993 111.399 179.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.34 -36.46 74.24 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.302 -0.408 . . . . 74.200000000000003 111.824 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 24.6 tp60 -56.8 -42.02 78.79 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.529 -0.305 . . . . 63.409999999999997 111.767 -177.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -59.23 -51.07 71.55 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 121.094 0.473 . . . . 65.400000000000006 111.35 176.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.07 -37.74 88.52 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.982 -0.553 . . . . 73.319999999999993 111.689 -178.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 95.1 mmm -68.28 -44.83 74.68 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 116.511 -0.313 . . . . 75.209999999999994 111.642 178.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -61.74 -48.58 80.05 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.05 0.452 . . . . 73.519999999999996 110.701 178.022 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.37 -33.84 76.42 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 116.029 -0.532 . . . . 64.019999999999996 111.452 177.073 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.485 ' HE2' ' O ' ' A' ' 11' ' ' ALA . 65.7 tttm -61.82 -57.34 12.22 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.91 0.386 . . . . 75.450000000000003 110.503 175.793 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -55.77 -44.65 77.88 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.205 -0.452 . . . . 71.400000000000006 111.297 178.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -61.11 -44.49 97.27 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.092 -0.504 . . . . 74.209999999999994 111.526 178.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 80.5 t80 -67.04 -38.9 86.67 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 116.373 -0.376 . . . . 75.310000000000002 111.375 179.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.466 ' HG3' ' O ' ' A' ' 54' ' ' LYS . 56.5 mt-10 -72.31 -5.41 35.95 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.371 0.508 . . . . 74.349999999999994 112.371 -176.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 68.4 m-20 . . . . . 0 CA--C 1.544 0.733 0 O-C-N 122.375 -0.203 . . . . 73.400000000000006 110.891 169.213 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 . . . . . 0 N--CA 1.469 0.505 0 CA-C-O 120.574 0.226 . . . . 74.140000000000001 110.439 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.488 ' HB1' ' CD2' ' A' ' 57' ' ' TYR . . . -117.96 167.03 11.81 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.626 0.602 . . . . 72.310000000000002 112.626 -174.808 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 28.5 p90 -147.88 150.47 34.17 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.533 -0.758 . . . . 73.329999999999998 110.883 178.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 55.1 mt -102.2 123.76 55.66 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-O 120.951 0.405 . . . . 73.150000000000006 111.339 -178.264 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.9 t -106.27 124.71 61.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-N 116.457 -0.338 . . . . 73.540000000000006 111.291 179.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 71.0 p -89.87 113.56 25.18 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.895 0.378 . . . . 74.239999999999995 111.285 178.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.444 HD11 ' HE3' ' A' ' 18' ' ' LYS . 30.0 pt -112.95 161.62 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-O 120.66 0.267 . . . . 70.510000000000005 111.337 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -124.14 130.07 51.92 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.165 0.507 . . . . 65.239999999999995 111.264 176.174 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.444 ' HE3' HD11 ' A' ' 16' ' ' ILE . 97.1 mttt -128.53 175.32 8.63 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 120.997 0.427 . . . . 72.340000000000003 111.131 177.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 90.52 -137.93 14.18 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 121.136 -0.554 . . . . 64.420000000000002 113.544 178.141 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -85.86 139.62 35.13 Favored Pre-proline 0 CA--C 1.541 0.599 0 C-N-CA 122.335 0.254 . . . . 75.030000000000001 111.503 -176.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -51.01 -45.33 37.12 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 C-N-CA 122.533 2.155 . . . . 73.400000000000006 112.833 178.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.03 -58.1 6.46 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 120.8 -0.714 . . . . 36.460000000000001 112.158 175.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -98.98 82.92 2.82 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 121.033 0.444 . . . . 72.409999999999997 110.702 179.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 46.0 p -86.12 150.22 24.57 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 116.003 -0.544 . . . . 72.319999999999993 112.202 179.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 47.2 t -111.79 116.33 52.25 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 115.965 -0.561 . . . . 71.120000000000005 110.458 174.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.406 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 94.5 m -81.75 117.95 22.47 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 111.888 0.329 . . . . 75.340000000000003 111.888 -178.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -110.92 131.63 54.89 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 120.88 0.371 . . . . 74.209999999999994 111.351 178.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -90.68 114.35 26.64 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.833 0.349 . . . . 73.030000000000001 110.907 177.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -103.92 120.51 41.17 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.304 -0.407 . . . . 75.040000000000006 111.588 -179.17 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.7 tp -83.32 110.97 18.56 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 120.62 0.248 . . . . 73.439999999999998 110.816 174.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 60.3 mtt180 -123.29 166.44 15.27 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.805 0.336 . . . . 71.310000000000002 110.798 177.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -137.79 171.99 13.62 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.529 -0.305 . . . . 73.25 111.096 178.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -90.2 -14.64 33.04 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.308 0.575 . . . . 71.420000000000002 110.594 175.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.403 ' HA ' ' C ' ' A' ' 35' ' ' PRO . 92.2 m-70 -122.03 130.98 24.5 Favored Pre-proline 0 CA--C 1.546 0.795 0 CA-C-N 116.005 -0.543 . . . . 74.109999999999999 110.261 173.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.403 ' C ' ' HA ' ' A' ' 34' ' ' HIS . 24.7 Cg_exo -64.85 -44.71 0.38 Allowed 'Cis proline' 0 C--N 1.357 0.992 0 C-N-CA 124.479 -1.05 . . . . 71.540000000000006 113.9 0.539 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -137.58 153.64 74.41 Favored Pre-proline 0 N--CA 1.474 0.754 0 C-N-CA 122.04 0.136 . . . . 74.409999999999997 111.058 179.144 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_exo -50.49 -27.28 18.42 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 122.75 2.3 . . . . 75.099999999999994 113.372 175.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -74.67 -23.82 58.7 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 116.131 -0.486 . . . . 54.039999999999999 112.014 178.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 53.0 m -57.52 105.86 0.28 Allowed 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.146 0.498 . . . . 74.430000000000007 112.288 -175.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 49.7 tp -95.3 124.91 39.58 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 115.86 -0.609 . . . . 71.329999999999998 111.229 178.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.1 mm -86.01 -50.88 13.93 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 CA-C-O 120.981 0.419 . . . . 73.409999999999997 111.784 -179.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 29.1 t -168.77 149.02 4.43 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 120.991 0.424 . . . . 64.310000000000002 112.09 -178.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -106.91 140.22 40.08 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.216 -0.447 . . . . 73.409999999999997 110.334 174.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -139.81 151.26 65.33 Favored Pre-proline 0 N--CA 1.471 0.597 0 CA-C-O 120.795 0.331 . . . . 63.450000000000003 111.784 179.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_exo -69.77 -37.22 9.45 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 122.853 2.369 . . . . 75.540000000000006 112.798 177.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 41.9 p -105.35 148.62 26.87 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 121.104 0.478 . . . . 74.540000000000006 111.718 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.444 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -65.79 -31.31 72.21 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.304 -0.407 . . . . 73.439999999999998 111.195 176.002 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 25.7 tp60 -57.16 -49.19 76.74 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 116.485 -0.325 . . . . 73.519999999999996 111.571 179.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -58.78 -43.55 90.44 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.34 0.591 . . . . 73.219999999999999 110.982 175.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.89 -35.21 79.27 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.767 -0.651 . . . . 72.239999999999995 111.497 177.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' MET . . . . . 0.495 ' O ' ' HG3' ' A' ' 55' ' ' LYS . 68.4 mtt -68.2 -42.61 79.61 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.477 -0.329 . . . . 61.299999999999997 111.226 176.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -56.99 -49.27 76.28 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.274 0.559 . . . . 70.329999999999998 110.507 176.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.02 -36.81 85.21 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 115.943 -0.572 . . . . 74.340000000000003 111.54 176.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.7 tttm -61.96 -42.88 99.62 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.078 0.466 . . . . 74.109999999999999 110.606 176.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.495 ' HG3' ' O ' ' A' ' 51' ' ' MET . 95.7 mttt -56.67 -55.1 38.3 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.426 0.632 . . . . 72.230000000000004 109.929 171.729 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 30.1 ttm-85 -60.23 -25.71 65.85 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 115.151 -0.931 . . . . 73.409999999999997 112.544 -174.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.488 ' CD2' ' HB1' ' A' ' 11' ' ' ALA . 90.1 t80 -76.68 -54.42 6.68 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 120.777 0.323 . . . . 71.219999999999999 111.505 176.454 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -74.59 -49.82 20.25 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.674 0.273 . . . . 65.430000000000007 111.246 -179.11 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 . . . . . 0 CA--C 1.537 0.47 0 N-CA-C 109.227 -0.657 . . . . 73.420000000000002 109.227 168.035 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.6 ptt? . . . . . 0 N--CA 1.488 1.469 0 N-CA-C 112.277 0.473 . . . . 71.129999999999995 112.277 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -92.47 150.25 2.94 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.051 2.5 . . . . 75.140000000000001 111.863 170.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.9 t -141.71 130.52 22.95 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.141 0.496 . . . . 71.310000000000002 111.91 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -114.67 109.83 47.5 Favored Pre-proline 0 CA--C 1.538 0.505 0 CA-C-N 116.018 -0.537 . . . . 64.200000000000003 110.661 176.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -71.72 161.45 45.13 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 122.574 2.183 . . . . 75.0 112.847 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.77 -23.75 73.19 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 122.594 2.196 . . . . 71.329999999999998 112.517 177.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -123.15 87.88 51.21 Favored Pre-proline 0 CA--C 1.54 0.591 0 CA-C-N 116.175 -0.466 . . . . 73.319999999999993 110.643 175.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -64.86 160.57 40.36 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 122.977 2.451 . . . . 71.099999999999994 113.914 -177.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.493 ' NH2' ' HB3' ' A' ' 62' ' ' LYS . 15.2 ptm180 -80.73 88.17 5.8 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.639 0.733 . . . . 75.349999999999994 110.956 179.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -124.42 138.89 54.32 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.897 -0.592 . . . . 74.219999999999999 111.798 -177.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -129.05 175.81 8.39 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 116.138 -0.483 . . . . 65.209999999999994 111.655 179.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 41.1 p90 -153.52 179.78 8.49 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 121.095 0.474 . . . . 73.25 111.336 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 58.1 mt -117.96 146.05 23.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-N 116.48 -0.327 . . . . 73.349999999999994 111.497 -177.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 57.4 t -128.09 121.1 55.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 122.546 0.338 . . . . 71.140000000000001 110.947 176.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 77.2 p -87.93 115.32 25.31 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 111.85 0.315 . . . . 72.230000000000004 111.85 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 37.4 pt -121.07 175.59 4.67 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-O 121.204 0.526 . . . . 73.040000000000006 111.772 -179.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.431 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 45.4 mt-10 -125.21 141.55 52.03 Favored 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 116.05 -0.523 . . . . 74.140000000000001 110.801 176.369 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -131.81 175.85 8.85 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.035 0.445 . . . . 74.549999999999997 111.724 178.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.27 -136.72 12.85 Favored Glycine 0 CA--C 1.525 0.687 0 C-N-CA 121.086 -0.578 . . . . 65.329999999999998 113.455 176.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -87.71 146.87 40.08 Favored Pre-proline 0 CA--C 1.538 0.485 0 C-N-CA 122.424 0.29 . . . . 75.409999999999997 111.54 -176.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -53.09 -31.51 54.66 Favored 'Trans proline' 0 C--N 1.354 0.859 0 C-N-CA 122.927 2.418 . . . . 51.420000000000002 113.088 -178.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -96.41 -42.64 3.39 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 121.14 -0.552 . . . . 42.439999999999998 112.709 175.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -99.69 85.24 3.07 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.144 0.497 . . . . 72.430000000000007 111.234 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.431 ' HB ' ' HB3' ' A' ' 17' ' ' GLU . 75.1 p -91.95 152.77 19.87 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 121.178 0.513 . . . . 75.219999999999999 112.349 -179.65 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 61.9 t -121.16 145.67 27.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 CA-C-N 115.902 -0.59 . . . . 64.099999999999994 110.505 176.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 41.7 m -78.5 127.97 32.9 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.256 0.465 . . . . 74.409999999999997 112.256 -176.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 44.4 m95 -132.13 151.21 51.9 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.235 0.54 . . . . 74.439999999999998 111.916 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -118.8 119.12 33.44 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.976 -0.557 . . . . 73.040000000000006 111.498 -179.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -100.58 129.84 46.57 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 120.967 0.413 . . . . 73.310000000000002 111.689 177.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 65.4 tp -88.77 111.72 22.33 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.398 -0.365 . . . . 74.0 110.592 174.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 71.7 mtt-85 -127.24 153.87 45.57 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.707 0.289 . . . . 74.5 110.595 178.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -134.14 145.18 49.04 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.809 0.3 . . . . 72.430000000000007 111.809 -176.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -62.64 -17.35 60.25 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 121.44 0.638 . . . . 71.239999999999995 111.156 176.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 29.6 m80 -120.29 128.81 25.64 Favored Pre-proline 0 CA--C 1.542 0.652 0 CA-C-N 115.736 -0.666 . . . . 70.230000000000004 110.777 -176.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -80.11 -17.6 26.39 Favored 'Cis proline' 0 CA--C 1.541 0.851 0 C-N-CA 123.815 -1.327 . . . . 74.420000000000002 113.276 0.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -143.35 143.34 23.85 Favored Pre-proline 0 N--CA 1.471 0.583 0 C-N-CA 122.439 0.296 . . . . 71.140000000000001 110.822 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -70.37 -8.61 24.02 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 122.513 2.142 . . . . 74.109999999999999 112.981 -174.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -97.1 -0.97 46.18 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 120.911 0.386 . . . . 75.409999999999997 111.229 175.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.6 t -72.64 103.87 3.72 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.103 0.477 . . . . 72.329999999999998 111.667 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 58.4 tp -82.99 122.62 28.54 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.989 -0.55 . . . . 74.140000000000001 110.295 176.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.4 mm -88.42 -54.16 8.36 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-O 120.987 0.423 . . . . 72.040000000000006 111.393 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 44.2 t -159.48 156.69 28.71 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 116.376 -0.375 . . . . 64.319999999999993 111.404 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -119.29 139.31 52.13 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.855 0.359 . . . . 65.420000000000002 111.036 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 48.2 m80 -143.32 143.07 22.88 Favored Pre-proline 0 N--CA 1.472 0.642 0 CA-C-N 116.643 -0.253 . . . . 75.519999999999996 111.377 -179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -75.35 -15.1 20.17 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 122.436 2.091 . . . . 70.140000000000001 113.355 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 44.6 p -116.91 148.69 41.12 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 121.118 0.485 . . . . 71.0 111.992 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.29 -42.71 99.11 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.075 -0.511 . . . . 51.219999999999999 112.165 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.2 tp60 -56.86 -46.42 81.8 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 111.89 0.33 . . . . 72.420000000000002 111.89 -178.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -59.75 -34.22 72.68 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 120.839 0.352 . . . . 75.430000000000007 111.462 177.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.97 -43.98 73.87 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 120.969 0.414 . . . . 73.150000000000006 111.458 178.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 66.2 mtt -65.33 -42.76 92.61 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.256 0.55 . . . . 72.319999999999993 111.311 177.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.42 ' O ' ' HD2' ' A' ' 56' ' ' ARG . 12.8 t70 -63.64 -47.99 79.09 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.919 -0.582 . . . . 73.099999999999994 110.563 178.408 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.57 -39.35 80.03 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.314 -0.403 . . . . 72.430000000000007 111.29 176.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.432 ' HZ3' ' CD ' ' A' ' 58' ' ' GLU . 49.5 tttp -55.11 -44.32 74.87 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.326 -0.397 . . . . 72.129999999999995 110.718 174.361 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -63.1 -41.7 99.44 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 122.327 -0.233 . . . . 74.239999999999995 111.605 175.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.428 ' HA ' ' HE ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -56.27 -32.78 64.85 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 122.194 -0.317 . . . . 73.099999999999994 111.809 176.811 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -77.75 -37.59 48.84 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 111.878 0.325 . . . . 63.399999999999999 111.878 177.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.432 ' CD ' ' HZ3' ' A' ' 54' ' ' LYS . 50.8 mt-10 -92.27 -22.8 19.56 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.084 0.772 . . . . 72.450000000000003 113.084 -172.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -76.05 155.07 84.68 Favored Pre-proline 0 CA--C 1.543 0.681 0 CA-C-O 120.935 0.398 . . . . 73.120000000000005 111.4 179.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -62.75 -6.51 9.25 Favored 'Trans proline' 0 C--N 1.354 0.847 0 C-N-CA 122.737 2.292 . . . . 54.399999999999999 113.507 -178.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -66.87 -36.9 83.36 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 120.7 0.286 . . . . 73.109999999999999 111.23 177.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.493 ' HB3' ' NH2' ' A' ' 9' ' ' ARG . 58.2 tptt -78.16 98.41 5.82 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.164 0.507 . . . . 73.019999999999996 109.862 173.268 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -75.68 168.94 19.07 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.662 -0.699 . . . . 72.299999999999997 112.336 -177.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.414 HD11 ' N ' ' A' ' 64' ' ' LEU . 7.3 mp -63.1 103.55 0.48 Allowed 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 121.038 0.447 . . . . 71.200000000000003 110.765 178.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -96.14 16.72 17.33 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 121.283 0.563 . . . . 73.310000000000002 112.102 -173.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 78.4 m-70 -74.92 119.48 19.16 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.989 -0.444 . . . . 74.120000000000005 109.887 174.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 56.7 m80 -58.41 120.93 9.65 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.476 0.655 . . . . 74.239999999999995 112.574 -175.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 16.4 t-80 -53.25 114.34 1.44 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 114.956 -1.02 . . . . 73.5 112.572 -176.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 66.5 t60 53.86 35.06 20.73 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 116.066 -0.515 . . . . 73.230000000000004 112.05 176.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 72.6 m80 65.97 32.47 8.44 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.006 0.431 . . . . 74.540000000000006 112.15 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 76.6 t60 . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.635 -0.697 . . . . 73.310000000000002 111.146 175.58 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.4 mmm . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 120.709 0.29 . . . . 74.319999999999993 111.102 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -77.2 -9.19 17.73 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.715 2.276 . . . . 75.040000000000006 113.321 -178.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.431 ' O ' HG23 ' A' ' 3' ' ' THR . 9.0 m 66.35 23.19 10.72 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 121.502 0.667 . . . . 54.399999999999999 110.995 178.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 53.5 tttp -140.35 94.62 8.49 Favored Pre-proline 0 CA--C 1.542 0.664 0 CA-C-N 116.373 -0.376 . . . . 74.530000000000001 111.126 -177.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.443 ' HG2' ' HB3' ' A' ' 8' ' ' PRO . 2.8 Cg_endo -84.66 152.23 11.64 Favored 'Trans proline' 0 CA--C 1.544 1.022 0 C-N-CA 123.145 2.564 . . . . 73.319999999999993 112.46 174.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -68.52 -43.45 4.07 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.549 2.166 . . . . 73.109999999999999 113.319 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 60.7 m-85 -137.32 80.69 33.11 Favored Pre-proline 0 N--CA 1.474 0.74 0 CA-C-O 120.973 0.416 . . . . 72.510000000000005 111.53 177.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.443 ' HB3' ' HG2' ' A' ' 5' ' ' PRO . 49.8 Cg_endo -95.82 -0.13 2.22 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 122.999 2.466 . . . . 71.120000000000005 113.47 176.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.498 ' NH2' ' HA ' ' A' ' 58' ' ' GLU . 13.2 ptm180 -174.33 138.78 0.57 Allowed 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.785 0.661 . . . . 74.239999999999995 112.785 -175.645 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -152.78 139.26 18.62 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 122.856 0.462 . . . . 74.150000000000006 110.958 169.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.487 ' O ' ' HE3' ' A' ' 54' ' ' LYS . . . -101.52 143.92 30.91 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 120.725 0.297 . . . . 51.119999999999997 111.339 176.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 49.7 p90 -139.65 144.3 37.57 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 121.181 0.515 . . . . 75.430000000000007 111.725 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 62.3 mt -95.34 140.49 16.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-N 116.153 -0.476 . . . . 71.319999999999993 111.333 -178.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.0 t -122.47 140.52 46.04 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 C-N-CA 122.586 0.354 . . . . 73.099999999999994 111.05 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.4 p -102.86 113.47 26.93 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.036 0.446 . . . . 74.040000000000006 111.942 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.432 HD12 ' NE2' ' A' ' 29' ' ' GLN . 37.4 pt -120.96 176.01 4.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-O 121.103 0.478 . . . . 55.530000000000001 111.702 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.428 ' HB2' ' HB ' ' A' ' 24' ' ' THR . 12.3 pt-20 -142.27 132.11 24.28 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.266 -0.425 . . . . 74.329999999999998 110.836 177.158 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -117.22 161.04 20.12 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-O 120.833 0.349 . . . . 71.340000000000003 111.876 -178.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.19 -147.16 17.19 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 121.471 -0.395 . . . . 64.329999999999998 113.583 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.42 ' O ' HG23 ' A' ' 24' ' ' THR . 94.9 mttt -89.1 151.95 47.5 Favored Pre-proline 0 N--CA 1.473 0.68 0 N-CA-C 112.187 0.44 . . . . 74.510000000000005 112.187 -173.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -53.59 123.09 12.5 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 122.345 2.03 . . . . 72.200000000000003 111.932 175.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.33 -50.84 3.89 Favored Glycine 0 CA--C 1.528 0.883 0 C-N-CA 121.05 -0.595 . . . . 55.009999999999998 112.48 -175.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -95.33 76.75 3.4 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.259 0.552 . . . . 65.430000000000007 110.896 177.311 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.428 ' HB ' ' HB2' ' A' ' 17' ' ' GLU . 33.0 p -118.09 161.42 19.87 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.718 0.636 . . . . 70.25 112.718 -177.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 62.0 t -108.76 130.33 61.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-N 115.793 -0.639 . . . . 74.319999999999993 110.617 178.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.7 m -76.07 115.29 15.63 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 120.774 0.321 . . . . 73.409999999999997 111.737 -178.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 88.7 m95 -117.36 144.3 45.07 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.173 0.511 . . . . 75.209999999999994 111.52 177.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -111.01 115.39 29.39 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.053 -0.521 . . . . 75.420000000000002 110.817 176.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.522 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 91.4 mt-30 -97.49 125.4 42.15 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 120.727 0.298 . . . . 72.140000000000001 111.647 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.7 tp -90.49 115.08 27.36 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 122.281 -0.262 . . . . 70.099999999999994 110.336 173.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 58.3 mtt-85 -122.95 151.61 41.65 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 116.771 -0.195 . . . . 73.209999999999994 110.925 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -122.43 167.74 12.94 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 120.885 0.374 . . . . 71.420000000000002 111.782 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.3 p-10 -85.59 -30.55 23.22 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-O 121.097 0.475 . . . . 74.230000000000004 111.352 178.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -117.29 145.64 36.45 Favored Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 122.89 0.476 . . . . 72.25 110.799 176.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -72.28 -13.99 17.07 Favored 'Cis proline' 0 CA--C 1.543 0.951 0 C-N-CA 124.365 -1.098 . . . . 73.439999999999998 113.516 2.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -151.42 150.73 27.52 Favored Pre-proline 0 CA--C 1.539 0.551 0 CA-C-N 116.558 -0.292 . . . . 74.430000000000007 110.691 177.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -58.98 -24.73 74.61 Favored 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 122.747 2.298 . . . . 74.5 112.918 -178.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -82.68 3.02 30.73 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.741 -0.663 . . . . 72.540000000000006 111.897 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 89.2 p -64.81 105.09 0.93 Allowed 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 121.196 0.522 . . . . 45.340000000000003 111.851 -176.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 54.5 tp -91.92 111.09 22.49 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.169 -0.469 . . . . 73.150000000000006 110.35 175.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 44.7 mm -77.49 -51.81 17.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 CA-C-N 116.356 -0.384 . . . . 72.209999999999994 111.386 -179.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 94.5 p -168.77 159.03 9.46 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.049 0.452 . . . . 62.149999999999999 111.954 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.522 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 45.8 mt-10 -114.79 121.42 43.24 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.961 -0.563 . . . . 72.209999999999994 110.465 175.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -126.59 141.95 41.71 Favored Pre-proline 0 N--CA 1.47 0.574 0 O-C-N 122.081 -0.387 . . . . 75.439999999999998 111.721 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -71.78 -27.08 18.48 Favored 'Trans proline' 0 CA--C 1.542 0.888 0 C-N-CA 122.573 2.182 . . . . 70.450000000000003 113.616 -177.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 28.1 p -106.07 148.14 28.11 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.066 0.46 . . . . 74.219999999999999 111.781 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.441 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -64.14 -31.75 73.06 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.308 -0.406 . . . . 74.530000000000001 111.335 175.252 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 27.9 tp60 -57.01 -54.49 46.14 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 116.465 -0.334 . . . . 74.510000000000005 111.319 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -56.18 -42.45 77.11 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 120.897 0.379 . . . . 72.530000000000001 111.33 177.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.53 -41.68 99.02 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.873 0.368 . . . . 72.150000000000006 111.678 179.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.441 ' HG3' ' O ' ' A' ' 47' ' ' ALA . 66.0 mtt -64.97 -49.11 71.6 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.368 -0.378 . . . . 75.340000000000003 110.944 177.183 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -62.22 -37.62 86.06 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 111.779 0.288 . . . . 73.420000000000002 111.779 178.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.68 -43.36 89.5 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.514 -0.312 . . . . 74.310000000000002 111.048 176.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.487 ' HE3' ' O ' ' A' ' 11' ' ' ALA . 87.6 tttt -61.58 -53.97 49.26 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.466 -0.334 . . . . 73.530000000000001 111.109 176.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -56.9 -45.88 82.32 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.358 -0.383 . . . . 74.230000000000004 111.266 178.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 55.1 ttm-85 -56.74 -44.73 81.99 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.055 0.455 . . . . 71.420000000000002 110.929 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -63.26 -48.38 78.43 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.966 -0.561 . . . . 75.040000000000006 110.577 175.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.498 ' HA ' ' NH2' ' A' ' 9' ' ' ARG . 6.0 mm-40 -76.98 15.41 0.68 Allowed 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.743 0.646 . . . . 72.349999999999994 112.743 -175.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 52.0 m-20 -90.18 132.76 34.95 Favored Pre-proline 0 CA--C 1.537 0.464 0 O-C-N 122.178 -0.326 . . . . 75.010000000000005 110.818 170.103 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -72.05 11.24 0.75 Allowed 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 122.494 2.13 . . . . 74.349999999999994 112.756 177.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -79.33 -34.4 42.24 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 116.127 -0.488 . . . . 72.420000000000002 111.331 178.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -100.25 136.54 39.98 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.177 0.513 . . . . 75.430000000000007 111.627 -178.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -85.79 -172.16 3.96 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.41 0.624 . . . . 72.120000000000005 112.177 -178.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 83.8 mt -71.25 99.78 1.98 Allowed 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.031 -0.531 . . . . 74.239999999999995 111.539 -178.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -63.6 90.85 0.05 Allowed 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.508 0.67 . . . . 75.530000000000001 109.878 175.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 19.5 p-80 -96.53 37.68 1.26 Allowed 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 112.915 0.709 . . . . 75.530000000000001 112.915 -169.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 46.8 t-80 -78.47 99.77 6.58 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.999 0.428 . . . . 74.420000000000002 110.02 173.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -78.34 31.4 0.18 Allowed 'General case' 0 CA--C 1.543 0.701 0 CA-C-O 120.83 0.348 . . . . 74.230000000000004 111.89 -174.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 44.0 t-80 56.57 13.97 1.54 Allowed 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 112.899 0.703 . . . . 74.510000000000005 112.899 -179.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 10.8 t60 -77.73 68.4 3.79 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 109.594 -0.521 . . . . 64.25 109.594 177.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 . . . . . 0 C--O 1.251 1.173 0 CA-C-N 115.481 -0.781 . . . . 73.209999999999994 111.107 -170.642 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.9 ptt? . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 121.087 0.47 . . . . 75.420000000000002 111.214 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -82.27 165.41 16.72 Favored 'Trans proline' 0 CA--C 1.538 0.703 0 C-N-CA 122.633 2.222 . . . . 74.420000000000002 113.071 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 54.3 p -66.88 107.1 2.09 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 120.912 0.386 . . . . 63.100000000000001 110.967 176.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt 59.5 84.73 0.2 Allowed Pre-proline 0 N--CA 1.471 0.616 0 CA-C-N 115.973 -0.558 . . . . 73.409999999999997 111.232 -171.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -68.75 154.37 71.36 Favored 'Trans proline' 0 CA--C 1.541 0.835 0 C-N-CA 122.728 2.285 . . . . 74.0 113.357 -178.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -62.37 169.47 8.01 Favored 'Trans proline' 0 CA--C 1.541 0.828 0 C-N-CA 122.654 2.236 . . . . 75.120000000000005 112.593 173.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 14.9 p90 -118.27 95.23 48.24 Favored Pre-proline 0 CA--C 1.545 0.786 0 CA-C-O 121.089 0.471 . . . . 73.150000000000006 111.943 -177.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -73.12 64.42 4.24 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.861 2.374 . . . . 72.140000000000001 112.133 175.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.426 ' NH2' ' O ' ' A' ' 57' ' ' TYR . 30.7 mtp-105 -98.5 102.93 14.82 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.934 -0.575 . . . . 72.430000000000007 111.545 -176.081 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -145.57 144.88 30.76 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.984 0.421 . . . . 73.230000000000004 111.767 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.445 ' HB1' ' CD2' ' A' ' 57' ' ' TYR . . . -128.78 152.47 48.42 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.981 -0.554 . . . . 72.120000000000005 111.511 179.188 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 33.9 p90 -142.27 168.79 18.91 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 120.856 0.36 . . . . 74.340000000000003 111.745 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 59.6 mt -109.81 136.87 44.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 N-CA-C 112.053 0.39 . . . . 63.43 112.053 -174.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 78.4 t -127.0 131.87 70.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 CA-C-N 116.46 -0.336 . . . . 70.530000000000001 110.731 175.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 68.2 p -89.91 123.05 33.51 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.312 0.486 . . . . 75.340000000000003 112.312 -177.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.47 HD11 ' NE2' ' A' ' 29' ' ' GLN . 37.1 pt -123.0 175.26 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 CA-C-N 116.326 -0.397 . . . . 72.400000000000006 110.495 173.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -134.61 137.89 44.08 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-O 120.935 0.398 . . . . 74.420000000000002 111.959 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 53.1 mttp -124.11 176.76 6.18 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 116.179 -0.464 . . . . 72.329999999999998 110.248 174.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.47 -142.48 15.87 Favored Glycine 0 CA--C 1.529 0.949 0 C-N-CA 121.214 -0.517 . . . . 50.32 113.635 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.599 ' HZ1' ' HB3' ' A' ' 20' ' ' LYS . 9.4 mtpm? -104.01 146.37 32.41 Favored Pre-proline 0 N--CA 1.473 0.722 0 C-N-CA 122.574 0.35 . . . . 74.049999999999997 111.571 -178.34 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_exo -45.51 125.48 7.62 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 122.98 2.453 . . . . 73.239999999999995 113.039 178.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.94 -65.93 3.65 Favored Glycine 0 CA--C 1.525 0.682 0 C-N-CA 120.904 -0.665 . . . . 62.399999999999999 112.237 -175.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -83.05 68.55 9.57 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.284 0.564 . . . . 74.329999999999998 110.652 177.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 71.5 p -103.8 159.62 15.48 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 121.264 0.554 . . . . 74.400000000000006 112.288 -176.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 86.8 t -109.73 127.07 66.83 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-N 115.931 -0.577 . . . . 75.209999999999994 110.178 174.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 59.0 m -79.68 115.59 19.38 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.095 0.474 . . . . 64.420000000000002 111.719 -178.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 73.6 m95 -102.71 132.31 48.93 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.104 -0.498 . . . . 74.109999999999999 110.953 177.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -97.1 114.4 26.06 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.001 0.429 . . . . 73.010000000000005 110.907 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.729 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 92.0 mt-30 -95.3 120.75 36.07 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.123 -0.489 . . . . 73.200000000000003 111.696 -178.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 58.2 tp -85.09 105.3 15.72 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.309 -0.405 . . . . 71.319999999999993 110.418 175.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.458 ' NH2' ' HA ' ' A' ' 38' ' ' ASP . 15.2 mtp-105 -111.49 139.97 46.48 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.336 -0.393 . . . . 74.420000000000002 110.945 -177.307 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -109.86 149.17 30.26 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 120.932 0.396 . . . . 74.420000000000002 111.324 177.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -77.36 -22.76 51.26 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 112.422 0.527 . . . . 75.200000000000003 112.422 -175.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -128.22 148.26 66.97 Favored Pre-proline 0 N--CA 1.472 0.659 0 O-C-N 122.113 -0.367 . . . . 64.340000000000003 111.13 179.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -70.31 -42.28 0.79 Allowed 'Cis proline' 0 C--N 1.359 1.116 0 C-N-CA 124.215 -1.161 . . . . 75.530000000000001 113.32 0.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -103.65 145.8 31.3 Favored Pre-proline 0 N--CA 1.469 0.482 0 N-CA-C 110.293 -0.262 . . . . 74.439999999999998 110.293 175.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -62.85 -6.41 9.22 Favored 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 122.288 1.992 . . . . 74.430000000000007 113.124 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.458 ' HA ' ' NH2' ' A' ' 31' ' ' ARG . 5.5 m-20 -103.9 14.93 29.79 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.098 0.407 . . . . 63.140000000000001 112.098 178.665 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.7 m -65.52 87.27 0.08 Allowed 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.893 0.378 . . . . 74.430000000000007 111.093 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 59.0 tp -72.55 103.06 3.41 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 121.108 0.48 . . . . 74.150000000000006 111.081 178.05 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.2 mm -71.62 -43.36 71.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 CA-C-N 116.202 -0.453 . . . . 72.319999999999993 111.174 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.6 t -174.12 149.54 1.45 Allowed 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 112.069 0.396 . . . . 74.049999999999997 112.069 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.729 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 45.1 mt-10 -108.13 134.22 51.31 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 116.209 -0.451 . . . . 54.520000000000003 110.521 173.052 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 37.9 m80 -136.33 145.07 50.31 Favored Pre-proline 0 CA--C 1.538 0.504 0 O-C-N 122.236 -0.29 . . . . 75.230000000000004 111.311 178.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -73.66 -15.81 24.13 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 122.479 2.119 . . . . 74.129999999999995 112.851 179.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 34.8 p -115.97 142.33 46.93 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 120.936 0.398 . . . . 74.340000000000003 111.372 178.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.462 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -64.15 -35.6 81.3 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 120.967 0.413 . . . . 64.230000000000004 110.855 176.779 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.26 -49.34 72.29 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.282 -0.417 . . . . 73.349999999999994 111.529 178.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -62.49 -38.53 90.25 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 120.881 0.372 . . . . 73.530000000000001 111.126 177.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.32 -40.91 98.62 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 120.93 0.395 . . . . 73.530000000000001 111.221 178.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.462 ' HG3' ' O ' ' A' ' 47' ' ' ALA . 86.8 mtp -69.49 -44.42 71.14 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.018 0.437 . . . . 74.239999999999995 111.329 178.288 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.587 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 12.4 t70 -65.79 -41.68 91.68 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 120.967 0.413 . . . . 70.450000000000003 111.122 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.24 -36.58 84.57 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.019 0.437 . . . . 61.530000000000001 110.773 175.141 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 43.7 tttp -56.9 -49.14 76.46 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 115.986 -0.552 . . . . 73.200000000000003 111.345 175.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.587 ' HG2' ' O ' ' A' ' 52' ' ' ASP . 17.0 pttm -61.59 -43.97 97.88 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 121.084 -0.246 . . . . 71.010000000000005 110.854 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -65.2 -35.36 80.83 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 120.601 0.239 . . . . 72.409999999999997 111.497 -178.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.464 ' HA ' ' HB2' ' A' ' 62' ' ' LYS . 66.6 t80 -64.15 -47.56 79.4 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.867 0.365 . . . . 75.409999999999997 110.895 175.13 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -71.97 -21.57 61.57 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 116.288 -0.415 . . . . 64.400000000000006 111.512 -177.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -64.84 148.93 96.98 Favored Pre-proline 0 CA--C 1.543 0.69 0 N-CA-C 110.371 -0.233 . . . . 71.329999999999998 110.371 167.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -54.49 -14.34 6.94 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 122.608 2.205 . . . . 71.329999999999998 113.276 177.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -57.25 -28.63 63.12 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 112.609 0.596 . . . . 72.129999999999995 112.609 179.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.607 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -119.34 101.14 7.76 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.215 0.82 . . . . 71.510000000000005 113.215 -177.641 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -122.43 108.72 13.52 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 108.806 -0.813 . . . . 71.420000000000002 108.806 167.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 84.4 mt -115.3 40.76 2.61 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.298 0.851 . . . . 64.310000000000002 113.298 -165.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -72.87 85.01 1.24 Allowed 'General case' 0 N--CA 1.468 0.454 0 O-C-N 121.698 -0.626 . . . . 74.099999999999994 111.384 176.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 64.0 t60 -70.45 85.48 0.61 Allowed 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 109.257 -0.646 . . . . 71.420000000000002 109.257 172.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 52.9 t60 -59.87 94.52 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.181 0.515 . . . . 74.409999999999997 111.933 -170.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 39.9 t60 -172.34 91.43 0.11 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.498 -0.774 . . . . 74.0 109.295 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -67.18 86.32 0.15 Allowed 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 112.46 0.541 . . . . 73.329999999999998 112.46 -170.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 38.7 t-80 -77.52 113.16 15.05 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.351 -0.386 . . . . 65.239999999999995 110.524 173.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 26.7 p-80 . . . . . 0 C--O 1.25 1.097 0 CA-C-O 119.19 -0.433 . . . . 74.420000000000002 111.291 177.046 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.595 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.1 mpt? . . . . . 0 N--CA 1.488 1.448 0 CA-C-O 120.319 0.104 . . . . 74.200000000000003 111.059 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_exo -57.48 -56.99 1.41 Allowed 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 122.938 2.425 . . . . 75.239999999999995 113.042 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 90.6 m 63.54 -73.71 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 116.116 -0.493 . . . . 72.299999999999997 111.537 -177.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -100.13 115.03 65.88 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 122.274 0.229 . . . . 72.120000000000005 110.772 176.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -75.94 150.92 34.86 Favored 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 122.644 2.23 . . . . 74.540000000000006 113.119 -177.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -70.31 96.39 0.64 Allowed 'Trans proline' 0 CA--C 1.539 0.725 0 C-N-CA 122.43 2.087 . . . . 73.129999999999995 112.073 176.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -60.94 113.04 6.7 Favored Pre-proline 0 CA--C 1.542 0.656 0 CA-C-N 116.548 -0.297 . . . . 75.239999999999995 110.895 178.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -55.3 110.4 0.54 Allowed 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 122.986 2.457 . . . . 72.109999999999999 114.175 -173.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.578 ' HG3' ' HA ' ' A' ' 58' ' ' GLU . 20.0 tpp180 -86.01 90.49 8.11 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 121.0 0.428 . . . . 75.430000000000007 110.034 174.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -141.36 141.65 33.81 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 112.05 0.389 . . . . 74.319999999999993 112.05 -172.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -138.03 162.07 35.08 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 120.801 0.334 . . . . 72.019999999999996 111.704 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 33.3 p90 -141.68 141.21 33.34 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 121.187 0.517 . . . . 71.409999999999997 111.952 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 62.4 mt -92.81 137.07 23.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-N 116.182 -0.463 . . . . 74.319999999999993 111.836 -177.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 48.2 t -123.65 137.62 56.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 C-N-CA 122.724 0.409 . . . . 74.150000000000006 110.854 177.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 77.8 p -98.07 129.74 44.89 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 112.376 0.51 . . . . 75.150000000000006 112.376 -177.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 41.3 pt -124.5 171.72 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-N 116.293 -0.412 . . . . 74.439999999999998 110.823 177.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -129.66 128.35 42.39 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.011 0.434 . . . . 72.430000000000007 111.909 -178.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -120.44 169.24 10.5 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 116.418 -0.356 . . . . 73.25 110.821 177.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.71 -141.76 15.52 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 120.957 -0.64 . . . . 37.82 114.049 177.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -94.49 141.3 23.28 Favored Pre-proline 0 CA--C 1.541 0.626 0 N-CA-C 111.997 0.369 . . . . 62.130000000000003 111.997 -173.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -55.63 99.6 0.07 OUTLIER 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.583 2.188 . . . . 72.409999999999997 111.935 175.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 116.21 -52.64 0.66 Allowed Glycine 0 CA--C 1.525 0.674 0 N-CA-C 111.537 -0.625 . . . . 43.240000000000002 111.537 -173.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.7 mm-40 -99.41 78.14 2.17 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.124 0.488 . . . . 73.150000000000006 110.67 173.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 81.6 p -105.89 164.73 11.72 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.342 0.592 . . . . 70.319999999999993 112.094 -177.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 61.7 t -121.49 118.43 55.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 115.797 -0.638 . . . . 72.450000000000003 109.633 173.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 87.9 m -76.07 115.33 15.67 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 120.945 0.402 . . . . 71.519999999999996 111.665 -177.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 36.9 m95 -97.37 151.08 20.29 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.079 -0.51 . . . . 74.230000000000004 111.271 177.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -109.67 115.0 29.06 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 116.204 -0.453 . . . . 73.010000000000005 111.34 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.607 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 92.6 mt-30 -98.26 130.21 44.97 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.002 -0.545 . . . . 74.140000000000001 111.041 178.083 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.5 tp -92.95 107.92 19.59 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 120.86 0.362 . . . . 72.329999999999998 111.121 175.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -102.95 163.97 11.89 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 120.917 0.389 . . . . 74.319999999999993 110.48 175.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -144.11 140.63 29.54 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.46 -0.336 . . . . 74.409999999999997 111.466 177.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -63.89 -17.79 63.55 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.014 0.435 . . . . 73.530000000000001 111.737 176.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 48.4 m80 -127.82 133.88 25.6 Favored Pre-proline 0 CA--C 1.544 0.745 0 CA-C-N 116.313 -0.403 . . . . 74.049999999999997 111.339 -174.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -77.96 -53.04 0.16 OUTLIER 'Cis proline' 0 CA--C 1.544 1.018 0 C-N-CA 123.853 -1.311 . . . . 72.549999999999997 113.334 -2.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.42 ' HE2' ' HD2' ' A' ' 37' ' ' PRO . 14.1 mmmm -77.92 141.49 63.63 Favored Pre-proline 0 CA--C 1.54 0.584 0 O-C-N 122.008 -0.433 . . . . 74.129999999999995 110.43 177.067 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.42 ' HD2' ' HE2' ' A' ' 36' ' ' LYS . 14.9 Cg_endo -56.22 -28.11 69.53 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 122.382 2.055 . . . . 75.439999999999998 112.871 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -99.05 22.73 9.92 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 116.558 -0.292 . . . . 72.400000000000006 111.7 177.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.0 t -57.85 94.99 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 121.014 0.435 . . . . 70.209999999999994 111.548 -178.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 58.8 tp -85.41 113.89 22.04 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.175 -0.466 . . . . 74.439999999999998 110.641 178.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.7 mm -81.27 -55.41 8.17 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 CA-C-N 116.61 -0.268 . . . . 72.230000000000004 111.624 -179.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 45.4 m -164.67 155.13 14.36 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-O 120.923 0.392 . . . . 71.420000000000002 111.631 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.607 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 45.2 mt-10 -105.45 139.45 40.06 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.189 -0.46 . . . . 75.530000000000001 110.296 174.271 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . 0.407 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 34.7 m80 -137.06 148.07 61.29 Favored Pre-proline 0 N--CA 1.473 0.702 0 N-CA-C 112.115 0.413 . . . . 74.219999999999999 112.115 179.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 44' ' ' HIS . 22.4 Cg_exo -63.65 -49.41 4.32 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 123.056 2.504 . . . . 73.239999999999995 113.499 178.872 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 34.0 p -101.64 158.97 15.71 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.352 0.596 . . . . 73.310000000000002 112.095 -178.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.42 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -64.68 -40.11 94.82 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.812 -0.631 . . . . 75.420000000000002 111.561 179.008 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.3 tp60 -58.94 -46.04 88.96 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.541 -0.3 . . . . 73.219999999999999 111.407 -178.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -56.36 -42.76 78.32 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 121.401 0.619 . . . . 62.130000000000003 111.001 175.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.88 -38.91 90.02 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.016 -0.538 . . . . 75.340000000000003 111.612 179.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.42 ' HG3' ' O ' ' A' ' 47' ' ' ALA . 73.6 mtp -70.98 -39.63 72.36 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.6 -0.273 . . . . 64.409999999999997 111.556 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.531 ' HA ' ' HD3' ' A' ' 55' ' ' LYS . 13.2 m-20 -59.92 -40.81 90.13 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 120.917 0.389 . . . . 53.229999999999997 111.343 174.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.8 -44.92 91.87 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.976 0.417 . . . . 73.430000000000007 110.942 174.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -56.88 -46.49 81.82 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.083 0.468 . . . . 74.439999999999998 110.896 176.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.531 ' HD3' ' HA ' ' A' ' 52' ' ' ASP . 47.3 mtpt -55.12 -53.94 49.51 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.77 -0.65 . . . . 74.140000000000001 111.174 175.187 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 13.8 mtp180 -56.69 -26.56 56.89 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 111.992 0.367 . . . . 70.099999999999994 111.992 178.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -80.03 -47.15 15.34 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 111.645 0.239 . . . . 75.400000000000006 111.645 176.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.578 ' HA ' ' HG3' ' A' ' 9' ' ' ARG . 48.1 mt-10 -84.17 -16.13 44.58 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.687 0.625 . . . . 72.530000000000001 112.687 -173.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -79.28 161.55 67.31 Favored Pre-proline 0 CA--C 1.541 0.628 0 O-C-N 122.311 -0.243 . . . . 74.209999999999994 110.97 176.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -47.53 88.83 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 122.751 2.3 . . . . 62.229999999999997 114.119 -177.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -68.31 1.07 3.19 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.805 -0.634 . . . . 74.019999999999996 112.176 178.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.58 ' N ' ' HD2' ' A' ' 62' ' ' LYS . 3.4 mptp? -84.1 -9.85 58.27 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 111.892 0.33 . . . . 53.439999999999998 111.892 -178.12 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.526 ' HG2' ' H ' ' A' ' 65' ' ' GLU . 35.6 tt0 -64.72 150.85 46.52 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 120.994 0.426 . . . . 63.43 111.364 179.049 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.421 ' N ' HD23 ' A' ' 64' ' ' LEU . 2.9 mm? -70.74 -42.37 70.61 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.403 -0.362 . . . . 74.439999999999998 111.04 176.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.526 ' H ' ' HG2' ' A' ' 63' ' ' GLU . 71.7 tt0 68.46 -9.32 0.53 Allowed 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.316 0.646 . . . . 73.219999999999999 112.259 -178.386 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.411 ' H ' ' C ' ' A' ' 64' ' ' LEU . 50.8 t-80 -80.05 129.37 34.44 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 122.106 -0.371 . . . . 71.200000000000003 110.383 176.371 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 47.4 t-80 71.62 -48.83 0.68 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.342 0.657 . . . . 74.150000000000006 111.663 -175.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 49.8 t-80 -64.55 88.38 0.06 Allowed 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.033 0.444 . . . . 74.0 110.826 174.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 35.6 p-80 -74.87 136.27 41.52 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.993 0.425 . . . . 75.510000000000005 112.004 -176.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 9.3 p-80 -86.76 -12.96 46.61 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 120.813 0.34 . . . . 71.209999999999994 111.306 177.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 73.2 t60 . . . . . 0 C--O 1.253 1.268 0 CA-C-O 118.641 -0.695 . . . . 73.400000000000006 110.999 176.998 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.4 ptm . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 120.434 0.159 . . . . 70.040000000000006 111.269 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -65.69 133.92 35.98 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 122.404 2.069 . . . . 73.120000000000005 112.394 173.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 63.5 p -86.83 17.1 4.24 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-O 120.885 0.374 . . . . 74.209999999999994 111.009 178.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 51.8 tptt -60.95 111.08 3.59 Favored Pre-proline 0 CA--C 1.544 0.726 0 CA-C-N 115.925 -0.579 . . . . 73.519999999999996 112.545 -174.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -89.57 157.38 5.3 Favored 'Trans proline' 0 CA--C 1.546 1.091 0 C-N-CA 122.931 2.421 . . . . 72.420000000000002 112.907 177.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -69.1 151.79 72.79 Favored 'Trans proline' 0 CA--C 1.542 0.897 0 C-N-CA 122.662 2.241 . . . . 65.310000000000002 112.555 174.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 25.5 p90 -114.07 147.36 37.66 Favored Pre-proline 0 CA--C 1.542 0.654 0 CA-C-N 116.724 -0.216 . . . . 74.340000000000003 111.374 178.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -58.83 121.73 10.44 Favored 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 122.962 2.441 . . . . 71.030000000000001 114.166 -177.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.442 ' NH2' ' O ' ' A' ' 57' ' ' TYR . 0.0 OUTLIER -137.36 80.69 1.82 Allowed 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.186 0.517 . . . . 74.420000000000002 111.119 176.715 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -88.28 164.64 15.5 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.94 -0.573 . . . . 74.420000000000002 111.62 -177.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.568 ' HA ' ' HA ' ' A' ' 32' ' ' ALA . . . -131.72 156.87 45.16 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 116.156 -0.474 . . . . 74.25 111.663 176.864 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 55.5 p90 -149.22 169.56 20.48 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 121.04 0.448 . . . . 74.140000000000001 111.63 178.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 69.2 mt -113.04 130.12 67.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 N-CA-C 112.238 0.458 . . . . 72.319999999999993 112.238 -175.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.479 HG22 ' HD2' ' A' ' 31' ' ' ARG . 60.1 t -111.5 124.59 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-N 116.395 -0.366 . . . . 75.420000000000002 111.083 177.376 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 68.2 p -90.2 113.0 24.71 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 122.029 -0.419 . . . . 75.310000000000002 111.986 -178.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.428 HD13 ' NE2' ' A' ' 29' ' ' GLN . 32.4 pt -115.87 160.06 15.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 120.64 0.257 . . . . 75.540000000000006 111.101 176.697 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -124.39 121.61 35.4 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.131 0.491 . . . . 75.5 111.266 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.438 ' HZ1' ' HB3' ' A' ' 18' ' ' LYS . 5.3 mtpm? -118.0 175.28 5.75 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 116.011 -0.541 . . . . 74.239999999999995 110.678 -178.007 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.29 -136.88 12.94 Favored Glycine 0 CA--C 1.526 0.733 0 C-N-CA 120.564 -0.827 . . . . 62.43 113.62 177.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.57 ' HD2' ' N ' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -96.28 156.45 36.92 Favored Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 122.526 0.33 . . . . 71.129999999999995 111.47 -175.16 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -56.38 123.28 13.47 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.686 2.257 . . . . 61.119999999999997 112.424 174.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 80.38 -60.73 4.5 Favored Glycine 0 CA--C 1.526 0.746 0 C-N-CA 120.88 -0.676 . . . . 74.129999999999995 112.494 -176.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -80.15 73.5 6.97 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.514 0.673 . . . . 64.420000000000002 110.628 176.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 78.2 p -100.01 167.96 10.16 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.558 -0.746 . . . . 75.420000000000002 112.638 -175.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 59.2 t -118.36 126.06 74.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.241 -0.89 . . . . 70.140000000000001 109.455 170.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 35.5 m -81.13 114.67 20.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.917 0.389 . . . . 70.439999999999998 110.866 -179.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -108.88 131.0 55.44 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.094 0.473 . . . . 75.450000000000003 110.847 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -98.1 114.27 26.41 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 116.361 -0.381 . . . . 74.209999999999994 110.953 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.458 ' HB2' ' HB ' ' A' ' 14' ' ' VAL . 68.8 mt-30 -88.6 117.78 27.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.369 -0.378 . . . . 75.310000000000002 111.645 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.6 tp -81.16 103.94 11.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.914 0.388 . . . . 72.310000000000002 110.195 173.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.479 ' HD2' HG22 ' A' ' 14' ' ' VAL . 58.8 mtt180 -114.27 171.41 7.63 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.518 -0.31 . . . . 74.209999999999994 110.752 178.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.568 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . . . -126.77 150.59 49.04 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.117 0.484 . . . . 75.329999999999998 111.865 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -72.17 -25.31 61.64 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.168 0.509 . . . . 72.420000000000002 111.43 175.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -132.45 141.83 42.7 Favored Pre-proline 0 CA--C 1.544 0.745 0 CA-C-N 116.2 -0.454 . . . . 73.400000000000006 111.105 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -77.17 -30.36 6.04 Favored 'Cis proline' 0 C--N 1.355 0.872 0 C-N-CA 124.068 -1.221 . . . . 73.129999999999995 113.31 0.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -124.53 143.73 44.11 Favored Pre-proline 0 CA--C 1.54 0.584 0 CA-C-O 120.568 0.223 . . . . 74.230000000000004 111.532 -176.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -55.26 -27.78 58.84 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.718 2.278 . . . . 74.439999999999998 113.22 177.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -92.9 13.44 20.49 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.098 0.407 . . . . 75.310000000000002 112.098 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.7 m -68.4 83.84 0.26 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.159 0.504 . . . . 75.219999999999999 110.336 174.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 58.1 tp -82.94 122.32 28.12 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 116.015 -0.539 . . . . 72.109999999999999 111.772 -177.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 45.9 mm -87.67 -49.98 14.11 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-N 116.284 -0.416 . . . . 74.049999999999997 111.495 179.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.7 t -172.74 148.79 1.93 Allowed 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 111.851 0.315 . . . . 75.299999999999997 111.851 -177.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -103.61 133.55 48.44 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.027 0.441 . . . . 73.140000000000001 110.856 175.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . 0.539 ' HB3' ' HB3' ' A' ' 49' ' ' GLU . 45.0 m-70 -128.63 143.53 48.76 Favored Pre-proline 0 N--CA 1.47 0.542 0 O-C-N 122.287 -0.258 . . . . 75.540000000000006 111.473 -178.011 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -71.87 -26.93 18.33 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 C-N-CA 122.827 2.351 . . . . 74.329999999999998 114.492 -174.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 25.6 p -114.47 151.18 33.65 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.85 -0.531 . . . . 74.549999999999997 111.964 -178.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.04 -39.71 86.87 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.196 -0.456 . . . . 70.0 111.62 177.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.9 tp60 -61.77 -42.58 99.17 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 120.665 0.269 . . . . 75.140000000000001 110.942 178.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.539 ' HB3' ' HB3' ' A' ' 44' ' ' HIS . 12.0 mm-40 -56.24 -47.06 79.25 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.993 0.425 . . . . 65.540000000000006 111.355 174.393 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.82 -50.91 69.1 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.136 -0.484 . . . . 64.129999999999995 111.959 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 93.5 mmm -63.15 -39.38 94.49 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 111.894 0.331 . . . . 73.430000000000007 111.894 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.44 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 32.8 t70 -64.06 -49.69 71.33 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.952 0.406 . . . . 74.299999999999997 110.844 179.51 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.23 -37.71 86.43 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.1 0.476 . . . . 73.530000000000001 111.306 175.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.7 tttm -56.01 -47.47 77.73 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.027 -0.533 . . . . 65.409999999999997 111.264 177.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -58.98 -43.76 91.46 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.025 0.441 . . . . 75.140000000000001 111.482 176.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.44 ' HG3' ' O ' ' A' ' 52' ' ' ASP . 51.5 mtt-85 -62.27 -32.97 73.75 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.167 -0.47 . . . . 74.319999999999993 111.359 -179.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.447 ' CD2' ' HB1' ' A' ' 11' ' ' ALA . 57.2 t80 -76.89 -44.08 33.27 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.442 -0.345 . . . . 72.510000000000005 111.775 177.451 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -80.18 5.75 13.63 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.517 0.562 . . . . 75.129999999999995 112.517 -175.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -62.19 135.84 95.18 Favored Pre-proline 0 CA--C 1.547 0.83 0 N-CA-C 109.532 -0.544 . . . . 63.420000000000002 109.532 174.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_exo -37.75 -60.35 0.44 Allowed 'Trans proline' 0 CA--C 1.543 0.975 0 C-N-CA 123.735 2.957 . . . . 75.340000000000003 115.16 -172.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -149.33 23.35 0.92 Allowed 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.967 0.728 . . . . 70.409999999999997 112.967 -177.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.507 ' HB2' ' NZ ' ' A' ' 62' ' ' LYS . 3.5 ttmp? -63.81 135.18 56.42 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.931 0.396 . . . . 74.409999999999997 111.709 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -100.2 105.53 17.12 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.319 -0.4 . . . . 65.310000000000002 111.51 -178.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 88.0 mt -67.98 -25.43 65.42 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.488 0.661 . . . . 75.319999999999993 110.265 173.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -145.31 163.12 35.49 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.004 -0.998 . . . . 64.25 109.741 171.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 33.5 m80 -69.85 119.81 14.64 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.063 0.459 . . . . 74.099999999999994 112.063 -174.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 31.4 p-80 -57.59 138.77 54.92 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 116.223 -0.444 . . . . 71.400000000000006 111.304 178.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 19.2 p-80 -137.16 150.02 47.65 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.309 -0.405 . . . . 74.519999999999996 111.561 -176.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 43.0 t-80 -63.01 -68.41 0.34 Allowed 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 112.915 0.709 . . . . 72.349999999999994 112.915 -174.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 -158.94 157.81 32.1 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.132 0.492 . . . . 74.230000000000004 111.71 -175.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 82.8 t60 . . . . . 0 C--O 1.245 0.867 0 CA-C-O 118.54 -0.743 . . . . 75.120000000000005 110.814 172.148 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.6 mtm . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 120.453 0.168 . . . . 65.409999999999997 110.928 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -61.9 108.67 0.68 Allowed 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 122.61 2.207 . . . . 73.319999999999993 113.449 -176.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 48.1 p -103.49 -57.21 2.07 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.142 0.496 . . . . 71.409999999999997 111.175 178.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.753 ' HB2' ' HZ3' ' A' ' 4' ' ' LYS . 0.2 OUTLIER -102.55 102.09 23.97 Favored Pre-proline 0 N--CA 1.471 0.578 0 CA-C-N 116.224 -0.444 . . . . 72.329999999999998 110.576 175.47 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -93.43 163.54 2.4 Favored 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 123.012 2.474 . . . . 72.010000000000005 113.161 178.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -67.09 130.75 23.53 Favored 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 122.356 2.037 . . . . 75.109999999999999 111.496 171.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 -57.41 144.68 70.71 Favored Pre-proline 0 CA--C 1.542 0.661 0 N-CA-C 111.944 0.35 . . . . 74.409999999999997 111.944 -177.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -59.57 171.62 2.52 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 122.954 2.436 . . . . 72.439999999999998 113.51 -178.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.712 ' HB2' ' HA ' ' A' ' 58' ' ' GLU . 18.1 ptp180 -121.45 7.21 10.09 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.466 0.913 . . . . 73.040000000000006 113.466 -168.235 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -95.2 143.05 26.93 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-O 121.487 0.661 . . . . 75.310000000000002 112.489 -170.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.418 ' HB2' ' O ' ' A' ' 31' ' ' ARG . . . -139.31 -174.8 3.97 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.53 -0.759 . . . . 74.420000000000002 111.048 -177.803 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -152.33 145.72 24.8 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.066 0.46 . . . . 71.019999999999996 111.605 178.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 70.2 mt -101.56 131.09 50.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-N 116.348 -0.387 . . . . 73.530000000000001 111.417 -179.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 59.9 t -105.84 127.31 60.96 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-N 116.394 -0.366 . . . . 73.209999999999994 111.05 177.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.6 p -91.29 112.68 24.69 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.741 0.305 . . . . 71.510000000000005 111.712 -178.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.459 HD13 ' HE3' ' A' ' 18' ' ' LYS . 29.3 pt -115.77 170.53 5.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 116.476 -0.329 . . . . 73.400000000000006 110.97 177.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.426 ' HB2' ' HB ' ' A' ' 24' ' ' THR . 9.9 pt-20 -133.17 126.47 31.72 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.442 0.639 . . . . 74.439999999999998 111.58 176.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.459 ' HE3' HD13 ' A' ' 16' ' ' ILE . 98.5 mttt -114.61 178.15 4.39 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.848 -0.614 . . . . 71.349999999999994 111.203 -178.171 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.32 -136.93 12.96 Favored Glycine 0 CA--C 1.527 0.811 0 C-N-CA 121.107 -0.568 . . . . 70.140000000000001 113.309 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 48.7 mmtm -119.18 154.23 53.54 Favored Pre-proline 0 CA--C 1.539 0.537 0 O-C-N 122.663 -0.316 . . . . 74.010000000000005 111.337 -178.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -49.09 127.5 17.47 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 122.609 2.206 . . . . 74.340000000000003 112.76 176.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.51 -51.91 3.35 Favored Glycine 0 CA--C 1.526 0.758 0 C-N-CA 120.942 -0.647 . . . . 74.319999999999993 112.369 -175.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -99.66 74.32 1.86 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.871 0.367 . . . . 70.310000000000002 111.08 177.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.426 ' HB ' ' HB2' ' A' ' 17' ' ' GLU . 76.9 p -103.08 145.64 29.6 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.384 0.611 . . . . 74.530000000000001 112.156 -178.452 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 54.0 t -108.93 124.88 65.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 CA-C-N 115.801 -0.636 . . . . 64.219999999999999 110.176 174.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.2 m -75.31 115.55 15.07 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.629 0.252 . . . . 73.299999999999997 111.238 -178.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 82.0 m95 -108.51 132.8 53.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.267 0.556 . . . . 73.319999999999993 111.235 177.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -99.28 115.03 28.22 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.976 -0.556 . . . . 75.200000000000003 110.858 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.466 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 83.9 mt-30 -98.44 114.65 27.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.086 -0.506 . . . . 64.010000000000005 111.552 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 60.6 tp -79.22 111.3 15.31 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.858 0.361 . . . . 71.540000000000006 110.572 176.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.418 ' O ' ' HB2' ' A' ' 11' ' ' ALA . 66.8 mtt180 -118.76 169.25 10.0 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.675 0.274 . . . . 73.409999999999997 110.885 178.185 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -140.66 143.91 35.39 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.93 0.395 . . . . 71.540000000000006 111.711 -178.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -68.75 -20.17 64.36 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 116.189 -0.46 . . . . 64.310000000000002 111.975 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 70.8 m80 -119.49 133.64 23.8 Favored Pre-proline 0 CA--C 1.543 0.681 0 CA-C-N 116.245 -0.434 . . . . 72.120000000000005 111.24 -176.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -80.18 -24.13 12.91 Favored 'Cis proline' 0 CA--C 1.539 0.766 0 C-N-CA 123.877 -1.301 . . . . 72.030000000000001 113.103 -0.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -131.68 129.5 22.07 Favored Pre-proline 0 N--CA 1.47 0.546 0 CA-C-N 116.615 -0.266 . . . . 74.329999999999998 110.995 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -67.72 7.74 0.53 Allowed 'Trans proline' 0 CA--C 1.544 0.993 0 C-N-CA 122.643 2.229 . . . . 73.420000000000002 113.445 -179.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.9 m-20 -101.17 -3.75 28.52 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 122.153 -0.342 . . . . 63.43 111.082 175.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.6 t -77.06 142.14 39.96 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.014 0.435 . . . . 74.209999999999994 112.064 -176.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 56.1 tp -115.73 123.59 48.67 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.128 -0.487 . . . . 72.409999999999997 111.051 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 44.4 mm -88.02 -53.95 8.85 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 N-CA-C 111.739 0.274 . . . . 73.430000000000007 111.739 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.8 t -163.43 154.15 16.22 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 112.319 0.488 . . . . 74.409999999999997 112.319 -178.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.466 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 46.4 mt-10 -113.91 132.57 55.88 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 116.333 -0.394 . . . . 74.239999999999995 110.757 177.43 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -141.16 139.73 19.74 Favored Pre-proline 0 N--CA 1.473 0.711 0 O-C-N 122.221 -0.3 . . . . 73.430000000000007 111.539 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo -72.64 -15.68 27.13 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 122.642 2.228 . . . . 75.120000000000005 113.641 -177.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 44.2 p -116.82 148.78 40.91 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 120.914 0.388 . . . . 65.230000000000004 111.534 177.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.71 -31.2 72.06 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.867 0.365 . . . . 75.049999999999997 111.439 177.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.41 ' O ' ' HB2' ' A' ' 52' ' ' ASP . 0.1 OUTLIER -60.62 -52.33 65.63 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.271 -0.422 . . . . 71.420000000000002 110.571 179.43 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -55.97 -45.85 78.8 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 120.897 0.379 . . . . 74.310000000000002 111.803 178.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.81 -49.24 78.49 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 120.99 0.424 . . . . 71.120000000000005 111.447 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.431 ' O ' ' HG3' ' A' ' 55' ' ' LYS . 24.2 mmt -64.23 -33.84 76.72 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.195 0.522 . . . . 60.32 111.101 175.167 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.8 ' HA ' ' HE2' ' A' ' 55' ' ' LYS . 3.6 t70 -61.97 -46.29 89.9 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.93 -0.577 . . . . 71.040000000000006 110.846 -177.469 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.95 -33.39 72.05 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 116.016 -0.538 . . . . 74.150000000000006 111.231 175.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 65.7 tttm -61.49 -37.22 82.88 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.193 -0.458 . . . . 70.129999999999995 111.346 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.8 ' HE2' ' HA ' ' A' ' 52' ' ' ASP . 51.1 mtmt -51.97 -55.37 20.78 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.742 0.306 . . . . 72.120000000000005 111.242 177.041 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 15.8 mtp180 -67.05 -26.71 66.89 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.002 0.371 . . . . 64.329999999999998 112.002 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -66.19 -32.45 73.89 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.035 0.445 . . . . 73.209999999999994 110.535 173.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.712 ' HA ' ' HB2' ' A' ' 9' ' ' ARG . 52.0 mt-10 -77.92 -45.37 24.23 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.952 0.406 . . . . 61.530000000000001 110.845 175.528 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -67.51 167.57 15.28 Favored Pre-proline 0 CA--C 1.549 0.908 0 N-CA-C 112.256 0.465 . . . . 64.299999999999997 112.256 177.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.24 -7.11 20.38 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.382 2.055 . . . . 64.129999999999995 112.455 172.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -76.78 29.96 0.13 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 122.707 0.403 . . . . 71.129999999999995 111.783 177.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.423 ' HE3' ' HB2' ' A' ' 62' ' ' LYS . 37.0 ttmt -77.0 131.58 38.53 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 122.787 0.435 . . . . 72.439999999999998 111.065 -179.426 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 45.2 mm-40 -104.15 -11.45 17.28 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.395 0.517 . . . . 75.420000000000002 112.395 -173.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 94.1 mt -55.49 126.8 26.74 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 120.904 0.383 . . . . 74.239999999999995 111.766 179.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -68.75 164.13 22.46 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.236 0.541 . . . . 72.129999999999995 111.763 177.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 68.2 m-70 -74.5 105.45 5.63 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.365 -0.38 . . . . 74.450000000000003 110.152 176.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 46.6 m80 -79.43 139.24 37.73 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.258 -0.428 . . . . 64.049999999999997 111.702 -176.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 72.9 m80 -88.61 164.8 15.19 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.43 0.634 . . . . 75.140000000000001 112.124 -177.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 21.5 m80 -81.49 84.1 6.8 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.663 -0.698 . . . . 72.540000000000006 111.387 -175.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 75.6 t60 -68.51 129.38 39.75 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 120.897 0.379 . . . . 74.310000000000002 111.799 -177.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 75.8 m80 . . . . . 0 C--O 1.254 1.297 0 CA-C-O 118.533 -0.746 . . . . 73.239999999999995 111.224 176.137 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.488 1.443 0 N-CA-C 110.604 -0.147 . . . . 73.349999999999994 110.604 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -66.58 78.61 0.35 Allowed 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.315 2.01 . . . . 72.420000000000002 113.349 -179.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 92.5 m -92.34 94.58 9.21 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 109.758 -0.46 . . . . 74.530000000000001 109.758 172.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.433 ' O ' ' HG3' ' A' ' 4' ' ' LYS . 20.7 pttp -59.24 111.51 3.85 Favored Pre-proline 0 CA--C 1.545 0.772 0 N-CA-C 112.791 0.663 . . . . 74.510000000000005 112.791 -173.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_endo -87.69 151.63 7.46 Favored 'Trans proline' 0 CA--C 1.544 1.014 0 C-N-CA 122.531 2.154 . . . . 70.150000000000006 112.041 173.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -73.55 -1.3 10.5 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 122.44 2.093 . . . . 74.319999999999993 112.849 178.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 33.5 p90 -143.61 147.66 40.18 Favored Pre-proline 0 CA--C 1.543 0.676 0 CA-C-N 116.382 -0.372 . . . . 71.010000000000005 110.894 -178.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -66.66 122.26 9.63 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 122.377 2.052 . . . . 73.409999999999997 111.808 172.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.417 ' HD3' ' O ' ' A' ' 58' ' ' GLU . 2.8 ptp180 -104.24 87.99 2.88 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.45 0.643 . . . . 75.040000000000006 112.187 -177.052 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -151.82 156.61 40.54 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.542 -0.753 . . . . 73.099999999999994 110.932 175.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.408 ' O ' ' HE3' ' A' ' 54' ' ' LYS . . . -134.5 178.65 6.82 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 121.062 0.458 . . . . 73.519999999999996 111.824 -175.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 33.0 p90 -144.41 141.46 29.66 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.338 0.589 . . . . 75.530000000000001 111.383 178.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 57.3 mt -91.58 125.53 44.27 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 CA-C-N 116.075 -0.511 . . . . 75.530000000000001 111.786 -177.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.433 HG23 ' HD2' ' A' ' 31' ' ' ARG . 83.8 t -106.1 132.4 53.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 CA-C-O 120.862 0.363 . . . . 74.109999999999999 111.047 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 67.8 p -93.19 120.86 33.94 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.306 0.484 . . . . 71.010000000000005 112.306 -178.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 37.8 pt -123.89 171.83 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 CA-C-O 120.763 0.316 . . . . 74.239999999999995 110.877 176.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.545 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 45.6 mt-10 -136.0 127.68 28.99 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.22 0.533 . . . . 73.019999999999996 111.623 178.047 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -104.99 174.69 5.77 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.266 -0.424 . . . . 73.010000000000005 110.83 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.41 -140.27 14.83 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 120.789 -0.719 . . . . 64.340000000000003 113.864 177.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.529 ' HB2' ' HB2' ' A' ' 23' ' ' GLN . 1.9 mptp? -102.29 154.43 37.41 Favored Pre-proline 0 N--CA 1.471 0.618 0 C-N-CA 122.43 0.292 . . . . 64.519999999999996 111.328 -176.135 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -54.91 112.81 1.14 Allowed 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 122.346 2.031 . . . . 75.310000000000002 111.885 172.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 94.72 -45.51 2.16 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 121.265 -0.493 . . . . 74.200000000000003 112.323 -175.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.529 ' HB2' ' HB2' ' A' ' 20' ' ' LYS . 27.8 mm-40 -96.52 71.63 2.69 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.322 0.582 . . . . 75.439999999999998 110.521 175.54 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.545 ' HB ' ' HB3' ' A' ' 17' ' ' GLU . 40.1 p -101.84 168.63 9.31 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.964 0.727 . . . . 71.329999999999998 112.964 -174.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 57.7 t -127.31 125.37 65.84 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 CA-C-N 115.217 -0.901 . . . . 75.120000000000005 110.159 176.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 90.6 m -68.86 124.74 24.51 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.384 0.513 . . . . 75.519999999999996 112.384 -177.284 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -130.29 150.71 51.41 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.109 0.48 . . . . 75.140000000000001 111.292 176.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -117.34 115.26 24.9 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.222 -0.445 . . . . 63.399999999999999 111.436 -179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.618 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 70.9 mt-30 -94.48 107.33 19.31 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.914 0.388 . . . . 72.239999999999995 111.087 175.253 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.6 tp -74.81 111.66 10.23 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.634 -0.257 . . . . 73.230000000000004 110.594 175.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.433 ' HD2' HG23 ' A' ' 14' ' ' VAL . 74.4 mtt180 -116.43 142.61 46.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.781 0.324 . . . . 75.140000000000001 111.004 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -109.6 140.23 43.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.836 0.35 . . . . 73.310000000000002 111.662 -178.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.547 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 26.6 t70 -68.74 -21.58 64.36 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.136 0.494 . . . . 65.540000000000006 111.482 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 78.9 m-70 -123.58 136.43 27.24 Favored Pre-proline 0 CA--C 1.543 0.7 0 CA-C-N 116.461 -0.336 . . . . 74.420000000000002 111.483 -176.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -67.36 -51.57 0.16 OUTLIER 'Cis proline' 0 C--N 1.359 1.1 0 C-N-CA 124.287 -1.13 . . . . 73.109999999999999 113.363 -0.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 31.5 mtmm -109.23 139.25 20.85 Favored Pre-proline 0 N--CA 1.472 0.629 0 O-C-N 122.298 -0.251 . . . . 73.140000000000001 110.897 176.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.547 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 77.2 Cg_exo -52.05 -29.78 37.74 Favored 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 123.182 2.588 . . . . 71.349999999999994 114.45 -177.222 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -78.34 6.78 7.59 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 112.222 0.453 . . . . 74.25 112.222 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 43.8 t -70.41 93.35 0.87 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.001 0.429 . . . . 60.439999999999998 111.511 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 59.8 tp -71.71 114.17 9.52 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 116.4 -0.364 . . . . 43.43 110.848 176.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.0 mm -79.02 -45.8 24.06 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-N 116.227 -0.442 . . . . 74.150000000000006 111.459 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 86.2 p -176.1 149.19 0.86 Allowed 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 112.473 0.546 . . . . 64.450000000000003 112.473 178.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.618 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 49.1 mt-10 -95.95 136.65 36.11 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 116.182 -0.463 . . . . 73.129999999999995 110.884 173.344 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 52.1 m80 -142.66 143.19 25.1 Favored Pre-proline 0 N--CA 1.471 0.623 0 C-N-CA 122.18 0.192 . . . . 73.150000000000006 111.393 177.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -71.75 -18.99 28.1 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.387 2.058 . . . . 71.519999999999996 112.921 -178.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 66.4 p -119.19 150.08 40.65 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.128 0.49 . . . . 73.209999999999994 111.524 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.444 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -67.77 -33.37 74.71 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.224 -0.444 . . . . 61.020000000000003 111.144 177.616 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -59.46 -48.34 82.04 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.28 -0.418 . . . . 72.409999999999997 111.629 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -63.34 -34.43 77.7 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.801 0.334 . . . . 71.329999999999998 111.862 177.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.51 -40.3 92.86 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 120.904 0.383 . . . . 74.230000000000004 110.786 174.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.444 ' HG3' ' O ' ' A' ' 47' ' ' ALA . 64.7 mtt -67.08 -34.41 77.59 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.285 -0.416 . . . . 75.129999999999995 111.42 176.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.488 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 12.7 t70 -57.27 -53.19 60.97 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.05 0.452 . . . . 73.349999999999994 110.823 176.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.07 -31.56 72.15 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 116.239 -0.437 . . . . 70.109999999999999 111.331 178.369 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.435 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 87.8 tttt -62.59 -49.01 76.95 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 116.241 -0.436 . . . . 71.420000000000002 110.95 175.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -59.43 -43.64 93.06 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 116.277 -0.419 . . . . 72.010000000000005 111.217 176.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.488 ' HG3' ' O ' ' A' ' 52' ' ' ASP . 78.5 mtp180 -59.03 -38.71 79.92 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.81 0.338 . . . . 72.299999999999997 111.174 176.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -64.93 -39.55 93.68 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-O 121.062 0.458 . . . . 73.510000000000005 110.979 175.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 54' ' ' LYS . 42.3 mt-10 -69.52 -36.25 76.25 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.168 -0.469 . . . . 73.329999999999998 111.569 179.372 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.406 ' HB3' ' HD2' ' A' ' 60' ' ' PRO . 9.4 m-20 -80.88 164.27 51.69 Favored Pre-proline 0 CA--C 1.543 0.69 0 C-N-CA 122.42 0.288 . . . . 73.340000000000003 111.129 174.61 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.406 ' HD2' ' HB3' ' A' ' 59' ' ' ASP . 73.1 Cg_endo -74.38 46.58 1.42 Allowed 'Trans proline' 0 CA--C 1.545 1.056 0 C-N-CA 122.167 1.911 . . . . 71.230000000000004 113.05 176.373 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -67.23 -50.91 58.93 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-O 120.827 0.346 . . . . 73.209999999999994 111.716 -178.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -141.96 136.84 30.76 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 120.92 0.391 . . . . 65.420000000000002 111.095 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -90.15 143.01 27.16 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 120.882 0.372 . . . . 74.340000000000003 111.644 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.43 ' N ' HD12 ' A' ' 64' ' ' LEU . 5.7 mp -103.23 -10.03 19.09 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 112.223 0.453 . . . . 72.319999999999993 112.223 -176.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -81.0 143.47 32.5 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 122.225 -0.297 . . . . 74.319999999999993 111.74 -177.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -137.47 88.95 2.38 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.191 0.441 . . . . 75.439999999999998 112.191 -179.369 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 30.5 m-70 -133.95 142.17 47.59 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 122.687 0.395 . . . . 63.509999999999998 110.249 173.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 16.2 p80 -94.19 115.0 27.21 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.327 0.491 . . . . 73.239999999999995 112.327 -172.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 57.31 22.4 7.73 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 112.382 0.512 . . . . 72.430000000000007 112.382 173.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 55.5 t-80 -97.79 142.0 30.09 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.611 0.597 . . . . 73.129999999999995 112.611 -174.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 44.8 p-80 . . . . . 0 C--O 1.247 0.941 0 CA-C-N 115.717 -0.674 . . . . 64.099999999999994 110.514 170.284 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.572 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.1 mpt? . . . . . 0 N--CA 1.489 1.524 0 N-CA-C 111.156 0.058 . . . . 73.420000000000002 111.156 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -62.15 113.73 2.02 Favored 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 122.715 2.277 . . . . 75.409999999999997 112.538 176.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 69.7 p -89.44 -39.35 13.43 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.027 0.38 . . . . 74.25 112.027 -178.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt 59.19 91.61 0.07 OUTLIER Pre-proline 0 CA--C 1.543 0.694 0 CA-C-O 121.074 0.464 . . . . 64.319999999999993 111.438 -177.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -57.96 142.62 96.68 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 123.041 2.494 . . . . 73.099999999999994 113.833 -175.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.55 138.78 30.18 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.508 2.139 . . . . 70.140000000000001 112.207 173.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -60.83 145.09 89.15 Favored Pre-proline 0 CA--C 1.544 0.731 0 N-CA-C 111.957 0.355 . . . . 74.409999999999997 111.957 -177.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.04 95.14 0.04 OUTLIER 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 123.313 2.676 . . . . 75.409999999999997 114.718 -172.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -88.84 89.6 8.05 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 116.275 -0.42 . . . . 74.230000000000004 109.988 173.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -127.09 127.1 44.13 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 112.016 0.376 . . . . 54.020000000000003 112.016 -173.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.423 ' O ' ' HE2' ' A' ' 54' ' ' LYS . . . -120.85 155.58 33.8 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.837 0.351 . . . . 54.130000000000003 111.335 175.368 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 26.2 p90 -139.04 142.24 38.24 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.168 0.508 . . . . 73.109999999999999 111.588 178.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 64.8 mt -94.02 131.13 41.79 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 116.12 -0.491 . . . . 74.140000000000001 111.51 -178.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 67.3 t -117.91 127.79 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-O 120.817 0.342 . . . . 71.209999999999994 111.18 178.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 75.3 p -86.79 112.81 22.07 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.136 0.493 . . . . 74.209999999999994 111.95 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.5 pt -114.85 176.83 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 116.084 -0.507 . . . . 70.340000000000003 110.57 174.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.552 ' HB2' ' HB ' ' A' ' 24' ' ' THR . 10.2 pt-20 -140.83 126.91 19.51 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.266 0.555 . . . . 72.310000000000002 111.879 177.511 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -104.94 170.25 7.98 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.115 -0.493 . . . . 74.219999999999999 110.745 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 98.88 -168.33 22.36 Favored Glycine 0 CA--C 1.527 0.84 0 C-N-CA 120.846 -0.692 . . . . 38.57 113.562 177.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -70.04 143.12 91.14 Favored Pre-proline 0 N--CA 1.472 0.65 0 N-CA-C 112.064 0.394 . . . . 75.319999999999993 112.064 -178.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -54.32 119.45 6.38 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.465 2.11 . . . . 74.140000000000001 111.815 176.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.2 -47.71 1.34 Allowed Glycine 0 CA--C 1.526 0.74 0 C-N-CA 121.322 -0.466 . . . . 38.57 112.373 -174.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -99.33 60.43 1.17 Allowed 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.047 0.451 . . . . 73.120000000000005 110.65 176.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.552 ' HB ' ' HB2' ' A' ' 17' ' ' GLU . 38.6 p -98.52 154.46 17.88 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 113.029 0.751 . . . . 63.200000000000003 113.029 -174.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 56.9 t -110.8 127.12 68.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-N 115.618 -0.719 . . . . 70.439999999999998 110.458 175.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 88.2 m -72.96 115.33 12.14 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 112.25 0.463 . . . . 75.5 112.25 -178.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 56.7 m95 -110.07 141.37 43.01 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.227 -0.442 . . . . 71.530000000000001 111.104 176.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -103.29 115.27 30.24 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.529 -0.305 . . . . 75.200000000000003 110.876 178.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.572 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 90.0 mt-30 -94.33 119.22 32.77 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 120.959 0.409 . . . . 55.420000000000002 111.572 176.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.2 tp -84.51 110.97 19.08 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 120.863 0.363 . . . . 75.299999999999997 110.122 174.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 47.0 mtp180 -118.92 166.64 12.58 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.473 -0.33 . . . . 73.209999999999994 110.673 -176.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -133.04 144.03 49.78 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 111.68 0.252 . . . . 54.420000000000002 111.68 178.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -79.41 -28.52 41.79 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 111.963 0.357 . . . . 74.040000000000006 111.963 178.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 85.7 m-70 -107.01 128.34 26.27 Favored Pre-proline 0 CA--C 1.542 0.67 0 CA-C-N 116.605 -0.27 . . . . 72.329999999999998 111.385 -175.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -85.84 -22.36 13.32 Favored 'Cis proline' 0 C--N 1.354 0.864 0 C-N-CA 123.969 -1.263 . . . . 70.109999999999999 113.249 -2.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -117.7 141.94 29.82 Favored Pre-proline 0 N--CA 1.469 0.51 0 CA-C-N 116.32 -0.4 . . . . 74.450000000000003 111.114 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_exo -61.19 -24.44 79.07 Favored 'Trans proline' 0 N--CA 1.479 0.631 0 C-N-CA 122.594 2.196 . . . . 70.120000000000005 112.088 177.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -82.13 10.84 5.98 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.504 -0.771 . . . . 54.509999999999998 111.982 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 51.7 m -73.56 89.31 1.7 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.065 0.459 . . . . 61.439999999999998 111.007 177.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 60.8 tp -85.57 125.1 32.84 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.19 -0.459 . . . . 73.040000000000006 110.861 178.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.6 mm -92.25 -53.92 8.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-O 120.741 0.305 . . . . 72.099999999999994 111.561 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 84.0 p -168.71 152.37 5.51 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 112.194 0.442 . . . . 73.209999999999994 112.194 -178.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.572 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 49.2 mt-10 -105.15 135.65 46.11 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 116.215 -0.448 . . . . 74.549999999999997 110.587 174.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 37.9 m80 -138.41 136.79 19.46 Favored Pre-proline 0 CA--C 1.539 0.534 0 O-C-N 122.394 -0.191 . . . . 75.409999999999997 111.497 179.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -76.57 -4.31 14.85 Favored 'Trans proline' 0 CA--C 1.54 0.824 0 C-N-CA 122.622 2.214 . . . . 73.239999999999995 113.569 -177.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 71.1 p -129.73 144.08 51.12 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.095 0.474 . . . . 74.439999999999998 111.24 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.76 -38.73 86.24 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.239 -0.437 . . . . 73.319999999999993 111.531 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.553 HE21 ' N ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -55.2 -49.32 72.21 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.642 0.258 . . . . 74.219999999999999 111.11 178.335 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.553 ' N ' HE21 ' A' ' 48' ' ' GLN . 10.7 mm-40 -63.28 -35.92 81.96 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 120.936 0.398 . . . . 74.310000000000002 111.664 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.37 -52.91 50.46 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.048 0.452 . . . . 72.540000000000006 111.203 176.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 87.8 mtp -62.09 -37.7 86.07 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 116.012 -0.54 . . . . 74.25 111.347 177.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.461 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 20.2 t70 -61.09 -52.23 65.78 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.874 -0.603 . . . . 64.140000000000001 110.924 178.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.56 -39.94 92.93 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.241 -0.436 . . . . 63.229999999999997 111.398 176.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.423 ' HE2' ' O ' ' A' ' 11' ' ' ALA . 61.0 tttm -56.27 -54.92 39.6 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 120.93 0.395 . . . . 74.150000000000006 111.448 179.35 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 52' ' ' ASP . 22.4 pttm -58.28 -40.81 82.88 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.563 -0.29 . . . . 73.409999999999997 110.328 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 69.5 mtp180 -67.21 -25.69 66.24 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 111.985 0.365 . . . . 71.120000000000005 111.985 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 75.4 t80 -77.02 -29.67 55.45 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 120.909 0.385 . . . . 64.299999999999997 111.509 174.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -102.54 -15.71 16.34 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.445 0.905 . . . . 74.010000000000005 113.445 -177.14 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 -69.07 159.28 83.71 Favored Pre-proline 0 N--CA 1.475 0.792 0 O-C-N 121.993 -0.442 . . . . 64.319999999999993 112.039 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_exo -57.52 -34.47 98.09 Favored 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 122.583 2.189 . . . . 74.129999999999995 112.742 175.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -75.62 98.83 4.13 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.133 0.492 . . . . 62.409999999999997 110.923 177.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -120.19 147.75 44.53 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.486 0.55 . . . . 73.430000000000007 112.486 -176.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 53.53 33.46 16.25 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 112.79 0.663 . . . . 75.200000000000003 112.79 171.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -72.82 -0.28 12.97 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 112.394 0.516 . . . . 74.0 112.394 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -69.81 88.67 0.55 Allowed 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.375 0.607 . . . . 74.310000000000002 112.119 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 15.9 p-80 -100.1 90.76 4.49 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.13 0.49 . . . . 73.099999999999994 110.51 173.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -88.78 143.52 26.85 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.071 -0.513 . . . . 62.409999999999997 110.062 -178.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 24.7 t60 -62.93 -12.73 27.35 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 112.412 0.523 . . . . 74.109999999999999 112.412 -175.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 51.4 m-70 -123.67 15.9 9.49 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-O 120.696 0.284 . . . . 73.299999999999997 111.616 175.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 32.5 t-80 -169.55 118.42 0.63 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 120.918 0.389 . . . . 70.299999999999997 111.849 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 . . . . . 0 C--O 1.25 1.125 0 CA-C-O 118.558 -0.734 . . . . 74.25 111.354 179.134 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 81.9 mtp . . . . . 0 N--CA 1.487 1.403 0 N-CA-C 111.608 0.225 . . . . 73.540000000000006 111.608 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -59.9 99.89 0.13 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 121.98 1.786 . . . . 72.099999999999994 111.098 170.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 59.0 p -67.03 83.51 0.12 Allowed 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.803 0.668 . . . . 70.140000000000001 112.803 -173.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -157.16 141.98 12.14 Favored Pre-proline 0 C--O 1.239 0.515 0 CA-C-N 115.468 -0.787 . . . . 71.530000000000001 110.357 174.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -54.37 142.61 68.79 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 122.627 2.218 . . . . 72.209999999999994 112.873 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -63.47 178.61 1.18 Allowed 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 122.527 2.152 . . . . 74.340000000000003 112.322 178.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.7 t80 61.97 62.93 2.22 Favored Pre-proline 0 CA--C 1.548 0.884 0 CA-C-O 121.529 0.681 . . . . 75.239999999999995 110.046 -175.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -91.56 5.25 3.84 Favored 'Trans proline' 0 CA--C 1.538 0.724 0 C-N-CA 122.987 2.458 . . . . 71.239999999999995 113.893 -175.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.42 ' NH2' ' HA ' ' A' ' 58' ' ' GLU . 22.0 ptt180 -165.8 146.26 6.69 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.014 0.435 . . . . 71.299999999999997 111.907 179.509 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.46 152.48 32.01 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 116.136 -0.483 . . . . 63.539999999999999 110.197 172.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.473 ' HB3' ' HG3' ' A' ' 54' ' ' LYS . . . -113.06 166.28 11.57 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.674 0.273 . . . . 74.5 111.009 176.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 22.6 p90 -155.78 143.56 19.67 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.248 0.547 . . . . 72.439999999999998 111.907 177.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 57.1 mt -96.85 111.32 26.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 CA-C-N 115.949 -0.568 . . . . 73.200000000000003 112.277 -175.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 72.4 t -106.26 126.89 61.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 122.518 0.327 . . . . 72.439999999999998 111.188 178.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 61.7 p -87.23 124.12 32.98 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 122.201 -0.312 . . . . 74.019999999999996 111.544 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.501 HD11 ' NE2' ' A' ' 29' ' ' GLN . 43.3 pt -114.63 154.37 16.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 CA-C-O 121.005 0.431 . . . . 75.430000000000007 111.705 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -100.74 109.68 21.72 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.19 -0.459 . . . . 71.420000000000002 111.733 -179.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.474 ' HE2' HD13 ' A' ' 16' ' ' ILE . 67.6 mttm -104.47 177.7 4.77 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 120.756 0.312 . . . . 75.400000000000006 110.285 175.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 88.32 -136.58 13.83 Favored Glycine 0 CA--C 1.527 0.793 0 C-N-CA 120.682 -0.77 . . . . 73.400000000000006 113.721 176.013 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -102.4 160.59 25.89 Favored Pre-proline 0 CA--C 1.54 0.578 0 CA-C-O 120.739 0.305 . . . . 73.129999999999995 111.669 -177.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -60.42 132.44 43.58 Favored 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 122.034 1.823 . . . . 74.329999999999998 111.685 169.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 80.37 -61.49 4.42 Favored Glycine 0 CA--C 1.528 0.864 0 C-N-CA 120.794 -0.717 . . . . 71.129999999999995 112.426 -175.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -87.39 75.8 9.17 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 121.449 0.642 . . . . 72.439999999999998 110.426 174.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 65.4 p -94.46 165.04 12.75 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.608 0.718 . . . . 72.439999999999998 112.632 -177.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 40.4 t -122.2 110.44 27.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-N 115.33 -0.85 . . . . 73.140000000000001 109.58 172.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 59.0 m -78.03 115.57 17.86 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.986 0.422 . . . . 74.450000000000003 111.963 -177.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.402 ' CD1' ' HD2' ' A' ' 18' ' ' LYS . 40.4 m95 -108.44 140.03 42.33 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.084 0.469 . . . . 74.239999999999995 111.561 178.562 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -92.35 114.31 26.82 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.228 -0.442 . . . . 70.510000000000005 110.931 178.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.67 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 76.6 mt-30 -97.84 116.99 31.16 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.341 -0.39 . . . . 74.430000000000007 111.553 178.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 49.8 tp -85.61 103.75 14.72 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 120.768 0.318 . . . . 73.200000000000003 110.183 173.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -103.71 148.24 26.29 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 110.319 -0.252 . . . . 74.140000000000001 110.319 178.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -124.02 149.11 46.44 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 112.139 0.422 . . . . 63.43 112.139 -178.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.595 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 34.4 t70 -66.38 -25.07 66.61 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 113.344 0.868 . . . . 72.319999999999993 113.344 -173.357 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 43.8 m-70 -122.06 142.5 36.68 Favored Pre-proline 0 N--CA 1.475 0.809 0 O-C-N 121.739 -0.601 . . . . 72.329999999999998 111.729 -178.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -74.42 -28.92 7.04 Favored 'Cis proline' 0 C--N 1.359 1.087 0 C-N-CA 124.182 -1.174 . . . . 64.109999999999999 113.385 0.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm -121.21 143.79 38.14 Favored Pre-proline 0 N--CA 1.467 0.408 0 N-CA-C 110.152 -0.314 . . . . 75.0 110.152 174.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.595 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 11.0 Cg_endo -52.36 -31.88 49.3 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.025 2.483 . . . . 72.349999999999994 114.62 -171.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -99.79 20.83 13.45 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 112.618 0.599 . . . . 72.219999999999999 112.618 -177.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 26.7 m -62.18 101.15 0.2 Allowed 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 121.266 0.555 . . . . 42.43 110.975 174.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.414 HD11 ' HB3' ' A' ' 29' ' ' GLN . 50.9 tp -72.41 106.51 4.56 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.764 -0.653 . . . . 73.299999999999997 112.259 -177.287 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 47.3 mm -65.31 -54.29 30.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-N 116.274 -0.421 . . . . 72.519999999999996 111.099 176.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 42.1 t -169.22 149.77 4.22 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 112.043 0.386 . . . . 74.349999999999994 112.043 -178.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.67 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 46.1 mt-10 -103.03 125.12 49.64 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 116.251 -0.431 . . . . 73.340000000000003 110.802 176.493 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 84.7 m-70 -128.2 148.62 68.46 Favored Pre-proline 0 N--CA 1.477 0.905 0 N-CA-C 111.797 0.295 . . . . 75.019999999999996 111.797 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -73.61 -21.25 19.47 Favored 'Trans proline' 0 CA--C 1.544 1.018 0 C-N-CA 122.547 2.165 . . . . 72.549999999999997 113.451 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 33.4 p -118.73 152.36 36.29 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 120.927 0.394 . . . . 73.439999999999998 111.654 179.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.41 -35.21 77.32 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.313 -0.403 . . . . 73.200000000000003 111.394 176.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -53.6 -49.12 68.46 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 120.767 0.318 . . . . 70.430000000000007 111.834 -179.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -58.76 -44.07 90.48 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 120.991 0.424 . . . . 74.140000000000001 111.743 178.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.38 -40.72 85.71 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 116.273 -0.421 . . . . 73.219999999999999 111.77 179.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 65.7 mtt -64.47 -43.22 94.86 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.856 0.36 . . . . 73.099999999999994 110.964 177.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -55.09 -51.1 67.46 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.076 0.465 . . . . 73.109999999999999 110.602 175.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.62 -35.58 78.3 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.011 -0.54 . . . . 71.299999999999997 111.487 179.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.473 ' HG3' ' HB3' ' A' ' 11' ' ' ALA . 63.2 tttm -63.6 -56.02 19.14 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 116.487 -0.324 . . . . 74.200000000000003 111.315 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 11.9 mptt -59.14 -43.72 92.02 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.102 0.477 . . . . 73.409999999999997 111.103 176.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 51.2 ttm-85 -65.85 -30.67 71.32 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.087 -0.506 . . . . 64.510000000000005 111.478 -178.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -67.88 -41.87 82.14 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 116.224 -0.443 . . . . 71.319999999999993 110.96 175.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.42 ' HA ' ' NH2' ' A' ' 9' ' ' ARG . 66.0 mm-40 -77.78 -8.58 58.2 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 112.696 0.628 . . . . 73.439999999999998 112.696 179.514 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -56.91 115.26 9.82 Favored Pre-proline 0 CA--C 1.546 0.799 0 CA-C-O 121.014 0.435 . . . . 75.209999999999994 111.189 179.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -83.2 88.32 1.21 Allowed 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.737 2.292 . . . . 64.109999999999999 113.964 -174.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -82.14 95.31 7.46 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.99 -0.55 . . . . 70.420000000000002 109.902 172.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.0 tptt -151.44 116.41 5.23 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.52 0.563 . . . . 72.519999999999996 112.52 -173.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -74.21 120.87 20.38 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.269 -0.423 . . . . 71.329999999999998 109.902 172.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.3 pp -144.68 174.23 11.15 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 112.92 0.711 . . . . 74.129999999999995 112.92 -178.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 37.9 mm-40 -99.8 105.0 16.73 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.729 -0.669 . . . . 74.450000000000003 111.645 177.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.2 p-80 -86.28 152.77 22.49 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 109.97 -0.381 . . . . 75.549999999999997 109.97 171.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 46.1 t60 -54.66 110.94 0.71 Allowed 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 120.742 0.306 . . . . 74.329999999999998 111.485 -178.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -140.55 142.28 35.19 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 120.938 0.399 . . . . 73.349999999999994 111.942 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 31.4 t-80 -66.52 107.42 2.07 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.099 -0.5 . . . . 75.329999999999998 111.748 179.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -92.86 146.33 23.72 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 116.379 -0.373 . . . . 73.010000000000005 110.837 176.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 54.9 t-80 . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.663 -0.684 . . . . 72.439999999999998 111.723 178.666 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.408 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 62.0 mtt . . . . . 0 N--CA 1.492 1.654 0 N-CA-C 111.847 0.314 . . . . 74.25 111.847 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 1' ' ' MET . 7.2 Cg_exo -75.14 35.64 0.43 Allowed 'Trans proline' 0 CA--C 1.544 0.991 0 C-N-CA 123.218 2.612 . . . . 73.519999999999996 113.09 176.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 91.2 m -54.76 116.51 2.76 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.069 0.461 . . . . 74.310000000000002 112.14 -175.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -98.65 128.01 34.01 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-N 116.271 -0.422 . . . . 71.129999999999995 111.63 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -64.8 119.93 7.08 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 C-N-CA 122.569 2.18 . . . . 73.109999999999999 112.144 174.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.6 161.05 46.83 Favored 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 122.85 2.367 . . . . 75.25 113.422 -176.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -103.97 107.53 57.19 Favored Pre-proline 0 CA--C 1.542 0.669 0 CA-C-N 116.018 -0.537 . . . . 72.319999999999993 111.325 -176.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -60.94 104.39 0.27 Allowed 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 122.219 1.946 . . . . 63.130000000000003 111.712 176.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 34.6 ttt180 -85.63 91.76 8.36 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.206 0.527 . . . . 74.140000000000001 110.848 -175.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -114.0 131.79 56.22 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.006 -0.543 . . . . 75.040000000000006 111.678 -175.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -129.49 158.04 40.33 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.114 -0.494 . . . . 54.219999999999999 111.119 177.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 39.5 p90 -151.37 155.24 38.26 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.099 0.476 . . . . 63.409999999999997 112.004 -177.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 60.1 mt -98.12 128.39 49.6 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 N-CA-C 112.401 0.519 . . . . 73.439999999999998 112.401 -176.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 48.7 t -115.67 141.7 31.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 122.604 0.362 . . . . 75.040000000000006 110.944 176.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 60.8 p -102.1 128.47 48.55 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 121.166 0.508 . . . . 74.439999999999998 112.005 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.517 HD11 ' NE2' ' A' ' 29' ' ' GLN . 41.9 pt -132.72 176.35 9.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-O 121.005 0.431 . . . . 75.439999999999998 111.094 176.674 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.535 ' HB2' ' HB ' ' A' ' 24' ' ' THR . 9.1 pt-20 -137.23 137.96 39.63 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.097 0.475 . . . . 73.439999999999998 111.674 177.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -127.53 164.91 20.92 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.113 -0.494 . . . . 73.25 111.016 179.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.74 -140.16 14.76 Favored Glycine 0 CA--C 1.533 1.18 0 N-CA-C 114.698 0.639 . . . . 73.340000000000003 114.698 175.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -86.1 157.11 57.18 Favored Pre-proline 0 N--CA 1.473 0.687 0 N-CA-C 112.279 0.474 . . . . 75.439999999999998 112.279 -173.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.35 141.4 68.1 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 122.092 1.861 . . . . 73.439999999999998 111.82 174.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.2 -61.75 3.79 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 120.949 -0.643 . . . . 74.25 112.477 -176.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -92.23 71.78 5.34 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 121.277 0.56 . . . . 74.129999999999995 111.099 176.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.535 ' HB ' ' HB2' ' A' ' 17' ' ' GLU . 63.1 p -93.88 159.2 15.29 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.737 -0.665 . . . . 64.340000000000003 111.236 178.883 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 61.0 t -108.98 127.78 65.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-N 116.521 -0.309 . . . . 64.299999999999997 111.028 178.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 37.8 m -76.78 116.11 17.15 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.773 0.32 . . . . 72.439999999999998 111.849 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -112.31 131.08 55.71 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.051 0.453 . . . . 75.329999999999998 111.281 176.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -96.9 114.13 25.72 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.034 0.445 . . . . 74.299999999999997 110.637 177.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.517 ' NE2' HD11 ' A' ' 16' ' ' ILE . 92.5 mt-30 -94.37 119.28 32.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.053 -0.521 . . . . 54.43 111.546 179.429 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.8 tp -83.45 107.36 15.89 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.197 -0.297 . . . . 74.5 110.197 172.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 50.9 mtt180 -111.86 161.31 16.5 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 120.918 0.389 . . . . 71.120000000000005 111.231 179.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -123.25 166.88 14.51 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 120.988 0.423 . . . . 53.420000000000002 111.343 178.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -86.79 -37.71 17.55 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 116.381 -0.372 . . . . 62.149999999999999 111.841 -178.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 43.6 m80 -115.22 147.79 39.29 Favored Pre-proline 0 N--CA 1.475 0.777 0 C-N-CA 122.439 0.296 . . . . 74.200000000000003 111.555 178.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -82.7 -2.19 52.3 Favored 'Cis proline' 0 C--N 1.355 0.918 0 C-N-CA 124.147 -1.189 . . . . 74.540000000000006 112.851 -2.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -140.66 135.54 15.77 Favored Pre-proline 0 N--CA 1.466 0.372 0 CA-C-N 115.742 -0.663 . . . . 64.409999999999997 110.246 177.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -61.73 -20.95 70.98 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 121.939 1.759 . . . . 74.530000000000001 111.687 175.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -80.38 -3.03 48.08 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 115.632 -0.713 . . . . 73.120000000000005 111.629 177.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 42.5 t -60.79 96.61 0.05 OUTLIER 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 121.05 0.452 . . . . 75.129999999999995 112.176 -175.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 64.9 tp -81.39 106.47 13.38 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.067 0.46 . . . . 73.340000000000003 111.062 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.2 mm -71.6 -51.73 30.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 116.386 -0.37 . . . . 73.239999999999995 111.135 179.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 43.2 t -171.53 149.55 2.67 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 116.382 -0.372 . . . . 72.319999999999993 111.747 178.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.473 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 52.0 mt-10 -102.1 141.26 35.22 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 116.452 -0.34 . . . . 74.540000000000006 110.885 177.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 64.2 m80 -144.07 141.22 18.0 Favored Pre-proline 0 CA--C 1.539 0.53 0 O-C-N 122.304 -0.247 . . . . 74.219999999999999 111.269 178.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.49 -12.64 24.95 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 122.431 2.087 . . . . 72.040000000000006 113.156 -178.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 80.3 p -122.58 141.88 51.23 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-O 121.051 0.453 . . . . 73.430000000000007 111.212 177.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.28 -31.84 72.44 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.356 -0.384 . . . . 65.219999999999999 111.696 -179.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.51 -46.98 73.62 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 120.704 0.288 . . . . 70.299999999999997 110.755 177.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -60.92 -39.48 89.58 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.996 0.427 . . . . 74.319999999999993 111.575 175.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.68 -37.89 89.13 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 116.331 -0.395 . . . . 72.140000000000001 111.023 176.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 67.3 mtt -68.44 -51.97 37.81 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.594 -0.276 . . . . 74.310000000000002 111.515 177.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -57.36 -41.35 79.97 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 120.773 0.32 . . . . 70.150000000000006 111.854 178.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.07 -40.19 87.0 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 120.85 0.357 . . . . 61.5 111.132 175.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.426 ' HZ1' ' CD ' ' A' ' 58' ' ' GLU . 52.5 tttp -62.77 -58.64 6.73 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 122.669 0.387 . . . . 71.200000000000003 112.024 178.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -56.45 -36.39 68.97 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 121.207 0.527 . . . . 72.099999999999994 111.655 -179.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 32.5 ttp180 -80.44 -26.5 38.35 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 116.007 -0.542 . . . . 75.109999999999999 111.798 -178.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -81.6 -42.72 19.65 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.752 0.31 . . . . 73.340000000000003 111.537 178.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.426 ' CD ' ' HZ1' ' A' ' 54' ' ' LYS . 55.0 mt-10 -64.42 -9.71 20.1 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 121.491 0.662 . . . . 72.420000000000002 111.155 179.073 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -100.91 139.05 20.21 Favored Pre-proline 0 CA--C 1.548 0.897 0 CA-C-N 115.406 -0.815 . . . . 61.329999999999998 109.657 171.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -58.67 -6.88 3.64 Favored 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 122.816 2.344 . . . . 73.310000000000002 114.575 -176.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -59.41 -50.6 73.32 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 112.289 0.478 . . . . 75.239999999999995 112.289 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.15 117.06 24.74 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 112.043 0.386 . . . . 72.129999999999995 112.043 -178.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -120.8 -178.98 3.86 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.876 0.369 . . . . 63.509999999999998 110.923 175.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.489 HD22 ' N ' ' A' ' 64' ' ' LEU . 1.6 pt? -158.85 89.69 0.96 Allowed 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 121.347 0.594 . . . . 64.430000000000007 110.719 176.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -88.19 174.9 7.95 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.16 0.505 . . . . 73.239999999999995 111.215 -179.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 19.6 p80 -149.44 110.6 4.39 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.156 -0.474 . . . . 71.329999999999998 111.435 178.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 -72.27 -24.96 61.43 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.229 0.538 . . . . 75.129999999999995 110.462 175.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 19.8 p80 -152.1 135.74 16.19 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.629 -0.714 . . . . 75.219999999999999 109.807 171.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 1.5 p80 -66.84 143.01 57.13 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 112.744 0.646 . . . . 74.329999999999998 112.744 -176.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 25.8 m170 -79.14 -38.64 35.55 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 120.889 0.376 . . . . 75.540000000000006 110.614 174.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 . . . . . 0 C--O 1.252 1.234 0 CA-C-O 118.135 -0.936 . . . . 75.340000000000003 111.708 -178.605 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.416 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 62.8 mtm . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.558 0.218 . . . . 43.549999999999997 110.676 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 1' ' ' MET . 31.2 Cg_exo -60.04 105.37 0.28 Allowed 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 122.436 2.09 . . . . 75.310000000000002 113.979 -177.07 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.453 ' O ' ' HD3' ' A' ' 5' ' ' PRO . 22.3 m -82.07 130.37 35.06 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 116.478 -0.328 . . . . 74.230000000000004 110.131 170.621 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.522 ' HD2' ' N ' ' A' ' 4' ' ' LYS . 10.3 mptt -92.54 110.09 42.78 Favored Pre-proline 0 CA--C 1.541 0.623 0 N-CA-C 111.859 0.318 . . . . 74.109999999999999 111.859 -175.204 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.453 ' HD3' ' O ' ' A' ' 3' ' ' THR . 87.6 Cg_endo -91.62 146.8 3.32 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 122.684 2.256 . . . . 73.219999999999999 112.141 173.375 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.53 93.93 0.04 OUTLIER 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 122.278 1.985 . . . . 73.230000000000004 112.56 177.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -147.05 75.2 11.79 Favored Pre-proline 0 CA--C 1.54 0.567 0 CA-C-O 121.384 0.612 . . . . 73.540000000000006 110.708 179.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -73.09 107.43 2.37 Favored 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 122.912 2.408 . . . . 65.540000000000006 112.607 -179.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 44.7 mtm-85 -79.48 83.74 5.45 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.076 0.465 . . . . 73.209999999999994 110.196 177.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -88.32 123.68 33.15 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.093 -0.503 . . . . 74.109999999999999 111.264 -176.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.526 ' O ' ' HE2' ' A' ' 54' ' ' LYS . . . -106.73 146.31 30.97 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 120.614 0.245 . . . . 73.439999999999998 111.427 179.345 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 40.2 p90 -144.98 153.24 41.29 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.162 0.506 . . . . 74.209999999999994 112.132 179.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.2 mt -96.18 135.21 31.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-N 116.095 -0.502 . . . . 72.239999999999995 111.951 -178.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 95.4 t -123.9 134.56 66.15 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-N 116.143 -0.48 . . . . 75.5 110.897 177.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 65.3 p -96.45 124.96 40.62 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 120.899 0.38 . . . . 74.120000000000005 111.807 -178.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.406 HD11 ' NE2' ' A' ' 29' ' ' GLN . 35.2 pt -126.14 170.79 15.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-N 116.317 -0.401 . . . . 75.400000000000006 111.462 179.22 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -128.49 135.11 49.0 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 116.351 -0.386 . . . . 74.409999999999997 110.858 178.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -122.43 158.11 30.45 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 120.896 0.379 . . . . 75.030000000000001 111.844 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.62 -138.79 14.08 Favored Glycine 0 CA--C 1.529 0.931 0 CA-C-N 116.268 -0.424 . . . . 63.509999999999998 113.966 177.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 54.2 mttp -94.64 155.46 39.43 Favored Pre-proline 0 CA--C 1.541 0.609 0 N-CA-C 111.926 0.343 . . . . 74.140000000000001 111.926 -174.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -52.96 130.3 37.22 Favored 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 122.879 2.386 . . . . 72.540000000000006 113.185 -178.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 77.46 -64.47 3.22 Favored Glycine 0 CA--C 1.523 0.55 0 C-N-CA 121.123 -0.561 . . . . 74.530000000000001 112.822 -178.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -80.93 71.53 7.89 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.272 0.558 . . . . 63.310000000000002 110.942 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 45.6 p -106.6 172.24 6.92 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.429 0.633 . . . . 75.310000000000002 112.201 -176.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 91.1 t -111.25 128.66 67.58 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-N 115.745 -0.662 . . . . 75.129999999999995 109.981 169.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 87.2 m -83.94 115.37 22.27 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.122 0.487 . . . . 74.519999999999996 111.762 -176.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 65.1 m95 -109.07 149.76 28.81 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 116.132 -0.485 . . . . 73.109999999999999 111.612 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -112.94 116.06 29.39 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.237 -0.438 . . . . 72.109999999999999 111.078 -179.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.698 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 85.4 mt-30 -101.02 133.33 45.67 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.297 -0.411 . . . . 75.409999999999997 111.882 -179.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.437 HD12 ' HB2' ' A' ' 11' ' ' ALA . 56.7 tp -91.66 111.35 22.82 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 110.145 -0.317 . . . . 73.150000000000006 110.145 172.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 37.5 mtp180 -115.12 148.67 38.68 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 110.17 -0.307 . . . . 73.540000000000006 110.17 -178.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -115.06 160.81 19.19 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.923 0.712 . . . . 73.519999999999996 112.923 -175.057 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -71.16 -36.0 71.86 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 115.461 -0.79 . . . . 75.219999999999999 112.498 -177.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.478 ' HA ' ' C ' ' A' ' 35' ' ' PRO . 45.6 m-70 -137.45 157.14 74.49 Favored Pre-proline 0 CA--C 1.544 0.724 0 C-N-CA 122.289 0.235 . . . . 74.340000000000003 111.473 -179.365 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.478 ' C ' ' HA ' ' A' ' 34' ' ' HIS . 24.5 Cg_endo -60.47 -47.98 0.18 OUTLIER 'Cis proline' 0 C--N 1.363 1.334 0 C-N-CA 124.906 -0.872 . . . . 72.400000000000006 113.85 2.387 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -112.85 150.12 42.31 Favored Pre-proline 0 CA--C 1.538 0.489 0 CA-C-O 120.466 0.174 . . . . 74.209999999999994 110.702 175.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -65.82 -22.85 56.04 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 122.091 1.86 . . . . 71.25 112.602 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -75.88 -9.32 58.51 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 116.434 -0.348 . . . . 64.430000000000007 111.159 178.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 98.5 p -53.91 116.68 2.67 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 121.407 0.622 . . . . 63.200000000000003 112.267 -176.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 57.8 tp -95.09 117.43 30.17 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.156 -0.474 . . . . 64.129999999999995 111.006 177.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 50.3 mm -78.73 -54.23 12.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-O 120.909 0.385 . . . . 74.530000000000001 110.944 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 36.9 t -168.94 162.14 11.03 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.024 0.44 . . . . 74.040000000000006 111.729 179.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.698 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 40.6 mt-10 -116.85 138.12 51.73 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 116.003 -0.544 . . . . 72.340000000000003 110.887 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 50.4 m80 -143.25 147.27 39.81 Favored Pre-proline 0 N--CA 1.472 0.647 0 CA-C-O 120.597 0.236 . . . . 74.349999999999994 111.102 178.074 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -77.38 -4.37 14.64 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.571 2.181 . . . . 70.219999999999999 113.268 -178.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 31.1 p -128.0 144.4 51.1 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 120.831 0.348 . . . . 74.040000000000006 111.185 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.413 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -66.37 -33.71 76.34 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 120.829 0.347 . . . . 52.130000000000003 111.104 177.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -55.67 -52.13 64.9 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 116.264 -0.425 . . . . 75.030000000000001 111.116 179.331 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -58.32 -41.0 83.57 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.063 0.459 . . . . 74.010000000000005 111.533 177.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.75 -38.65 88.76 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.938 0.399 . . . . 72.439999999999998 111.27 178.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.472 ' O ' ' HG3' ' A' ' 55' ' ' LYS . 66.2 mtt -68.48 -43.51 76.76 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 116.277 -0.42 . . . . 74.200000000000003 110.884 176.344 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -54.68 -44.11 73.07 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.274 0.559 . . . . 74.209999999999994 111.236 177.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.07 -39.16 75.79 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 116.155 -0.475 . . . . 71.140000000000001 111.56 176.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.526 ' HE2' ' O ' ' A' ' 11' ' ' ALA . 62.2 tttm -56.09 -50.09 72.0 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 121.081 0.467 . . . . 75.349999999999994 110.928 177.723 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 51' ' ' MET . 62.7 mttm -61.15 -47.65 85.26 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.983 -0.553 . . . . 72.209999999999994 111.241 179.479 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 41.9 ttp180 -65.69 -25.18 67.21 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 115.969 -0.559 . . . . 73.010000000000005 111.713 -177.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.713 ' HA ' ' HG2' ' A' ' 63' ' ' GLU . 77.6 t80 -79.0 -51.58 9.4 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 121.131 0.491 . . . . 72.420000000000002 111.339 176.728 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.468 ' CD ' ' HZ1' ' A' ' 54' ' ' LYS . 50.7 mt-10 -67.4 -32.43 73.33 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 116.351 -0.386 . . . . 75.409999999999997 111.75 -177.171 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -95.84 108.91 43.45 Favored Pre-proline 0 CA--C 1.536 0.432 0 N-CA-C 110.134 -0.321 . . . . 70.140000000000001 110.134 171.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -46.08 98.55 0.03 OUTLIER 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 122.741 2.294 . . . . 63.229999999999997 113.234 -177.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -145.37 -53.13 0.28 Allowed 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.32 -0.4 . . . . 64.209999999999994 111.753 -177.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -164.15 96.76 0.8 Allowed 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 120.825 0.345 . . . . 73.209999999999994 110.767 -178.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.713 ' HG2' ' HA ' ' A' ' 57' ' ' TYR . 29.2 mt-10 -117.52 -179.43 3.73 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.274 0.472 . . . . 73.319999999999993 112.274 -173.49 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.408 HD12 ' N ' ' A' ' 64' ' ' LEU . 5.1 mp -124.45 110.1 14.1 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 116.506 -0.316 . . . . 74.450000000000003 111.087 179.698 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -115.7 -175.66 2.77 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.151 0.5 . . . . 74.530000000000001 111.39 177.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 34.5 p-80 -172.38 91.72 0.11 Allowed 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.645 -0.707 . . . . 72.420000000000002 110.605 171.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 8.3 p-80 -76.82 70.6 3.29 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 121.572 0.701 . . . . 73.230000000000004 111.691 -178.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -144.4 113.66 6.97 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.263 -0.88 . . . . 74.340000000000003 110.114 176.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 51.8 m170 -74.37 150.31 40.12 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 121.061 0.458 . . . . 73.540000000000006 111.643 -178.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -135.95 147.09 47.93 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.071 -0.513 . . . . 74.230000000000004 110.871 177.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 78.5 t60 . . . . . 0 C--O 1.251 1.133 0 CA-C-O 118.774 -0.631 . . . . 75.230000000000004 111.458 -177.933 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.589 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.8 OUTLIER . . . . . 0 N--CA 1.488 1.43 0 N-CA-C 111.665 0.246 . . . . 63.439999999999998 111.665 . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -59.63 115.99 2.98 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 122.3 2.0 . . . . 74.120000000000005 111.74 174.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 85.0 m -113.08 117.13 31.12 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.187 0.44 . . . . 72.099999999999994 112.187 -175.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -91.73 148.24 36.78 Favored Pre-proline 0 CA--C 1.54 0.563 0 CA-C-N 116.38 -0.373 . . . . 75.510000000000005 111.252 176.199 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -65.18 152.29 82.69 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 121.922 1.748 . . . . 51.5 110.843 166.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -71.84 -5.73 17.69 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 121.987 1.791 . . . . 71.420000000000002 113.649 -176.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 51.81 87.21 0.14 Allowed Pre-proline 0 CA--C 1.542 0.64 0 CA-C-O 120.922 0.391 . . . . 74.340000000000003 111.545 -175.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -51.36 112.72 0.87 Allowed 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 122.934 2.423 . . . . 75.510000000000005 112.95 -179.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.44 144.79 29.36 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 116.152 -0.476 . . . . 74.409999999999997 111.337 -176.795 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -124.53 157.17 35.99 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 121.123 0.487 . . . . 71.209999999999994 111.91 -179.533 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -138.7 -174.85 3.94 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 116.174 -0.466 . . . . 63.409999999999997 111.7 -179.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -159.56 169.66 23.34 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.92 0.39 . . . . 75.400000000000006 111.325 179.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.9 mt -112.12 139.15 38.11 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 CA-C-O 120.995 0.426 . . . . 74.109999999999999 111.7 179.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.495 HG22 ' HD2' ' A' ' 31' ' ' ARG . 89.3 t -115.62 136.31 52.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 CA-C-N 116.444 -0.344 . . . . 71.519999999999996 110.79 175.863 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 50.7 p -104.09 113.2 26.57 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 112.184 0.439 . . . . 71.239999999999995 112.184 -178.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 38.8 pt -114.06 168.09 6.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 CA-C-N 116.432 -0.349 . . . . 72.450000000000003 110.994 176.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -126.12 134.68 51.27 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 121.218 0.532 . . . . 74.150000000000006 111.611 -177.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -129.15 160.24 33.49 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 116.231 -0.441 . . . . 72.420000000000002 111.294 178.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.52 -137.22 13.13 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 121.132 -0.556 . . . . 63.109999999999999 113.91 177.393 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -87.66 144.28 35.05 Favored Pre-proline 0 N--CA 1.469 0.507 0 O-C-N 122.682 -0.305 . . . . 63.299999999999997 111.64 -176.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -50.81 -43.78 44.81 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 122.987 2.458 . . . . 75.219999999999999 113.685 -177.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.08 -61.23 3.31 Favored Glycine 0 CA--C 1.526 0.725 0 C-N-CA 121.117 -0.564 . . . . 44.509999999999998 112.747 179.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -100.06 84.09 2.8 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.111 0.481 . . . . 64.510000000000005 111.161 178.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 48.2 p -85.69 159.13 19.88 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.405 0.622 . . . . 74.120000000000005 111.936 178.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 57.4 t -109.3 124.11 65.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 CA-C-N 115.899 -0.591 . . . . 74.439999999999998 109.983 173.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 85.8 m -80.91 115.27 20.31 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.11 0.481 . . . . 74.420000000000002 111.643 -178.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 60.7 m95 -105.75 131.25 53.33 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.027 -0.533 . . . . 74.340000000000003 110.999 176.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 51.9 m-85 -97.09 114.18 25.82 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.138 -0.483 . . . . 62.140000000000001 111.087 -178.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.543 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 87.7 mt-30 -91.83 108.81 20.18 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.223 -0.444 . . . . 70.510000000000005 111.186 176.531 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.0 tp -71.1 109.54 5.23 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.026 0.441 . . . . 61.009999999999998 110.434 172.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.495 ' HD2' HG22 ' A' ' 14' ' ' VAL . 58.5 mtt180 -125.17 158.11 34.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.145 0.498 . . . . 74.200000000000003 111.406 -178.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -118.14 157.44 26.92 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.236 -0.438 . . . . 75.109999999999999 110.325 172.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.455 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 29.4 t70 -86.82 -20.12 28.01 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.441 0.638 . . . . 75.340000000000003 110.486 174.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 48.5 m80 -126.65 138.78 33.19 Favored Pre-proline 0 CA--C 1.542 0.644 0 CA-C-N 115.9 -0.591 . . . . 73.439999999999998 110.858 -179.084 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -82.69 -1.34 52.59 Favored 'Cis proline' 0 CA--C 1.542 0.882 0 C-N-CA 124.292 -1.128 . . . . 74.200000000000003 113.417 0.011 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -136.99 142.77 39.68 Favored Pre-proline 0 N--CA 1.469 0.515 0 CA-C-N 116.311 -0.404 . . . . 71.109999999999999 110.409 177.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.455 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 55.6 Cg_endo -71.15 -37.13 6.33 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 122.264 1.976 . . . . 73.200000000000003 112.817 -177.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -89.0 24.44 2.09 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.984 -0.448 . . . . 74.319999999999993 111.725 176.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.9 p -65.26 97.38 0.27 Allowed 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.223 0.535 . . . . 75.099999999999994 110.904 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 37.7 tp -78.85 102.83 8.41 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 120.99 0.424 . . . . 75.019999999999996 111.143 -178.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 39.3 mm -84.33 -47.86 17.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-O 120.983 0.42 . . . . 73.340000000000003 111.205 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 43.7 t -164.3 157.08 17.28 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 116.426 -0.352 . . . . 74.129999999999995 111.945 -178.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.543 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 45.2 mt-10 -130.36 125.03 33.61 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 122.453 0.301 . . . . 75.340000000000003 110.816 176.256 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 33.4 m80 -139.6 146.17 46.71 Favored Pre-proline 0 N--CA 1.473 0.71 0 CA-C-O 120.693 0.283 . . . . 72.200000000000003 111.615 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -76.28 -12.14 19.12 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.573 2.182 . . . . 65.310000000000002 113.411 -176.053 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 32.2 p -118.54 142.89 47.16 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 120.897 0.38 . . . . 71.140000000000001 111.219 178.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.73 -33.21 75.34 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 120.612 0.244 . . . . 71.040000000000006 111.401 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 26.0 tp60 -53.85 -48.17 70.24 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.471 -0.331 . . . . 73.409999999999997 111.505 177.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -62.73 -42.67 99.77 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.889 0.376 . . . . 74.150000000000006 111.545 177.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.58 -43.94 92.27 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.333 -0.394 . . . . 72.129999999999995 111.575 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 90.8 mtp -67.08 -39.21 86.77 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.362 -0.381 . . . . 74.409999999999997 111.399 179.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.408 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 37.9 t70 -63.56 -40.35 96.77 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 120.961 0.41 . . . . 75.349999999999994 111.157 177.405 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -75.49 -32.8 60.68 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 116.132 -0.486 . . . . 61.140000000000001 111.433 177.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.423 ' HZ1' ' CD ' ' A' ' 58' ' ' GLU . 65.4 tttm -59.55 -52.21 66.54 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.471 -0.331 . . . . 72.420000000000002 111.242 179.191 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.408 ' HG2' ' O ' ' A' ' 52' ' ' ASP . 19.3 pttm -58.45 -25.97 62.82 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.383 0.611 . . . . 75.120000000000005 110.985 177.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -78.08 -44.78 25.29 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.8 -0.637 . . . . 74.409999999999997 111.397 -179.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -68.32 -37.03 80.16 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.915 0.388 . . . . 75.310000000000002 111.377 178.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.423 ' CD ' ' HZ1' ' A' ' 54' ' ' LYS . 54.7 mt-10 -78.56 13.87 1.47 Allowed 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.436 -0.347 . . . . 63.140000000000001 111.915 -178.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -108.39 92.84 10.44 Favored Pre-proline 0 CA--C 1.544 0.742 0 N-CA-C 110.118 -0.327 . . . . 71.049999999999997 110.118 175.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -87.32 13.33 2.7 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 122.571 2.181 . . . . 64.329999999999998 113.02 -179.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -109.99 -44.41 3.79 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 112.26 0.467 . . . . 72.040000000000006 112.26 -173.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.579 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 0.6 OUTLIER -93.39 117.62 30.3 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.615 0.598 . . . . 60.299999999999997 112.615 -174.179 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -125.52 157.42 37.09 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 116.061 -0.518 . . . . 75.319999999999993 110.095 171.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.446 ' N ' HD23 ' A' ' 64' ' ' LEU . 1.8 pt? -146.66 145.9 30.19 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.257 0.551 . . . . 73.120000000000005 112.045 -176.177 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -81.91 80.38 8.2 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 112.66 0.615 . . . . 74.439999999999998 112.66 -173.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 28.7 m170 -132.96 -52.12 0.91 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 116.19 -0.459 . . . . 74.239999999999995 110.617 173.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -137.29 131.1 31.79 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 116.221 -0.445 . . . . 72.030000000000001 111.027 178.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 32.3 t-80 -67.43 104.24 1.5 Allowed 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 109.79 -0.448 . . . . 74.310000000000002 109.79 176.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 32.9 p-80 -76.69 30.2 0.13 Allowed 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.23 0.826 . . . . 73.239999999999995 113.23 -169.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 49.8 t-80 -158.79 141.02 13.97 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 122.19 -0.319 . . . . 75.299999999999997 110.988 177.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 71.7 m80 . . . . . 0 C--O 1.25 1.124 0 CA-C-O 118.652 -0.69 . . . . 75.409999999999997 111.131 177.017 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.2 mtm . . . . . 0 N--CA 1.487 1.402 0 CA-C-O 120.855 0.36 . . . . 72.109999999999999 110.658 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -79.04 151.05 23.6 Favored 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 122.785 2.324 . . . . 73.230000000000004 113.506 -175.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 5.0 t -82.98 81.41 8.67 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.66 0.743 . . . . 74.5 110.273 174.23 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -64.37 112.16 7.11 Favored Pre-proline 0 CA--C 1.545 0.785 0 N-CA-C 113.235 0.828 . . . . 74.049999999999997 113.235 -170.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -94.65 159.14 1.89 Allowed 'Trans proline' 0 CA--C 1.548 1.198 0 C-N-CA 123.347 2.698 . . . . 74.219999999999999 113.025 175.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -90.51 142.34 3.47 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 122.91 2.407 . . . . 71.25 112.879 175.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -90.42 121.43 68.47 Favored Pre-proline 0 CA--C 1.541 0.627 0 CA-C-O 120.659 0.266 . . . . 72.209999999999994 110.979 179.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.424 ' HB2' ' H ' ' A' ' 9' ' ' ARG . 72.8 Cg_endo -74.4 -146.09 0.03 OUTLIER 'Trans proline' 0 CA--C 1.549 1.246 0 C-N-CA 122.89 2.393 . . . . 73.219999999999999 113.504 -179.271 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.424 ' H ' ' HB2' ' A' ' 8' ' ' PRO . 0.3 OUTLIER -152.84 85.48 1.24 Allowed 'General case' 0 CA--C 1.547 0.852 0 CA-C-O 121.368 0.604 . . . . 72.530000000000001 111.603 -173.772 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -85.96 139.04 31.55 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.418 0.525 . . . . 62.229999999999997 112.418 -176.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.51 160.42 21.77 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.086 -0.506 . . . . 74.230000000000004 111.594 178.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 50.6 p90 -142.59 145.38 33.49 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.471 -0.331 . . . . 72.120000000000005 110.819 177.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 62.2 mt -104.01 131.32 53.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-O 121.074 0.464 . . . . 75.420000000000002 111.838 -178.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 63.0 t -116.03 125.49 73.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 CA-C-N 116.246 -0.434 . . . . 51.530000000000001 111.043 177.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 42.9 p -87.19 120.84 28.88 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 120.975 0.417 . . . . 74.200000000000003 111.39 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.448 HD11 ' NE2' ' A' ' 29' ' ' GLN . 35.1 pt -118.08 166.9 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-O 120.863 0.363 . . . . 73.400000000000006 111.348 178.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.435 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 44.0 mt-10 -125.1 114.82 19.56 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.494 -0.321 . . . . 62.229999999999997 110.865 178.486 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -122.45 174.16 7.21 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 116.608 -0.269 . . . . 64.319999999999993 111.661 -177.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.71 -136.89 12.94 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 121.013 -0.613 . . . . 73.129999999999995 112.808 -178.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -79.21 153.91 77.04 Favored Pre-proline 0 CA--C 1.539 0.545 0 O-C-N 122.469 -0.43 . . . . 73.109999999999999 111.22 178.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -57.78 -44.23 42.71 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.396 2.064 . . . . 74.310000000000002 112.474 176.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -82.89 -46.01 6.46 Favored Glycine 0 CA--C 1.528 0.853 0 C-N-CA 121.301 -0.476 . . . . 43.210000000000001 112.839 177.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -96.83 79.5 2.94 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.1 0.476 . . . . 74.430000000000007 111.286 178.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.435 ' HB ' ' HB3' ' A' ' 17' ' ' GLU . 69.3 p -88.23 146.18 25.49 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.969 -0.56 . . . . 74.150000000000006 111.54 178.194 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 54.8 t -109.47 128.6 65.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.917 -0.583 . . . . 73.439999999999998 110.33 174.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 94.6 m -79.21 114.22 17.97 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.135 0.493 . . . . 73.209999999999994 111.082 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -110.07 131.29 55.19 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 116.146 -0.479 . . . . 74.25 111.52 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -93.28 114.21 26.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.834 0.35 . . . . 74.349999999999994 110.538 176.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.805 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 72.9 mt-30 -98.01 113.65 25.56 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.412 -0.358 . . . . 72.219999999999999 111.668 -179.342 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 54.8 tp -79.53 116.72 19.91 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.352 -0.385 . . . . 74.409999999999997 110.513 174.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.414 HH11 ' HD3' ' A' ' 31' ' ' ARG . 51.7 mtt180 -129.26 170.5 13.53 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.869 0.366 . . . . 75.25 111.97 -177.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -136.01 167.09 21.88 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.981 0.42 . . . . 73.519999999999996 111.129 175.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -95.53 -9.74 31.57 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 112.271 0.471 . . . . 74.040000000000006 112.271 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 39.9 m80 -142.81 149.53 50.18 Favored Pre-proline 0 CA--C 1.541 0.606 0 O-C-N 122.357 -0.214 . . . . 73.239999999999995 110.95 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -70.54 -21.98 10.61 Favored 'Cis proline' 0 C--N 1.356 0.95 0 C-N-CA 124.392 -1.087 . . . . 70.430000000000007 113.244 -0.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -118.55 135.28 23.57 Favored Pre-proline 0 N--CA 1.47 0.557 0 CA-C-N 116.705 -0.225 . . . . 73.019999999999996 110.708 176.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.0 -27.21 84.37 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 122.219 1.946 . . . . 64.109999999999999 111.592 174.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -77.77 -2.39 36.09 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 115.2 -0.909 . . . . 74.230000000000004 112.504 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 90.2 p -58.44 110.46 0.98 Allowed 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.271 0.558 . . . . 73.310000000000002 112.327 -173.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 56.4 tp -104.03 114.45 28.71 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.918 -0.583 . . . . 75.209999999999994 110.463 176.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.3 mm -83.64 -53.6 10.91 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 116.288 -0.415 . . . . 74.340000000000003 111.935 -177.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 40.6 t -162.78 157.53 21.64 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.389 0.514 . . . . 70.120000000000005 112.389 -175.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.805 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 37.4 mt-10 -120.96 118.41 29.79 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 116.243 -0.435 . . . . 73.019999999999996 110.753 177.135 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 61.8 m170 -123.49 143.6 41.9 Favored Pre-proline 0 N--CA 1.475 0.791 0 O-C-N 122.375 -0.203 . . . . 74.0 111.278 -178.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -70.1 -22.93 29.85 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 122.632 2.221 . . . . 74.430000000000007 114.13 -176.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.443 ' OG1' ' HB2' ' A' ' 49' ' ' GLU . 59.6 p -120.74 153.78 36.52 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.11 0.481 . . . . 71.510000000000005 111.508 178.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.17 -45.32 70.31 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.262 -0.426 . . . . 73.200000000000003 111.811 -177.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.81 -50.58 70.14 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 120.954 0.407 . . . . 64.319999999999993 110.637 179.346 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.443 ' HB2' ' OG1' ' A' ' 46' ' ' THR . 0.7 OUTLIER -56.28 -39.59 72.92 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 121.357 0.599 . . . . 73.310000000000002 110.45 178.718 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.74 -41.29 75.47 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 116.292 -0.413 . . . . 45.340000000000003 111.857 177.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 85.1 mtp -67.59 -34.67 77.49 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 112.075 0.398 . . . . 73.319999999999993 112.075 -178.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.657 ' HA ' ' HE3' ' A' ' 55' ' ' LYS . 4.6 t70 -64.5 -30.86 71.89 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-O 121.128 0.489 . . . . 75.030000000000001 110.934 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -75.88 -40.3 54.78 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.343 0.592 . . . . 72.430000000000007 110.618 170.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 66.4 tttm -54.84 -47.51 74.06 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 115.563 -0.744 . . . . 75.439999999999998 111.691 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.657 ' HE3' ' HA ' ' A' ' 52' ' ' ASP . 18.6 ptpt -57.71 -38.86 75.98 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 116.558 -0.292 . . . . 74.530000000000001 111.521 179.347 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.451 ' HG2' ' HB2' ' A' ' 62' ' ' LYS . 80.1 ttt180 -73.79 -26.02 60.42 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 120.821 0.343 . . . . 75.239999999999995 111.798 -178.562 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -73.33 -51.27 18.08 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 120.854 0.359 . . . . 74.310000000000002 110.999 175.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -73.02 -34.51 66.4 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.241 -0.436 . . . . 72.120000000000005 112.096 -176.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -100.43 171.89 5.08 Favored Pre-proline 0 CA--C 1.549 0.906 0 CA-C-N 116.365 -0.38 . . . . 51.130000000000003 111.434 179.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -60.49 -171.45 0.07 OUTLIER 'Trans proline' 0 CA--C 1.547 1.136 0 C-N-CA 122.6 2.2 . . . . 73.209999999999994 113.56 174.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.9 t70 77.81 19.49 1.13 Allowed 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.701 0.801 . . . . 73.420000000000002 111.091 -175.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.451 ' HB2' ' HG2' ' A' ' 56' ' ' ARG . 64.4 tttp -140.05 145.56 37.86 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.806 -0.634 . . . . 73.439999999999998 110.712 175.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -70.94 158.18 36.91 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.308 0.575 . . . . 74.349999999999994 112.135 178.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.412 HD22 ' N ' ' A' ' 64' ' ' LEU . 3.2 mm? -70.19 129.03 38.29 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.966 -0.561 . . . . 73.400000000000006 111.249 178.597 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.18 -30.22 34.41 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 120.95 0.405 . . . . 65.010000000000005 111.735 -177.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 35.2 t-80 -104.91 69.52 0.87 Allowed 'General case' 0 CA--C 1.547 0.854 0 CA-C-O 120.996 0.427 . . . . 72.109999999999999 110.87 -178.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 -87.94 10.99 16.95 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-O 121.085 0.469 . . . . 75.349999999999994 112.193 -174.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 27.3 m80 -138.64 135.45 34.89 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 122.437 0.295 . . . . 74.129999999999995 110.772 174.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 8.0 p80 -149.28 95.49 2.38 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 113.036 0.754 . . . . 71.519999999999996 113.036 -177.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 33.3 p80 -97.82 179.63 4.74 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 116.159 -0.473 . . . . 75.200000000000003 110.392 170.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 20.9 p80 . . . . . 0 C--O 1.251 1.161 0 CA-C-O 119.58 -0.247 . . . . 75.230000000000004 111.629 176.934 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.8 mtt . . . . . 0 N--CA 1.49 1.527 0 CA-C-O 120.608 0.242 . . . . 75.209999999999994 110.834 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -62.12 103.96 0.32 Allowed 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 122.675 2.25 . . . . 74.530000000000001 113.363 -178.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 68.5 p -87.58 140.32 29.65 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 116.57 -0.286 . . . . 74.200000000000003 111.38 178.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.52 ' N ' ' HD3' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -146.26 108.63 4.22 Favored Pre-proline 0 CA--C 1.545 0.772 0 CA-C-O 121.012 0.434 . . . . 75.239999999999995 111.74 -178.092 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -87.5 150.45 7.67 Favored 'Trans proline' 0 CA--C 1.545 1.065 0 C-N-CA 122.889 2.393 . . . . 75.140000000000001 113.226 176.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -55.56 153.94 27.09 Favored 'Trans proline' 0 CA--C 1.544 0.99 0 C-N-CA 122.912 2.408 . . . . 61.030000000000001 113.308 178.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.4 p90 -62.47 132.27 94.24 Favored Pre-proline 0 CA--C 1.544 0.745 0 N-CA-C 112.285 0.476 . . . . 73.400000000000006 112.285 -178.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -74.94 116.03 4.47 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 122.565 2.177 . . . . 75.219999999999999 112.441 174.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.7 ptp85 -78.09 154.19 31.54 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.666 0.617 . . . . 75.099999999999994 112.666 -175.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.542 ' HA ' ' HG2' ' A' ' 58' ' ' GLU . 13.2 pt-20 -132.63 165.52 24.24 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.147 -0.479 . . . . 71.430000000000007 110.736 172.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.443 ' HB2' ' CD2' ' A' ' 57' ' ' TYR . . . -124.29 171.87 9.54 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 120.794 0.33 . . . . 70.420000000000002 111.534 179.259 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 36.9 p90 -147.36 157.62 43.65 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.139 0.495 . . . . 71.310000000000002 111.923 178.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 58.6 mt -100.4 137.26 28.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 CA-C-N 116.073 -0.512 . . . . 74.150000000000006 111.838 -177.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 61.1 t -117.07 127.44 74.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-N 116.163 -0.471 . . . . 74.230000000000004 110.571 177.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 65.1 p -95.06 114.41 26.21 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.017 0.437 . . . . 73.510000000000005 111.861 -178.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.4 pt -121.51 172.18 9.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 121.021 0.439 . . . . 74.239999999999995 111.259 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.404 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 1.6 mp0 -128.91 148.84 50.95 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 120.856 0.36 . . . . 61.149999999999999 111.057 177.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -134.15 166.68 22.21 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-O 120.844 0.354 . . . . 74.420000000000002 111.441 178.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.53 -143.17 16.17 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 121.234 -0.508 . . . . 71.430000000000007 113.734 178.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -81.26 142.93 51.43 Favored Pre-proline 0 N--CA 1.471 0.577 0 O-C-N 122.575 -0.368 . . . . 72.150000000000006 111.636 -178.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -53.44 116.93 3.3 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.371 2.048 . . . . 63.130000000000003 112.365 176.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 97.61 -67.41 0.8 Allowed Glycine 0 CA--C 1.526 0.751 0 C-N-CA 121.249 -0.501 . . . . 61.119999999999997 112.283 -174.37 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -80.95 75.56 7.91 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 121.361 0.6 . . . . 74.430000000000007 110.277 176.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.404 ' HB ' ' HB3' ' A' ' 17' ' ' GLU . 64.7 p -107.84 163.91 12.71 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.596 -0.729 . . . . 61.420000000000002 112.895 -173.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 59.0 t -110.14 127.65 66.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-N 115.489 -0.778 . . . . 74.430000000000007 110.201 171.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 51.4 m -82.26 118.86 23.44 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.402 0.519 . . . . 72.230000000000004 112.402 -175.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 67.7 m95 -110.37 149.42 30.27 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.191 -0.458 . . . . 75.5 111.512 178.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -110.2 114.63 28.27 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.878 0.371 . . . . 74.140000000000001 111.193 178.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.719 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 72.8 mt-30 -95.59 121.57 37.43 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.919 0.39 . . . . 75.140000000000001 111.542 178.23 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.6 tp -83.02 109.89 17.5 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.571 -0.286 . . . . 74.409999999999997 110.322 173.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 53.2 mtt180 -123.4 162.17 23.3 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.448 0.642 . . . . 74.420000000000002 112.184 -178.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -140.83 -179.35 6.01 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.516 -0.765 . . . . 74.040000000000006 110.72 175.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.504 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 20.4 m-20 -103.1 -0.98 29.87 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.203 0.525 . . . . 54.439999999999998 111.209 175.512 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -123.72 129.54 24.79 Favored Pre-proline 0 CA--C 1.544 0.725 0 CA-C-N 116.354 -0.384 . . . . 71.510000000000005 111.066 -178.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -78.76 -14.86 30.23 Favored 'Cis proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.757 -1.351 . . . . 74.5 113.206 -1.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -129.03 143.32 48.31 Favored Pre-proline 0 N--CA 1.472 0.663 0 C-N-CA 122.445 0.298 . . . . 75.219999999999999 111.101 -178.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.504 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 53.8 Cg_exo -54.54 -28.9 57.43 Favored 'Trans proline' 0 CA--C 1.545 1.073 0 C-N-CA 122.338 2.025 . . . . 72.5 113.023 174.26 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -88.98 16.64 6.7 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-O 121.03 0.443 . . . . 63.039999999999999 111.309 177.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 83.1 p -66.52 96.13 0.36 Allowed 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.45 0.643 . . . . 63.240000000000002 111.474 -179.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 56.7 tp -87.26 107.6 18.57 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.071 -0.513 . . . . 73.310000000000002 110.539 176.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 44.0 mm -73.47 -53.96 16.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 120.914 0.388 . . . . 75.239999999999995 111.054 178.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 70.1 m -163.55 149.94 11.87 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 120.953 0.406 . . . . 70.109999999999999 111.691 -178.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.719 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 42.4 mt-10 -108.2 119.22 38.85 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 116.181 -0.463 . . . . 74.5 110.511 174.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . 0.461 ' HB3' ' HB2' ' A' ' 49' ' ' GLU . 37.7 m170 -128.23 151.14 75.8 Favored Pre-proline 0 CA--C 1.543 0.696 0 N-CA-C 112.187 0.439 . . . . 64.409999999999997 112.187 -176.608 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.35 -31.89 8.71 Favored 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 122.857 2.371 . . . . 73.540000000000006 114.358 -176.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.44 ' OG1' ' HG2' ' A' ' 49' ' ' GLU . 43.9 p -115.06 152.05 33.18 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.192 0.52 . . . . 65.25 111.886 -177.266 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.48 -29.94 70.29 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.009 -0.541 . . . . 71.140000000000001 110.758 175.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 25.0 tp60 -59.09 -51.33 70.52 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.475 -0.33 . . . . 63.200000000000003 111.281 175.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.461 ' HB2' ' HB3' ' A' ' 44' ' ' HIS . 78.9 mm-40 -62.96 -30.93 71.96 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.086 0.469 . . . . 54.219999999999999 111.475 178.591 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.89 -47.93 34.49 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.392 -0.367 . . . . 62.439999999999998 111.35 177.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 90.1 mmm -64.59 -43.43 93.87 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 112.307 0.484 . . . . 74.319999999999993 112.307 -178.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.508 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 16.8 t70 -59.31 -51.14 71.24 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.821 0.343 . . . . 73.420000000000002 111.11 -179.343 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.39 -36.45 84.01 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.273 0.559 . . . . 64.150000000000006 111.296 176.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.523 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 43.7 tttp -53.94 -49.96 67.53 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.855 -0.612 . . . . 75.239999999999995 111.469 176.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -65.71 -27.02 68.03 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.231 0.456 . . . . 74.420000000000002 112.231 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.508 ' HG3' ' O ' ' A' ' 52' ' ' ASP . 44.9 mtt180 -72.94 -29.08 62.82 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 120.943 0.402 . . . . 75.040000000000006 111.073 177.259 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.443 ' CD2' ' HB2' ' A' ' 11' ' ' ALA . 89.5 t80 -77.35 -37.05 53.11 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.287 0.565 . . . . 75.439999999999998 110.849 174.125 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.542 ' HG2' ' HA ' ' A' ' 10' ' ' GLU . 56.6 mt-10 -76.97 -25.45 52.8 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.006 -0.543 . . . . 65.150000000000006 111.639 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -119.07 96.75 50.35 Favored Pre-proline 0 CA--C 1.54 0.571 0 CA-C-O 120.698 0.285 . . . . 62.399999999999999 110.345 175.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -64.83 76.66 0.2 Allowed 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 122.839 2.359 . . . . 71.310000000000002 112.828 -177.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -90.93 -58.91 2.31 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 116.137 -0.483 . . . . 75.409999999999997 111.287 179.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 40.5 ttpt -75.37 -73.09 0.27 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 120.737 0.303 . . . . 74.400000000000006 111.44 179.363 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -165.32 -173.47 2.84 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 116.592 -0.277 . . . . 75.420000000000002 110.583 179.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.505 ' N ' HD23 ' A' ' 64' ' ' LEU . 1.7 pt? -146.3 103.34 3.69 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 121.237 0.541 . . . . 64.420000000000002 111.605 178.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -64.86 102.49 0.6 Allowed 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 121.293 0.568 . . . . 72.239999999999995 110.884 179.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 31.5 p-80 -105.3 141.14 37.34 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 112.731 0.641 . . . . 71.140000000000001 112.731 -169.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 53.4 t-80 50.1 95.46 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 113.416 0.895 . . . . 71.25 113.416 176.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 28.5 p80 -161.67 166.69 26.38 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.192 0.52 . . . . 64.349999999999994 112.205 176.142 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -57.5 141.86 46.2 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 115.648 -0.706 . . . . 61.240000000000002 112.133 -179.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 9.8 m-70 -76.07 91.28 3.1 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 110.139 -0.319 . . . . 74.5 110.139 175.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 51.7 t-80 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 119.471 -0.299 . . . . 74.400000000000006 111.482 -178.803 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.697 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 121.124 0.488 . . . . 73.040000000000006 112.106 . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.43 ' HD3' ' H3 ' ' A' ' 1' ' ' MET . 55.2 Cg_endo -105.84 52.3 0.02 OUTLIER 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 123.844 3.029 . . . . 74.450000000000003 113.113 175.535 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.558 ' O ' ' HB2' ' A' ' 4' ' ' LYS . 74.9 p -81.26 55.02 2.42 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.774 0.657 . . . . 73.129999999999995 112.774 -174.428 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.558 ' HB2' ' O ' ' A' ' 3' ' ' THR . 4.0 ttpm? 169.24 91.55 0.03 OUTLIER Pre-proline 0 N--CA 1.477 0.917 0 C-N-CA 123.931 0.892 . . . . 71.519999999999996 109.692 170.51 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -77.01 157.73 34.32 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 122.744 2.296 . . . . 71.200000000000003 113.667 -174.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -67.03 -174.86 0.53 Allowed 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.75 2.3 . . . . 65.299999999999997 112.593 174.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.3 t80 68.95 95.06 0.05 OUTLIER Pre-proline 0 N--CA 1.474 0.757 0 CA-C-O 121.104 0.478 . . . . 70.439999999999998 111.477 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -82.47 167.78 15.05 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 122.537 2.158 . . . . 73.209999999999994 112.747 176.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.515 ' H ' ' HD3' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -130.9 132.85 45.38 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.813 0.339 . . . . 70.25 110.844 177.619 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -151.16 109.32 3.74 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.249 -0.432 . . . . 61.219999999999999 110.518 179.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -93.31 153.84 18.33 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.914 0.388 . . . . 74.450000000000003 110.838 178.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 45.2 p90 -141.09 159.34 42.41 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.188 0.518 . . . . 74.540000000000006 111.569 -179.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 67.2 mt -99.74 138.05 25.33 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-N 115.947 -0.569 . . . . 71.349999999999994 111.511 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 59.2 t -119.95 121.16 65.27 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 122.509 0.323 . . . . 75.430000000000007 110.766 176.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 32.5 p -86.77 112.59 21.84 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.463 0.542 . . . . 75.349999999999994 112.463 -178.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.5 pt -113.92 175.87 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-N 116.296 -0.411 . . . . 73.319999999999993 110.523 175.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -138.53 128.43 25.26 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.125 0.488 . . . . 74.310000000000002 111.44 179.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -115.67 159.9 20.75 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 116.531 -0.304 . . . . 63.43 111.561 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.56 -153.74 19.29 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 121.294 -0.479 . . . . 63.149999999999999 113.845 178.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -79.84 155.49 75.46 Favored Pre-proline 0 CA--C 1.54 0.566 0 O-C-N 122.668 -0.313 . . . . 73.439999999999998 111.294 -176.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -52.97 -37.68 78.66 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 122.487 2.125 . . . . 70.030000000000001 113.002 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -84.69 -48.08 5.11 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 121.106 -0.569 . . . . 74.140000000000001 112.619 175.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -99.46 83.38 2.8 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.224 0.535 . . . . 72.140000000000001 111.691 178.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 75.2 p -99.64 155.89 17.36 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.769 -0.65 . . . . 74.420000000000002 111.457 175.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 48.8 t -116.97 128.08 74.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 CA-C-N 116.089 -0.505 . . . . 74.540000000000006 110.246 174.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 36.1 m -74.44 115.35 13.87 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.762 0.315 . . . . 73.030000000000001 111.444 -179.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 67.3 m95 -113.53 131.08 56.21 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.086 0.469 . . . . 70.319999999999993 111.265 177.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -100.76 114.13 27.62 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.109 -0.496 . . . . 74.010000000000005 110.813 -179.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.458 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 78.0 mt-30 -96.29 120.58 36.85 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.885 0.374 . . . . 75.150000000000006 111.637 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 55.9 tp -83.3 107.48 15.86 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 120.737 0.304 . . . . 72.019999999999996 110.259 175.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 54.4 mtt180 -120.92 166.28 14.03 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.158 0.504 . . . . 72.310000000000002 111.787 -178.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -139.02 158.57 43.96 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.935 -0.575 . . . . 72.200000000000003 111.114 178.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -80.8 -21.72 40.67 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 116.521 -0.309 . . . . 71.319999999999993 111.686 -179.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -112.27 144.3 30.55 Favored Pre-proline 0 CA--C 1.542 0.65 0 N-CA-C 111.573 0.212 . . . . 73.010000000000005 111.573 -177.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -74.67 -28.47 7.44 Favored 'Cis proline' 0 CA--C 1.542 0.881 0 C-N-CA 123.794 -1.336 . . . . 71.439999999999998 112.98 -4.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.412 ' HB3' ' HD2' ' A' ' 37' ' ' PRO . 58.1 mttp -131.23 160.28 67.76 Favored Pre-proline 0 CA--C 1.541 0.603 0 C-N-CA 122.426 0.29 . . . . 73.239999999999995 110.941 176.028 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.412 ' HD2' ' HB3' ' A' ' 36' ' ' LYS . 28.8 Cg_endo -61.43 -7.03 7.84 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 C-N-CA 122.573 2.182 . . . . 71.099999999999994 113.173 177.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -77.79 -7.12 56.15 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.554 -0.294 . . . . 73.030000000000001 111.422 176.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 68.6 m -65.44 92.17 0.13 Allowed 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.523 0.564 . . . . 74.219999999999999 112.523 -175.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 48.7 tp -100.06 105.11 16.73 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.067 -0.515 . . . . 74.099999999999994 109.974 172.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.477 ' N ' HD12 ' A' ' 41' ' ' ILE . 2.3 mp -71.06 -53.87 19.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 CA-C-N 116.383 -0.371 . . . . 62.329999999999998 111.397 -175.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 71.1 p -169.58 149.8 3.98 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.178 0.513 . . . . 70.030000000000001 111.397 -179.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.458 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 45.2 mt-10 -100.56 140.66 34.5 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.274 -0.421 . . . . 75.430000000000007 110.795 177.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 83.0 m-70 -136.74 135.91 20.89 Favored Pre-proline 0 CA--C 1.538 0.516 0 O-C-N 122.219 -0.301 . . . . 72.200000000000003 111.183 -178.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.0 -5.57 16.47 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 122.594 2.196 . . . . 64.409999999999997 113.58 -179.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 35.8 p -136.14 155.08 50.7 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-O 120.933 0.397 . . . . 74.209999999999994 111.345 177.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.55 -41.14 89.13 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.287 -0.415 . . . . 74.219999999999999 111.725 178.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 20.1 tp60 -56.55 -51.68 67.67 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 111.396 0.147 . . . . 74.409999999999997 111.396 177.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -61.39 -29.09 69.71 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 120.93 0.395 . . . . 62.420000000000002 111.82 179.144 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.54 -47.45 40.76 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 120.889 0.376 . . . . 72.319999999999993 111.464 176.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 65.6 mtt -65.89 -35.9 81.92 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.008 0.432 . . . . 73.219999999999999 111.451 178.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -60.52 -49.93 75.58 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.34 0.59 . . . . 64.329999999999998 110.37 176.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.27 -39.32 94.25 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.803 -0.635 . . . . 74.340000000000003 111.758 176.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 44.1 tttp -54.76 -48.55 72.49 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.709 0.29 . . . . 72.140000000000001 111.76 178.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 47.4 mtmt -61.56 -48.75 79.57 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.179 0.514 . . . . 75.010000000000005 111.223 177.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 45.2 mtp180 -65.5 -26.07 67.75 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.944 -0.571 . . . . 74.329999999999998 111.97 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -71.21 -46.95 60.1 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.965 0.412 . . . . 75.140000000000001 111.214 176.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -81.49 -21.64 38.53 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 112.387 0.514 . . . . 63.25 112.387 -178.408 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 -122.28 78.65 44.35 Favored Pre-proline 0 CA--C 1.544 0.717 0 CA-C-O 120.768 0.318 . . . . 75.409999999999997 111.146 175.154 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -75.83 88.13 1.33 Allowed 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 122.579 2.186 . . . . 75.109999999999999 112.766 178.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -90.27 -23.68 21.14 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.832 0.349 . . . . 55.43 111.418 176.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.508 ' HA ' ' HE2' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -74.52 170.9 14.79 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 120.881 0.372 . . . . 74.310000000000002 111.675 -178.831 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -74.66 152.14 39.21 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 112.811 0.671 . . . . 74.430000000000007 112.811 -178.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.503 ' N ' HD13 ' A' ' 64' ' ' LEU . 5.2 mp -75.82 150.15 37.74 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.523 -0.762 . . . . 72.019999999999996 111.1 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -73.52 179.14 4.22 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.211 0.529 . . . . 73.230000000000004 111.751 178.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 52.0 m-70 -119.42 149.2 42.26 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.52 -0.309 . . . . 73.030000000000001 111.184 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 71.01 -40.09 0.47 Allowed 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.034 0.753 . . . . 75.030000000000001 113.034 178.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 52.3 m170 -60.34 103.0 0.2 Allowed 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.924 0.393 . . . . 73.299999999999997 110.622 176.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 19.8 p-80 -92.48 28.56 1.94 Allowed 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 121.079 0.466 . . . . 71.549999999999997 112.018 -174.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 78.9 t60 -65.34 139.23 58.56 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.338 -0.392 . . . . 72.519999999999996 111.442 176.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 19.4 p-80 . . . . . 0 C--O 1.25 1.117 0 CA-C-O 119.476 -0.297 . . . . 73.540000000000006 111.578 175.675 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.5 ptp . . . . . 0 N--CA 1.489 1.521 0 CA-C-O 120.477 0.179 . . . . 74.209999999999994 111.254 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -82.71 88.1 1.29 Allowed 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 122.45 2.1 . . . . 74.439999999999998 112.506 176.376 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 83.2 m -77.51 93.88 4.22 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.159 0.504 . . . . 74.140000000000001 111.53 -179.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -144.44 89.43 6.88 Favored Pre-proline 0 CA--C 1.539 0.551 0 CA-C-N 116.069 -0.514 . . . . 73.439999999999998 109.923 176.135 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -79.79 124.14 5.53 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 122.858 2.372 . . . . 62.030000000000001 112.836 179.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.401 ' O ' ' HD3' ' A' ' 8' ' ' PRO . 40.2 Cg_endo -66.06 170.81 11.1 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 122.366 2.044 . . . . 70.540000000000006 112.112 175.696 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -79.87 115.64 55.44 Favored Pre-proline 0 CA--C 1.543 0.71 0 N-CA-C 112.15 0.426 . . . . 71.239999999999995 112.15 -175.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.401 ' HD3' ' O ' ' A' ' 6' ' ' PRO . 72.9 Cg_endo -91.3 139.77 2.5 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.003 2.469 . . . . 73.319999999999993 111.891 172.152 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.44 ' HD3' ' CZ ' ' A' ' 57' ' ' TYR . 91.8 mtt-85 -93.23 144.24 25.49 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 112.578 0.585 . . . . 75.319999999999993 112.578 -176.101 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -130.72 128.26 40.49 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.682 -0.69 . . . . 63.310000000000002 110.849 178.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -131.61 154.66 48.66 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 116.161 -0.472 . . . . 65.010000000000005 110.706 178.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 13.1 p90 -135.11 146.13 48.54 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.272 0.558 . . . . 72.019999999999996 111.932 -177.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 62.9 mt -91.06 117.35 34.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 115.81 -0.632 . . . . 74.030000000000001 111.359 -177.356 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.523 HG22 ' HD2' ' A' ' 31' ' ' ARG . 61.9 t -105.61 126.63 60.86 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 CA-C-O 120.782 0.325 . . . . 74.510000000000005 111.277 -179.203 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 66.4 p -93.53 115.71 28.22 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 120.763 0.316 . . . . 74.450000000000003 111.228 178.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 42.3 pt -111.69 166.86 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 CA-C-O 121.004 0.431 . . . . 62.340000000000003 111.61 -179.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -115.34 114.98 25.85 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.257 -0.429 . . . . 64.400000000000006 111.787 -177.305 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -108.8 165.12 11.8 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 122.095 -0.378 . . . . 75.150000000000006 110.677 174.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.3 -137.09 13.06 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 121.024 -0.608 . . . . 55.450000000000003 113.652 -179.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -102.17 158.54 31.58 Favored Pre-proline 0 N--CA 1.473 0.684 0 N-CA-C 112.032 0.382 . . . . 75.140000000000001 112.032 -175.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -60.69 124.31 14.76 Favored 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 122.18 1.92 . . . . 71.150000000000006 111.714 173.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 89.27 -47.8 3.35 Favored Glycine 0 CA--C 1.525 0.692 0 C-N-CA 120.859 -0.686 . . . . 71.439999999999998 112.406 -176.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -99.08 79.15 2.31 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.347 0.594 . . . . 74.120000000000005 110.41 175.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 77.6 p -107.84 156.56 19.02 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.684 -0.689 . . . . 60.149999999999999 112.371 -175.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 63.6 t -113.27 132.31 62.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-N 115.639 -0.709 . . . . 72.420000000000002 110.359 175.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 95.0 m -79.73 117.28 20.49 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 120.912 0.387 . . . . 72.150000000000006 111.833 -179.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 76.9 m95 -114.87 131.62 56.79 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 116.377 -0.374 . . . . 75.329999999999998 111.163 175.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -92.81 114.73 27.36 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.946 0.403 . . . . 75.219999999999999 111.131 -178.305 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.634 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 86.0 mt-30 -102.08 130.13 48.58 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.472 -0.331 . . . . 73.109999999999999 111.393 177.447 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.8 tp -87.51 104.51 16.54 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.779 0.323 . . . . 65.430000000000007 110.441 174.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.523 ' HD2' HG22 ' A' ' 14' ' ' VAL . 86.5 mtt180 -111.48 154.72 24.3 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.555 -0.293 . . . . 74.209999999999994 110.953 179.079 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.29 140.25 51.49 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 120.574 0.226 . . . . 74.409999999999997 111.375 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -62.62 -24.54 67.64 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.157 0.429 . . . . 73.25 112.157 -179.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.469 ' HA ' ' C ' ' A' ' 35' ' ' PRO . 83.5 m-70 -122.18 134.22 24.69 Favored Pre-proline 0 CA--C 1.541 0.633 0 O-C-N 122.329 -0.232 . . . . 73.030000000000001 111.154 179.654 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.469 ' C ' ' HA ' ' A' ' 34' ' ' HIS . 22.2 Cg_exo -65.42 -42.12 0.66 Allowed 'Cis proline' 0 C--N 1.358 1.037 0 C-N-CA 124.643 -0.982 . . . . 70.140000000000001 113.709 3.393 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -137.0 145.85 52.27 Favored Pre-proline 0 N--CA 1.471 0.59 0 O-C-N 122.376 -0.202 . . . . 74.239999999999995 110.688 178.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -50.84 -22.0 9.28 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 C-N-CA 122.933 2.422 . . . . 74.430000000000007 113.914 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -84.23 10.89 9.23 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-O 121.052 0.453 . . . . 72.409999999999997 111.677 178.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 66.5 m -81.1 100.31 8.97 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.098 0.475 . . . . 71.209999999999994 111.109 178.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 56.3 tp -87.1 116.52 25.22 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.193 -0.458 . . . . 73.430000000000007 111.366 -179.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 47.8 mm -76.76 -54.87 12.31 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-O 120.663 0.268 . . . . 74.540000000000006 110.835 176.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 64.0 m -165.8 154.1 11.12 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.603 0.361 . . . . 73.319999999999993 111.404 179.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.634 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 50.8 mt-10 -100.31 150.11 22.92 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.03 0.443 . . . . 72.310000000000002 111.448 176.409 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . 0.457 ' ND1' ' HB3' ' A' ' 49' ' ' GLU . 89.7 m-70 -147.08 142.2 16.73 Favored Pre-proline 0 CA--C 1.542 0.649 0 CA-C-N 116.454 -0.339 . . . . 75.299999999999997 111.215 176.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -74.6 -25.09 13.08 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 122.31 2.006 . . . . 73.510000000000005 113.243 177.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 31.2 p -114.9 151.01 34.74 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-O 121.179 0.514 . . . . 75.409999999999997 111.737 -179.311 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.23 -44.25 92.44 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.062 -0.517 . . . . 73.209999999999994 112.303 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 24.0 tp60 -53.45 -42.56 67.27 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 111.744 0.275 . . . . 73.349999999999994 111.744 -179.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.457 ' HB3' ' ND1' ' A' ' 44' ' ' HIS . 47.1 mt-10 -61.31 -43.13 99.39 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.899 0.38 . . . . 74.310000000000002 111.342 176.087 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.08 -43.67 97.9 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.059 0.457 . . . . 74.129999999999995 111.385 178.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 58.6 mtt -63.76 -38.12 89.92 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.336 0.589 . . . . 71.140000000000001 110.958 176.152 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.448 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 34.0 t70 -62.95 -51.85 65.31 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.761 -0.654 . . . . 73.519999999999996 110.971 177.592 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.16 -42.72 86.56 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 116.091 -0.504 . . . . 71.439999999999998 111.443 177.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -55.65 -49.79 71.96 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.243 -0.435 . . . . 73.209999999999994 111.052 175.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 23.5 mtpp -60.06 -28.97 68.23 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.305 -0.407 . . . . 72.219999999999999 112.056 178.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.448 ' HG3' ' O ' ' A' ' 52' ' ' ASP . 72.7 mtt180 -73.58 -40.68 63.71 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 122.062 -0.399 . . . . 62.439999999999998 110.561 176.439 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.44 ' CZ ' ' HD3' ' A' ' 9' ' ' ARG . 79.3 t80 -63.5 -33.32 75.33 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.341 0.591 . . . . 73.329999999999998 110.523 176.408 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -80.53 -34.37 35.62 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.909 -0.587 . . . . 74.120000000000005 111.836 176.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -132.5 74.86 74.73 Favored Pre-proline 0 CA--C 1.544 0.717 0 CA-C-O 120.962 0.411 . . . . 65.319999999999993 111.177 -176.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -99.08 101.61 0.06 OUTLIER 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 123.211 2.607 . . . . 75.010000000000005 113.908 -179.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -82.57 1.12 39.62 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.273 0.559 . . . . 71.230000000000004 110.912 172.052 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 32.3 mmmt -85.41 150.7 24.54 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.975 -0.557 . . . . 75.409999999999997 111.309 178.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 67.55 11.06 8.19 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 113.168 0.803 . . . . 73.349999999999994 113.168 172.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 89.8 mt -65.06 159.53 23.03 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.738 0.304 . . . . 74.010000000000005 110.834 176.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -77.7 96.83 4.96 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 112.954 0.724 . . . . 72.340000000000003 112.954 -174.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 28.6 p-80 -84.9 132.8 34.33 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 109.29 -0.633 . . . . 73.540000000000006 109.29 170.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 17.1 p80 -146.57 79.41 1.53 Allowed 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.612 0.597 . . . . 74.519999999999996 112.612 -175.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 32.6 m80 65.8 -68.37 0.12 Allowed 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 113.203 0.816 . . . . 65.109999999999999 113.203 173.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 41.3 t60 -54.85 102.42 0.06 Allowed 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 112.192 0.442 . . . . 74.420000000000002 112.192 -177.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -82.54 -61.08 1.98 Allowed 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.249 0.547 . . . . 63.049999999999997 111.227 177.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 71.8 t60 . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.742 -0.647 . . . . 73.420000000000002 111.31 -178.943 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.3 mtt . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 120.533 0.206 . . . . 75.430000000000007 111.31 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -80.26 159.71 23.16 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.401 2.067 . . . . 71.120000000000005 112.116 172.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 73.5 p -71.78 131.17 42.7 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 111.931 0.345 . . . . 64.400000000000006 111.931 -179.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt 64.38 89.38 0.1 Allowed Pre-proline 0 N--CA 1.476 0.834 0 C-N-CA 123.064 0.546 . . . . 64.349999999999994 112.38 179.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.62 159.42 48.84 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.641 2.227 . . . . 71.319999999999993 112.757 179.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_exo -67.24 160.46 47.48 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 122.624 2.216 . . . . 75.420000000000002 113.053 177.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 52.4 p90 -65.17 147.97 98.21 Favored Pre-proline 0 CA--C 1.544 0.72 0 CA-C-O 120.83 0.347 . . . . 73.329999999999998 111.75 178.074 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -69.18 153.75 71.12 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 122.485 2.123 . . . . 74.439999999999998 112.94 178.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.2 tpp85 -80.41 143.72 33.24 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.135 0.493 . . . . 74.129999999999995 111.791 -178.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -127.7 146.72 50.47 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 116.286 -0.415 . . . . 75.5 111.282 178.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -145.54 155.05 42.83 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.395 -0.366 . . . . 72.120000000000005 111.012 176.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 40.5 p90 -149.36 161.54 41.87 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.14 0.495 . . . . 75.310000000000002 111.628 -178.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 65.4 mt -101.89 136.86 31.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-O 121.077 0.465 . . . . 74.129999999999995 112.106 -177.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.447 HG23 ' HD2' ' A' ' 31' ' ' ARG . 98.4 t -119.07 126.38 75.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 116.353 -0.385 . . . . 72.319999999999993 110.802 176.391 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 46.8 p -86.64 114.42 23.33 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.587 0.232 . . . . 74.129999999999995 111.615 -179.137 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.5 HD12 ' NE2' ' A' ' 29' ' ' GLN . 37.8 pt -112.83 168.91 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 CA-C-O 121.19 0.519 . . . . 75.340000000000003 111.872 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -114.59 124.84 52.87 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.756 -0.656 . . . . 54.130000000000003 111.416 -179.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -119.25 159.61 23.75 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.764 0.316 . . . . 75.519999999999996 110.932 172.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.26 -146.21 17.6 Favored Glycine 0 CA--C 1.528 0.868 0 C-N-CA 121.314 -0.469 . . . . 65.519999999999996 113.401 -179.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -95.22 148.96 35.5 Favored Pre-proline 0 N--CA 1.471 0.606 0 N-CA-C 112.088 0.403 . . . . 73.340000000000003 112.088 -175.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -56.49 124.35 16.04 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.201 1.934 . . . . 65.120000000000005 112.065 176.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 95.17 -52.79 1.86 Allowed Glycine 0 CA--C 1.527 0.786 0 C-N-CA 121.133 -0.556 . . . . 74.239999999999995 112.384 -174.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 31.4 mm-40 -99.8 64.8 1.28 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.148 0.499 . . . . 73.329999999999998 110.882 176.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 59.9 p -92.05 167.63 11.95 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.376 0.608 . . . . 73.319999999999993 112.43 -175.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 60.8 t -124.34 124.7 69.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 CA-C-N 115.707 -0.679 . . . . 74.439999999999998 109.95 175.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 94.4 m -77.46 114.86 16.73 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.123 0.487 . . . . 60.409999999999997 112.015 -177.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 72.6 m95 -110.58 140.47 44.87 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.926 -0.579 . . . . 74.109999999999999 110.784 175.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -97.74 113.76 25.6 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 120.884 0.373 . . . . 74.0 111.298 -177.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.639 ' HG2' ' HG3' ' A' ' 43' ' ' GLU . 79.4 mt-30 -91.5 125.85 36.39 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.815 0.341 . . . . 74.430000000000007 111.362 177.726 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 60.4 tp -83.25 116.92 22.62 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.664 0.268 . . . . 74.109999999999999 110.495 173.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.447 ' HD2' HG23 ' A' ' 14' ' ' VAL . 99.0 mtt180 -126.94 164.7 20.88 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 120.926 0.393 . . . . 73.310000000000002 111.217 178.214 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -139.82 140.15 36.53 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.504 -0.316 . . . . 74.019999999999996 111.094 176.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.508 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 29.0 t70 -61.05 -38.61 86.78 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.313 0.578 . . . . 71.120000000000005 110.869 177.337 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 -105.96 130.54 22.84 Favored Pre-proline 0 CA--C 1.541 0.611 0 CA-C-N 116.105 -0.498 . . . . 72.019999999999996 110.392 177.09 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -77.45 -34.49 3.27 Favored 'Cis proline' 0 CA--C 1.545 1.033 0 C-N-CA 123.885 -1.298 . . . . 73.430000000000007 114.156 3.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -130.76 130.96 22.99 Favored Pre-proline 0 N--CA 1.474 0.766 0 O-C-N 122.393 -0.192 . . . . 74.510000000000005 110.943 -178.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.508 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 91.2 Cg_exo -45.47 -51.34 8.1 Favored 'Trans proline' 0 CA--C 1.542 0.916 0 C-N-CA 123.419 2.746 . . . . 73.519999999999996 114.49 -174.814 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -79.34 24.67 0.34 Allowed 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 112.703 0.631 . . . . 71.239999999999995 112.703 -177.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 45.2 p -66.6 89.77 0.15 Allowed 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.161 0.505 . . . . 74.530000000000001 111.413 177.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 38.2 tp -72.7 104.1 3.83 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 120.887 0.375 . . . . 64.209999999999994 111.476 178.087 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.3 mm -74.88 -54.1 15.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 116.272 -0.422 . . . . 73.319999999999993 110.754 175.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 29.3 t -175.76 149.87 0.99 Allowed 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 116.351 -0.386 . . . . 53.130000000000003 111.904 -178.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.639 ' HG3' ' HG2' ' A' ' 29' ' ' GLN . 1.9 mp0 -89.39 125.99 35.37 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 116.534 -0.303 . . . . 72.230000000000004 110.381 173.525 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 11.9 m170 -116.52 146.93 38.61 Favored Pre-proline 0 CA--C 1.542 0.638 0 C-N-CA 122.574 0.349 . . . . 61.020000000000003 111.008 179.519 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -67.0 -40.37 11.94 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.827 2.352 . . . . 75.239999999999995 114.173 -173.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.504 ' OG1' ' HB2' ' A' ' 49' ' ' GLU . 29.9 p -120.37 153.51 36.4 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 122.064 -0.398 . . . . 73.209999999999994 111.243 -179.435 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.21 -41.71 79.95 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 120.896 0.379 . . . . 74.310000000000002 111.251 178.02 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.27 -43.75 98.37 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 116.288 -0.415 . . . . 74.019999999999996 110.752 176.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.504 ' HB2' ' OG1' ' A' ' 46' ' ' THR . 0.6 OUTLIER -61.44 -33.1 73.16 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.343 0.592 . . . . 53.399999999999999 110.727 178.524 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.96 -42.76 56.99 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 116.212 -0.449 . . . . 73.030000000000001 111.371 176.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.559 ' SD ' ' HD3' ' A' ' 54' ' ' LYS . 22.2 mmt -57.29 -35.74 70.18 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 116.313 -0.403 . . . . 73.409999999999997 111.753 176.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -54.47 -43.83 72.06 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 116.133 -0.485 . . . . 75.319999999999993 111.088 177.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.08 -40.08 53.94 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.158 0.504 . . . . 72.200000000000003 111.408 175.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.559 ' HD3' ' SD ' ' A' ' 51' ' ' MET . 42.3 tttp -53.89 -49.76 67.84 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 115.872 -0.603 . . . . 75.530000000000001 112.004 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 60.6 mttp -53.7 -57.97 8.9 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 111.844 0.312 . . . . 74.310000000000002 111.844 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 53.0 mtp180 -62.24 -26.4 68.36 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 112.003 0.371 . . . . 64.530000000000001 112.003 -178.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.522 ' HA ' ' HB2' ' A' ' 62' ' ' LYS . 60.6 t80 -71.45 -34.47 70.28 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.002 0.43 . . . . 75.409999999999997 110.936 176.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.464 ' CD ' ' HZ2' ' A' ' 54' ' ' LYS . 44.1 mt-10 -86.25 -20.19 28.83 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.086 -0.507 . . . . 70.209999999999994 111.48 179.549 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -76.25 163.96 63.02 Favored Pre-proline 0 CA--C 1.543 0.68 0 CA-C-N 116.398 -0.365 . . . . 73.019999999999996 110.855 172.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -68.33 4.93 1.38 Allowed 'Trans proline' 0 CA--C 1.544 1.012 0 C-N-CA 122.265 1.976 . . . . 74.219999999999999 112.278 172.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -69.03 -37.09 78.41 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.219 0.608 . . . . 74.109999999999999 111.179 177.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.522 ' HB2' ' HA ' ' A' ' 57' ' ' TYR . 14.7 tppt? -72.31 156.52 39.02 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.276 0.56 . . . . 74.420000000000002 112.306 -175.063 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -82.02 167.42 18.86 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.596 0.712 . . . . 74.340000000000003 111.981 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.474 ' N ' HD23 ' A' ' 64' ' ' LEU . 1.1 pt? -130.57 70.17 1.45 Allowed 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 121.653 0.74 . . . . 73.400000000000006 110.432 178.138 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -79.55 81.75 5.77 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.227 0.537 . . . . 71.319999999999993 111.447 -176.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 36.9 t-80 -92.87 14.58 17.01 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 116.083 -0.508 . . . . 74.540000000000006 111.91 -177.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 84.1 m-70 -123.98 104.23 8.78 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.844 -0.535 . . . . 74.510000000000005 111.605 178.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 39.9 m80 -146.69 164.84 31.43 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.028 0.442 . . . . 72.340000000000003 111.001 177.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 31.7 m80 -124.11 100.67 6.83 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 120.858 0.361 . . . . 71.530000000000001 110.401 175.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 17.8 m-70 -139.18 130.88 27.42 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.852 0.358 . . . . 73.209999999999994 111.881 -178.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 32.4 m80 . . . . . 0 C--O 1.252 1.23 0 CA-C-O 119.214 -0.422 . . . . 74.420000000000002 110.798 172.338 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.9 mtt . . . . . 0 N--CA 1.489 1.512 0 N-CA-C 110.728 -0.101 . . . . 73.299999999999997 110.728 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -70.87 131.37 19.53 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 C-N-CA 122.367 2.044 . . . . 74.409999999999997 112.979 -179.27 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 31.9 p -76.27 -22.06 55.54 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 116.493 -0.321 . . . . 75.219999999999999 111.483 177.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt 67.62 91.85 0.07 OUTLIER Pre-proline 0 N--CA 1.472 0.663 0 N-CA-C 112.586 0.587 . . . . 72.310000000000002 112.586 171.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_exo -72.98 148.64 45.55 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 122.675 2.25 . . . . 71.230000000000004 112.304 174.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.88 60.92 4.6 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 122.401 2.067 . . . . 71.129999999999995 113.07 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 34.4 t80 63.49 97.52 0.04 OUTLIER Pre-proline 0 CA--C 1.543 0.694 0 C-N-CA 123.182 0.593 . . . . 71.420000000000002 112.247 -177.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_exo -72.55 110.49 3.0 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 122.618 2.212 . . . . 72.340000000000003 112.126 176.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.2 mpt_? -64.35 137.64 58.01 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 120.917 0.389 . . . . 74.430000000000007 111.368 -178.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.458 ' HA ' ' HG2' ' A' ' 58' ' ' GLU . 42.1 tt0 -133.53 150.51 51.67 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.975 0.417 . . . . 73.030000000000001 111.698 -178.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.434 ' O ' ' NZ ' ' A' ' 54' ' ' LYS . . . -124.89 175.06 7.54 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.049 -0.523 . . . . 72.129999999999995 110.96 177.415 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 41.2 p90 -148.47 153.09 38.0 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.098 0.475 . . . . 74.329999999999998 111.693 177.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 63.5 mt -101.66 135.51 37.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 116.107 -0.497 . . . . 74.329999999999998 111.557 -176.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.41 HG23 ' HD2' ' A' ' 31' ' ' ARG . 61.6 t -119.28 138.71 49.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-N 116.585 -0.28 . . . . 74.129999999999995 111.23 178.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 80.3 p -101.24 117.33 34.77 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 120.522 0.201 . . . . 73.239999999999995 111.506 178.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.489 HD11 ' NE2' ' A' ' 29' ' ' GLN . 42.8 pt -120.11 168.47 12.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-O 120.871 0.367 . . . . 75.349999999999994 111.614 178.573 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.411 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 47.4 mt-10 -116.12 126.87 54.3 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 116.357 -0.383 . . . . 72.530000000000001 111.193 177.233 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.415 ' HE3' HD12 ' A' ' 16' ' ' ILE . 95.1 mttt -130.4 166.63 20.06 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.781 0.325 . . . . 74.540000000000006 111.329 176.039 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.08 -136.88 12.94 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 121.186 -0.531 . . . . 53.450000000000003 113.164 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.403 ' HB2' ' HB2' ' A' ' 23' ' ' GLN . 75.5 mmtt -75.27 147.01 82.39 Favored Pre-proline 0 CA--C 1.539 0.52 0 O-C-N 122.437 -0.449 . . . . 74.430000000000007 111.332 179.093 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_exo -53.06 -46.89 30.73 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 122.781 2.32 . . . . 74.129999999999995 113.076 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -84.33 -52.91 3.42 Favored Glycine 0 CA--C 1.526 0.745 0 C-N-CA 121.118 -0.563 . . . . 73.239999999999995 112.825 175.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.403 ' HB2' ' HB2' ' A' ' 20' ' ' LYS . 32.9 mm-40 -83.81 77.27 9.92 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.119 0.485 . . . . 62.210000000000001 111.032 177.131 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.411 ' HB ' ' HB3' ' A' ' 17' ' ' GLU . 53.0 p -88.4 152.12 22.12 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.182 0.515 . . . . 72.540000000000006 111.745 179.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 58.0 t -114.84 129.4 71.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.033 -0.531 . . . . 74.200000000000003 109.976 174.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 31.2 m -75.36 115.58 15.17 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 120.697 0.284 . . . . 72.540000000000006 111.498 -179.298 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 77.9 m95 -106.58 132.3 52.74 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.053 0.454 . . . . 64.420000000000002 110.877 175.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -97.17 114.5 26.21 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.298 0.57 . . . . 75.400000000000006 111.138 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.728 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 95.5 mt-30 -97.46 122.29 40.33 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.678 -0.692 . . . . 73.030000000000001 111.723 -178.698 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.9 tp -83.24 109.87 17.59 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 120.788 0.328 . . . . 71.420000000000002 110.299 171.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.41 ' HD2' HG23 ' A' ' 14' ' ' VAL . 87.5 mtt-85 -121.41 158.63 27.9 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.053 0.454 . . . . 73.230000000000004 111.728 -178.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -146.01 146.49 31.01 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.241 -0.436 . . . . 73.209999999999994 111.211 178.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.463 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 3.9 m-20 -62.67 -22.6 66.59 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.058 0.456 . . . . 72.049999999999997 111.847 177.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.535 ' HA ' ' C ' ' A' ' 35' ' ' PRO . 35.3 m80 -125.82 141.39 39.18 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-N 116.365 -0.379 . . . . 75.549999999999997 110.52 179.064 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.535 ' C ' ' HA ' ' A' ' 34' ' ' HIS . 31.7 Cg_exo -59.93 -56.62 0.13 OUTLIER 'Cis proline' 0 N--CA 1.49 1.293 0 CA-C-N 119.662 0.915 . . . . 64.530000000000001 114.368 4.135 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -109.68 147.4 36.05 Favored Pre-proline 0 N--CA 1.471 0.576 0 O-C-N 122.231 -0.293 . . . . 73.430000000000007 111.229 179.011 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.463 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 75.9 Cg_exo -50.6 -31.13 30.62 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 122.948 2.432 . . . . 74.150000000000006 113.809 -179.344 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -98.74 20.87 12.25 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 120.839 0.352 . . . . 73.230000000000004 111.682 -179.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.4 t -72.42 107.4 4.97 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.019 0.437 . . . . 73.109999999999999 111.665 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 36.1 tp -92.48 109.82 21.22 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 116.114 -0.493 . . . . 74.510000000000005 111.027 177.051 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.8 mm -73.71 -54.61 14.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 116.115 -0.493 . . . . 74.230000000000004 111.747 -177.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.0 t -164.13 149.46 10.52 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 112.3 0.482 . . . . 71.120000000000005 112.3 -176.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.728 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 88.3 mt-10 -108.93 139.34 43.92 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.277 -0.419 . . . . 71.430000000000007 110.856 175.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 89.6 m-70 -138.77 140.32 26.97 Favored Pre-proline 0 CA--C 1.538 0.503 0 O-C-N 122.3 -0.25 . . . . 75.239999999999995 111.531 178.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -71.86 -24.13 21.47 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 122.458 2.105 . . . . 52.420000000000002 113.517 -179.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 30.4 p -113.07 143.7 43.89 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 121.085 0.469 . . . . 75.299999999999997 111.713 179.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.95 -34.69 73.6 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.053 -0.521 . . . . 73.400000000000006 111.9 177.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.5 -48.96 76.07 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 120.577 0.227 . . . . 72.310000000000002 110.894 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -58.66 -42.5 88.56 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.092 0.472 . . . . 74.450000000000003 111.199 177.424 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.71 -41.25 98.13 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.939 -0.573 . . . . 74.540000000000006 111.726 -179.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 67.1 mtt -65.06 -49.31 70.6 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 120.934 0.397 . . . . 62.310000000000002 111.004 177.379 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.541 ' HA ' ' HE2' ' A' ' 55' ' ' LYS . 11.2 m-20 -57.67 -41.29 81.24 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 121.056 0.455 . . . . 73.049999999999997 111.767 176.161 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.79 -43.42 93.26 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.953 0.406 . . . . 71.409999999999997 111.026 177.339 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.434 ' NZ ' ' O ' ' A' ' 11' ' ' ALA . 59.5 tttp -60.48 -52.43 65.23 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 116.316 -0.402 . . . . 72.049999999999997 111.781 178.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.541 ' HE2' ' HA ' ' A' ' 52' ' ' ASP . 63.7 pttt -64.81 -33.92 77.14 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 120.938 0.399 . . . . 75.129999999999995 111.567 -179.147 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 51.6 ttt180 -77.89 -26.29 49.08 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.948 0.404 . . . . 65.129999999999995 111.001 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -72.27 -43.26 64.55 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.05 0.452 . . . . 75.200000000000003 110.855 175.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.458 ' HG2' ' HA ' ' A' ' 10' ' ' GLU . 81.0 mt-10 -75.6 -33.64 60.56 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.935 -0.575 . . . . 73.400000000000006 111.849 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.5 m-20 -112.38 80.3 3.4 Favored Pre-proline 0 CA--C 1.544 0.739 0 CA-C-O 120.859 0.362 . . . . 71.319999999999993 111.162 175.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -81.04 131.98 8.18 Favored 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 122.426 2.084 . . . . 65.430000000000007 113.349 -176.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -92.01 12.69 21.03 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.965 -0.561 . . . . 73.150000000000006 110.599 178.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.0 tptt -153.85 161.01 42.39 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.325 -0.398 . . . . 70.430000000000007 110.696 -174.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 64.18 30.6 13.62 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-O 121.058 0.456 . . . . 75.519999999999996 112.09 175.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 96.5 mt -80.52 85.44 5.95 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.439 -0.346 . . . . 63.43 111.522 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 50.9 tt0 -63.81 107.85 1.31 Allowed 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.89 0.376 . . . . 53.539999999999999 110.49 175.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -81.55 154.49 26.21 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.984 0.421 . . . . 75.519999999999996 111.599 -176.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 20.4 p-80 -60.7 125.96 25.65 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.128 0.49 . . . . 72.319999999999993 111.888 -179.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 51.9 t-80 -75.93 138.54 41.08 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.285 -0.416 . . . . 73.209999999999994 110.689 178.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 48.3 t-80 -46.62 117.42 1.62 Allowed 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 120.965 0.412 . . . . 72.450000000000003 111.777 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 28.5 t60 -55.08 128.79 35.35 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 115.87 -0.605 . . . . 75.5 112.13 -176.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 . . . . . 0 C--O 1.251 1.148 0 CA-C-O 118.603 -0.713 . . . . 72.409999999999997 111.876 -179.848 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.3 mtt . . . . . 0 N--CA 1.489 1.488 0 CA-C-O 120.298 0.094 . . . . 73.329999999999998 110.888 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_exo -62.72 129.61 26.86 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 122.391 2.061 . . . . 75.140000000000001 112.583 177.262 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 68.8 p -68.97 96.34 0.77 Allowed 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.127 0.489 . . . . 54.140000000000001 110.971 177.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt 69.65 138.55 0.06 OUTLIER Pre-proline 0 CA--C 1.546 0.795 0 CA-C-N 115.761 -0.654 . . . . 74.209999999999994 110.882 -172.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_exo -44.52 128.44 8.31 Favored 'Trans proline' 0 CA--C 1.545 1.026 0 C-N-CA 123.309 2.673 . . . . 73.430000000000007 114.517 -172.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -68.61 149.63 74.04 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 122.519 2.146 . . . . 74.150000000000006 111.983 175.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -88.35 115.71 64.07 Favored Pre-proline 0 CA--C 1.542 0.665 0 N-CA-C 112.247 0.462 . . . . 74.310000000000002 112.247 -176.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -80.4 131.68 8.68 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 122.584 2.19 . . . . 74.019999999999996 111.958 172.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.409 ' HB2' ' O ' ' A' ' 57' ' ' TYR . 86.8 mtm180 -95.04 157.88 15.7 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 120.762 0.315 . . . . 75.349999999999994 111.295 -178.175 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -132.04 140.9 49.04 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 120.674 0.273 . . . . 72.349999999999994 111.318 -179.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.485 ' O ' ' HE2' ' A' ' 54' ' ' LYS . . . -140.95 162.31 35.77 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 120.87 0.367 . . . . 61.130000000000003 111.889 -179.337 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -151.63 149.63 29.35 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.097 0.475 . . . . 75.219999999999999 111.63 178.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 60.2 mt -101.56 134.49 41.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-N 116.35 -0.386 . . . . 74.519999999999996 111.895 -176.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.4 t -129.18 122.85 57.12 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 116.289 -0.414 . . . . 64.519999999999996 110.49 176.062 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 45.9 p -86.91 129.45 34.88 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 120.817 0.341 . . . . 74.099999999999994 111.579 -178.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.506 HD11 ' NE2' ' A' ' 29' ' ' GLN . 43.3 pt -113.33 175.07 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-O 120.955 0.407 . . . . 72.340000000000003 111.423 178.039 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.45 ' HB2' ' HB ' ' A' ' 24' ' ' THR . 9.4 pt-20 -118.16 129.83 55.74 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 121.231 0.538 . . . . 71.109999999999999 111.754 178.905 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -124.97 178.51 5.47 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 116.384 -0.371 . . . . 71.230000000000004 110.933 175.198 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 84.29 -136.79 15.11 Favored Glycine 0 CA--C 1.526 0.733 0 C-N-CA 120.927 -0.654 . . . . 74.519999999999996 114.414 172.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -74.63 150.0 86.38 Favored Pre-proline 0 CA--C 1.542 0.635 0 N-CA-C 112.053 0.39 . . . . 71.450000000000003 112.053 -173.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -58.68 -38.07 91.06 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 122.701 2.267 . . . . 53.409999999999997 112.957 179.087 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -92.3 -52.14 2.25 Favored Glycine 0 CA--C 1.524 0.642 0 C-N-CA 121.173 -0.537 . . . . 71.010000000000005 112.492 177.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -93.35 80.87 4.41 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.493 0.663 . . . . 73.349999999999994 110.818 177.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.45 ' HB ' ' HB2' ' A' ' 17' ' ' GLU . 71.7 p -80.75 151.17 28.96 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.457 -0.792 . . . . 72.239999999999995 111.816 179.602 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 53.7 t -108.54 136.46 44.15 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 CA-C-N 116.176 -0.466 . . . . 72.329999999999998 110.852 -179.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 67.6 m -85.28 120.07 26.35 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.068 0.461 . . . . 73.319999999999993 112.125 -175.468 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 61.6 m95 -119.66 131.62 55.48 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.047 0.451 . . . . 70.409999999999997 111.28 175.286 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -91.57 114.71 27.31 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 116.358 -0.383 . . . . 75.340000000000003 111.187 -178.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.528 ' HG2' ' HG3' ' A' ' 43' ' ' GLU . 72.4 mt-30 -95.82 120.31 35.86 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.562 -0.29 . . . . 74.049999999999997 111.571 177.687 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 55.2 tp -85.67 103.47 14.51 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.872 0.368 . . . . 74.530000000000001 110.426 173.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 55.4 mtt180 -106.5 141.85 37.12 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.464 -0.334 . . . . 72.219999999999999 110.325 178.169 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.41 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . . . -109.6 167.9 9.8 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.808 0.67 . . . . 74.450000000000003 112.808 -173.275 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -77.36 -54.48 6.41 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 115.631 -0.713 . . . . 71.129999999999995 111.98 -176.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.5 ' HB3' ' HA ' ' A' ' 35' ' ' PRO . 60.0 m-70 -123.43 164.05 30.59 Favored Pre-proline 0 CA--C 1.547 0.83 0 C-N-CA 122.597 0.359 . . . . 71.329999999999998 110.929 178.694 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.5 ' HA ' ' HB3' ' A' ' 34' ' ' HIS . 36.8 Cg_endo -64.76 -50.16 0.17 OUTLIER 'Cis proline' 0 C--N 1.362 1.278 0 C-N-CA 124.825 -0.906 . . . . 74.25 113.572 1.158 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -98.6 149.05 35.36 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 122.169 0.188 . . . . 75.030000000000001 110.548 173.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -67.87 -14.9 42.76 Favored 'Trans proline' 0 CA--C 1.537 0.64 0 C-N-CA 122.212 1.942 . . . . 73.030000000000001 112.502 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -88.61 1.05 55.72 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.98 -0.555 . . . . 71.150000000000006 111.874 -179.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 64.0 m -56.78 92.52 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 112.259 0.466 . . . . 72.230000000000004 112.259 -175.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 49.6 tp -83.88 107.23 16.14 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 116.265 -0.425 . . . . 73.420000000000002 110.508 176.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 45.0 mm -69.44 -53.7 23.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 116.312 -0.404 . . . . 64.439999999999998 111.641 -177.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.9 t -175.24 149.64 1.08 Allowed 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 121.038 0.447 . . . . 73.329999999999998 112.01 -179.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.528 ' HG3' ' HG2' ' A' ' 29' ' ' GLN . 2.2 mp0 -100.42 130.81 46.55 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 116.044 -0.525 . . . . 75.040000000000006 110.595 176.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -134.95 147.04 61.13 Favored Pre-proline 0 N--CA 1.473 0.69 0 CA-C-O 120.839 0.352 . . . . 72.430000000000007 111.584 -179.047 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.84 -18.59 19.04 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 122.825 2.35 . . . . 73.340000000000003 114.146 -174.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 30.6 p -116.88 151.67 36.1 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.093 0.473 . . . . 71.319999999999993 111.399 179.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.34 -36.46 74.24 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.302 -0.408 . . . . 74.200000000000003 111.824 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 24.6 tp60 -56.8 -42.02 78.79 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.529 -0.305 . . . . 63.409999999999997 111.767 -177.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -59.23 -51.07 71.55 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 121.094 0.473 . . . . 65.400000000000006 111.35 176.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.07 -37.74 88.52 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.982 -0.553 . . . . 73.319999999999993 111.689 -178.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 95.1 mmm -68.28 -44.83 74.68 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 116.511 -0.313 . . . . 75.209999999999994 111.642 178.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -61.74 -48.58 80.05 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.05 0.452 . . . . 73.519999999999996 110.701 178.022 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.37 -33.84 76.42 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 116.029 -0.532 . . . . 64.019999999999996 111.452 177.073 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.485 ' HE2' ' O ' ' A' ' 11' ' ' ALA . 65.7 tttm -61.82 -57.34 12.22 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.91 0.386 . . . . 75.450000000000003 110.503 175.793 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -55.77 -44.65 77.88 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.205 -0.452 . . . . 71.400000000000006 111.297 178.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -61.11 -44.49 97.27 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.092 -0.504 . . . . 74.209999999999994 111.526 178.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.409 ' O ' ' HB2' ' A' ' 9' ' ' ARG . 80.5 t80 -67.04 -38.9 86.67 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 116.373 -0.376 . . . . 75.310000000000002 111.375 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.466 ' HG3' ' O ' ' A' ' 54' ' ' LYS . 56.5 mt-10 -72.31 -5.41 35.95 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.371 0.508 . . . . 74.349999999999994 112.371 -176.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 68.4 m-20 -84.28 144.91 44.47 Favored Pre-proline 0 CA--C 1.544 0.733 0 O-C-N 122.375 -0.203 . . . . 73.400000000000006 110.891 169.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.77 84.45 1.03 Allowed 'Trans proline' 0 CA--C 1.542 0.897 0 C-N-CA 122.05 1.833 . . . . 71.409999999999997 111.517 172.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -65.44 -70.92 0.21 Allowed 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.967 0.729 . . . . 64.340000000000003 112.967 -174.182 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 15.5 tppt? -81.87 127.09 32.65 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.123 0.487 . . . . 73.109999999999999 111.995 -172.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -94.7 -177.61 4.26 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.081 -0.509 . . . . 71.129999999999995 110.991 174.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 8.7 mp 64.12 5.83 2.63 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.11 0.411 . . . . 73.400000000000006 112.11 -178.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 41.8 mm-40 -80.41 19.03 0.81 Allowed 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 112.518 0.562 . . . . 72.040000000000006 112.518 -179.309 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 58.7 m80 -77.04 -8.67 57.85 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.768 0.318 . . . . 73.200000000000003 111.106 176.256 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -75.32 34.83 0.11 Allowed 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 112.42 0.526 . . . . 74.319999999999993 112.42 177.056 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 -145.81 142.09 28.53 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 122.359 0.264 . . . . 74.5 110.553 -178.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -57.95 145.64 35.15 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 121.298 0.57 . . . . 73.340000000000003 112.157 -177.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 74.2 m80 -113.51 -165.61 1.01 Allowed 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 115.927 -0.579 . . . . 74.239999999999995 111.098 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 18.7 p80 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 119.199 -0.429 . . . . 72.439999999999998 111.34 175.713 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.7 mtm . . . . . 0 N--CA 1.492 1.626 0 N-CA-C 111.237 0.088 . . . . 75.140000000000001 111.237 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -63.03 116.38 3.54 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 122.537 2.158 . . . . 74.420000000000002 112.418 178.218 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 77.8 p -92.5 85.33 5.29 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.475 0.546 . . . . 71.420000000000002 112.475 -175.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.622 ' HA ' ' HE3' ' A' ' 4' ' ' LYS . 1.6 tpmt? -157.53 97.18 1.98 Allowed Pre-proline 0 CA--C 1.539 0.553 0 N-CA-C 111.979 0.362 . . . . 73.140000000000001 111.979 177.239 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -82.53 145.72 13.3 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 122.427 2.085 . . . . 65.239999999999995 112.149 172.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -72.25 160.54 46.89 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 122.205 1.937 . . . . 64.230000000000004 112.439 177.424 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 52.8 p90 -63.92 146.0 97.43 Favored Pre-proline 0 CA--C 1.544 0.744 0 CA-C-O 120.835 0.35 . . . . 73.129999999999995 111.9 -179.013 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -74.38 165.24 32.22 Favored 'Trans proline' 0 CA--C 1.541 0.835 0 C-N-CA 122.674 2.249 . . . . 71.109999999999999 113.238 178.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.453 ' HB2' ' HA ' ' A' ' 58' ' ' GLU . 0.1 OUTLIER -101.38 139.35 37.17 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 116.176 -0.466 . . . . 72.219999999999999 111.033 -179.24 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -151.66 117.53 5.48 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 116.525 -0.307 . . . . 74.140000000000001 110.439 176.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.488 ' HB1' ' CD2' ' A' ' 57' ' ' TYR . . . -117.96 167.03 11.81 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.626 0.602 . . . . 72.310000000000002 112.626 -174.808 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 28.5 p90 -147.88 150.47 34.17 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.533 -0.758 . . . . 73.329999999999998 110.883 178.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 55.1 mt -102.2 123.76 55.66 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-O 120.951 0.405 . . . . 73.150000000000006 111.339 -178.264 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.9 t -106.27 124.71 61.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-N 116.457 -0.338 . . . . 73.540000000000006 111.291 179.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 71.0 p -89.87 113.56 25.18 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.895 0.378 . . . . 74.239999999999995 111.285 178.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.444 HD11 ' HE3' ' A' ' 18' ' ' LYS . 30.0 pt -112.95 161.62 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-O 120.66 0.267 . . . . 70.510000000000005 111.337 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -124.14 130.07 51.92 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.165 0.507 . . . . 65.239999999999995 111.264 176.174 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.444 ' HE3' HD11 ' A' ' 16' ' ' ILE . 97.1 mttt -128.53 175.32 8.63 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 120.997 0.427 . . . . 72.340000000000003 111.131 177.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 90.52 -137.93 14.18 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 121.136 -0.554 . . . . 64.420000000000002 113.544 178.141 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -85.86 139.62 35.13 Favored Pre-proline 0 CA--C 1.541 0.599 0 C-N-CA 122.335 0.254 . . . . 75.030000000000001 111.503 -176.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -51.01 -45.33 37.12 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 C-N-CA 122.533 2.155 . . . . 73.400000000000006 112.833 178.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.03 -58.1 6.46 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 120.8 -0.714 . . . . 36.460000000000001 112.158 175.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -98.98 82.92 2.82 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 121.033 0.444 . . . . 72.409999999999997 110.702 179.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 46.0 p -86.12 150.22 24.57 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 116.003 -0.544 . . . . 72.319999999999993 112.202 179.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 47.2 t -111.79 116.33 52.25 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 115.965 -0.561 . . . . 71.120000000000005 110.458 174.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.406 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 94.5 m -81.75 117.95 22.47 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 111.888 0.329 . . . . 75.340000000000003 111.888 -178.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -110.92 131.63 54.89 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 120.88 0.371 . . . . 74.209999999999994 111.351 178.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -90.68 114.35 26.64 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.833 0.349 . . . . 73.030000000000001 110.907 177.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -103.92 120.51 41.17 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.304 -0.407 . . . . 75.040000000000006 111.588 -179.17 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.7 tp -83.32 110.97 18.56 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 120.62 0.248 . . . . 73.439999999999998 110.816 174.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 60.3 mtt180 -123.29 166.44 15.27 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.805 0.336 . . . . 71.310000000000002 110.798 177.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -137.79 171.99 13.62 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.529 -0.305 . . . . 73.25 111.096 178.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -90.2 -14.64 33.04 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.308 0.575 . . . . 71.420000000000002 110.594 175.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.403 ' HA ' ' C ' ' A' ' 35' ' ' PRO . 92.2 m-70 -122.03 130.98 24.5 Favored Pre-proline 0 CA--C 1.546 0.795 0 CA-C-N 116.005 -0.543 . . . . 74.109999999999999 110.261 173.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.403 ' C ' ' HA ' ' A' ' 34' ' ' HIS . 24.7 Cg_exo -64.85 -44.71 0.38 Allowed 'Cis proline' 0 C--N 1.357 0.992 0 C-N-CA 124.479 -1.05 . . . . 71.540000000000006 113.9 0.539 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -137.58 153.64 74.41 Favored Pre-proline 0 N--CA 1.474 0.754 0 C-N-CA 122.04 0.136 . . . . 74.409999999999997 111.058 179.144 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_exo -50.49 -27.28 18.42 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 122.75 2.3 . . . . 75.099999999999994 113.372 175.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -74.67 -23.82 58.7 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 116.131 -0.486 . . . . 54.039999999999999 112.014 178.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 53.0 m -57.52 105.86 0.28 Allowed 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.146 0.498 . . . . 74.430000000000007 112.288 -175.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 49.7 tp -95.3 124.91 39.58 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 115.86 -0.609 . . . . 71.329999999999998 111.229 178.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.1 mm -86.01 -50.88 13.93 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 CA-C-O 120.981 0.419 . . . . 73.409999999999997 111.784 -179.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 29.1 t -168.77 149.02 4.43 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 120.991 0.424 . . . . 64.310000000000002 112.09 -178.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -106.91 140.22 40.08 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.216 -0.447 . . . . 73.409999999999997 110.334 174.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -139.81 151.26 65.33 Favored Pre-proline 0 N--CA 1.471 0.597 0 CA-C-O 120.795 0.331 . . . . 63.450000000000003 111.784 179.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_exo -69.77 -37.22 9.45 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 122.853 2.369 . . . . 75.540000000000006 112.798 177.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 41.9 p -105.35 148.62 26.87 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 121.104 0.478 . . . . 74.540000000000006 111.718 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.444 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -65.79 -31.31 72.21 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.304 -0.407 . . . . 73.439999999999998 111.195 176.002 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 25.7 tp60 -57.16 -49.19 76.74 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 116.485 -0.325 . . . . 73.519999999999996 111.571 179.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -58.78 -43.55 90.44 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.34 0.591 . . . . 73.219999999999999 110.982 175.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.89 -35.21 79.27 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.767 -0.651 . . . . 72.239999999999995 111.497 177.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' MET . . . . . 0.495 ' O ' ' HG3' ' A' ' 55' ' ' LYS . 68.4 mtt -68.2 -42.61 79.61 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.477 -0.329 . . . . 61.299999999999997 111.226 176.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -56.99 -49.27 76.28 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.274 0.559 . . . . 70.329999999999998 110.507 176.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.02 -36.81 85.21 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 115.943 -0.572 . . . . 74.340000000000003 111.54 176.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.7 tttm -61.96 -42.88 99.62 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.078 0.466 . . . . 74.109999999999999 110.606 176.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.495 ' HG3' ' O ' ' A' ' 51' ' ' MET . 95.7 mttt -56.67 -55.1 38.3 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.426 0.632 . . . . 72.230000000000004 109.929 171.729 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.4 ' HG3' ' OD1' ' A' ' 61' ' ' ASP . 30.1 ttm-85 -60.23 -25.71 65.85 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 115.151 -0.931 . . . . 73.409999999999997 112.544 -174.197 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.488 ' CD2' ' HB1' ' A' ' 11' ' ' ALA . 90.1 t80 -76.68 -54.42 6.68 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 120.777 0.323 . . . . 71.219999999999999 111.505 176.454 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.453 ' HA ' ' HB2' ' A' ' 9' ' ' ARG . 39.2 mt-10 -74.59 -49.82 20.25 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.674 0.273 . . . . 65.430000000000007 111.246 -179.11 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -83.85 99.75 0.83 Allowed Pre-proline 0 CA--C 1.537 0.47 0 N-CA-C 109.227 -0.657 . . . . 73.420000000000002 109.227 168.035 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -78.9 107.79 2.3 Favored 'Trans proline' 0 CA--C 1.538 0.684 0 C-N-CA 122.306 2.004 . . . . 75.219999999999999 115.09 -165.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.4 ' OD1' ' HG3' ' A' ' 56' ' ' ARG . 1.8 m-20 -68.46 79.03 0.27 Allowed 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 108.383 -0.969 . . . . 75.420000000000002 108.383 161.366 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 49.1 pttt -48.7 -50.17 34.62 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.178 1.177 . . . . 73.120000000000005 114.178 -167.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -99.22 127.36 45.19 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.389 0.614 . . . . 72.109999999999999 112.398 -175.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 88.8 mt -77.74 -179.41 5.92 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.097 -0.501 . . . . 61.130000000000003 111.079 175.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -59.63 152.59 21.99 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.137 0.494 . . . . 73.549999999999997 112.066 -177.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 9.5 p80 -124.19 107.79 11.6 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.995 -0.548 . . . . 71.519999999999996 110.76 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -83.29 129.74 35.02 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 111.979 0.363 . . . . 75.420000000000002 111.979 -177.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 59.3 t-80 -137.56 125.26 22.36 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.52 -0.309 . . . . 73.310000000000002 110.919 179.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 64.4 m80 -59.65 139.73 56.98 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 116.34 -0.391 . . . . 73.129999999999995 111.68 -179.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 29.3 p-80 -115.45 151.83 34.04 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 120.784 0.326 . . . . 74.209999999999994 111.771 -178.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 53.3 p-80 . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.594 -0.717 . . . . 73.230000000000004 111.597 171.538 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 . . . . . 0 CA--C 1.539 0.551 0 CA-C-O 120.866 0.365 . . . . 65.21 111.798 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -129.05 175.81 8.39 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 116.138 -0.483 . . . . 32.54 111.655 179.501 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 41.1 p90 -153.52 179.78 8.49 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 121.095 0.474 . . . . 71.5 111.336 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 58.1 mt -117.96 146.05 23.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-N 116.48 -0.327 . . . . 73.35 111.497 -177.835 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 57.4 t -128.09 121.1 55.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 122.546 0.338 . . . . 71.14 110.947 176.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 77.2 p -87.93 115.32 25.31 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 111.85 0.315 . . . . 72.23 111.85 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.446 HD11 ' HE3' ' A' ' 18' ' ' LYS . 37.4 pt -121.07 175.59 4.67 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-O 121.204 0.526 . . . . 73.04 111.772 -179.43 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.434 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 45.4 mt-10 -125.21 141.55 52.03 Favored 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 116.05 -0.523 . . . . 74.14 110.801 176.369 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.446 ' HE3' HD11 ' A' ' 16' ' ' ILE . 93.7 mttt -131.81 175.85 8.85 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.035 0.445 . . . . 74.55 111.724 178.73 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.27 -136.72 12.85 Favored Glycine 0 CA--C 1.525 0.687 0 C-N-CA 121.086 -0.578 . . . . 65.33 113.455 176.34 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -87.71 146.87 40.08 Favored Pre-proline 0 CA--C 1.538 0.485 0 C-N-CA 122.424 0.29 . . . . 75.41 111.54 -176.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -53.09 -31.51 54.66 Favored 'Trans proline' 0 C--N 1.354 0.859 0 C-N-CA 122.927 2.418 . . . . 51.42 113.088 -178.383 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -96.41 -42.64 3.39 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 121.14 -0.552 . . . . 42.44 112.709 175.11 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 81.4 mm-40 -99.69 85.24 3.07 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.144 0.497 . . . . 72.43 111.234 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.434 ' HB ' ' HB3' ' A' ' 17' ' ' GLU . 75.1 p -91.95 152.77 19.87 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 121.178 0.513 . . . . 74.3 112.349 -179.65 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 61.9 t -121.16 145.67 27.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 CA-C-N 115.902 -0.59 . . . . 60.31 110.505 176.619 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 41.7 m -78.5 127.97 32.9 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.256 0.465 . . . . 45.32 112.256 -176.435 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 44.4 m95 -132.13 151.21 51.9 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.235 0.54 . . . . 72.25 111.916 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -118.8 119.12 33.44 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.976 -0.557 . . . . 61.44 111.498 -179.18 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -100.58 129.84 46.57 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 120.967 0.413 . . . . 72.24 111.689 177.36 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 65.4 tp -88.77 111.72 22.33 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.398 -0.365 . . . . 54.53 110.592 174.269 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 31' ' ' ARG . 71.7 mtt-85 -127.24 153.87 45.57 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.707 0.289 . . . . 74.5 110.595 178.706 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -134.14 145.18 49.04 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.809 0.3 . . . . 72.43 111.809 -176.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -62.64 -17.35 60.25 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 121.44 0.638 . . . . 62.13 111.156 176.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 29.6 m80 -120.29 128.81 25.64 Favored Pre-proline 0 CA--C 1.542 0.652 0 CA-C-N 115.736 -0.666 . . . . 70.23 110.777 -176.711 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -80.11 -17.6 26.39 Favored 'Cis proline' 0 CA--C 1.541 0.851 0 C-N-CA 123.815 -1.327 . . . . 74.42 113.276 0.144 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -143.35 143.34 23.85 Favored Pre-proline 0 N--CA 1.471 0.583 0 C-N-CA 122.439 0.296 . . . . 71.14 110.822 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -70.37 -8.61 24.02 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 122.513 2.142 . . . . 74.11 112.981 -174.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -97.1 -0.97 46.18 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 120.911 0.386 . . . . 75.41 111.229 175.414 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.6 t -72.64 103.87 3.72 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.103 0.477 . . . . 72.33 111.667 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 58.4 tp -82.99 122.62 28.54 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.989 -0.55 . . . . 74.14 110.295 176.463 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.4 mm -88.42 -54.16 8.36 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-O 120.987 0.423 . . . . 72.04 111.393 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 44.2 t -159.48 156.69 28.71 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 116.376 -0.375 . . . . 64.32 111.404 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -119.29 139.31 52.13 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.855 0.359 . . . . 65.42 111.036 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -143.32 143.07 22.88 Favored Pre-proline 0 N--CA 1.472 0.642 0 CA-C-N 116.643 -0.253 . . . . 75.52 111.377 -179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -75.35 -15.1 20.17 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 122.436 2.091 . . . . 70.14 113.355 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 44.6 p -116.91 148.69 41.12 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 121.118 0.485 . . . . 71.0 111.992 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.29 -42.71 99.11 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.075 -0.511 . . . . 51.22 112.165 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.2 tp60 -56.86 -46.42 81.8 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 111.89 0.33 . . . . 52.41 111.89 -178.067 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -59.75 -34.22 72.68 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 120.839 0.352 . . . . 75.43 111.462 177.868 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.97 -43.98 73.87 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 120.969 0.414 . . . . 73.15 111.458 178.34 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 66.2 mtt -65.33 -42.76 92.61 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.256 0.55 . . . . 72.32 111.311 177.637 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.423 ' O ' ' HD2' ' A' ' 56' ' ' ARG . 12.8 t70 -63.64 -47.99 79.09 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.919 -0.582 . . . . 73.1 110.563 178.408 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.57 -39.35 80.03 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.314 -0.403 . . . . 64.1 111.29 176.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 49.5 tttp -55.11 -44.32 74.87 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.326 -0.397 . . . . 72.13 110.718 174.361 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -63.1 -41.7 99.44 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 122.327 -0.233 . . . . 72.0 111.605 175.131 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.462 ' HA ' ' HE ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -56.27 -32.78 64.85 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 122.194 -0.317 . . . . 73.1 111.809 176.811 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -77.75 -37.59 48.84 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 111.878 0.325 . . . . 63.4 111.878 177.627 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -92.27 -22.8 19.56 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.084 0.772 . . . . 72.32 113.084 -172.483 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 . . . . . 0 CA--C 1.543 0.681 0 CA-C-O 120.935 0.398 . . . . 73.12 111.4 179.037 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 . . . . . 0 CA--C 1.539 0.555 0 CA-C-O 120.895 0.379 . . . . 74.15 110.958 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.484 ' O ' ' HE3' ' A' ' 54' ' ' LYS . . . -101.52 143.92 30.91 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 120.725 0.297 . . . . 45.44 111.339 176.2 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 49.7 p90 -139.65 144.3 37.57 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 121.181 0.515 . . . . 74.53 111.725 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 62.3 mt -95.34 140.49 16.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-N 116.153 -0.476 . . . . 63.25 111.333 -178.721 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.0 t -122.47 140.52 46.04 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 C-N-CA 122.586 0.354 . . . . 51.51 111.05 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.4 p -102.86 113.47 26.93 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.036 0.446 . . . . 74.04 111.942 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.443 HD13 ' NE2' ' A' ' 29' ' ' GLN . 37.4 pt -120.96 176.01 4.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-O 121.103 0.478 . . . . 55.22 111.702 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.413 ' HB2' ' HB ' ' A' ' 24' ' ' THR . 12.3 pt-20 -142.27 132.11 24.28 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.266 -0.425 . . . . 64.0 110.836 177.158 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -117.22 161.04 20.12 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-O 120.833 0.349 . . . . 71.34 111.876 -178.589 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.19 -147.16 17.19 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 121.471 -0.395 . . . . 64.33 113.583 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.453 ' O ' HG23 ' A' ' 24' ' ' THR . 94.9 mttt -89.1 151.95 47.5 Favored Pre-proline 0 N--CA 1.473 0.68 0 N-CA-C 112.187 0.44 . . . . 74.23 112.187 -173.523 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -53.59 123.09 12.5 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 122.345 2.03 . . . . 71.31 111.932 175.665 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.33 -50.84 3.89 Favored Glycine 0 CA--C 1.528 0.883 0 C-N-CA 121.05 -0.595 . . . . 55.01 112.48 -175.1 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 17.8 mm-40 -95.33 76.75 3.4 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.259 0.552 . . . . 65.43 110.896 177.311 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.453 HG23 ' O ' ' A' ' 20' ' ' LYS . 33.0 p -118.09 161.42 19.87 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.718 0.636 . . . . 70.25 112.718 -177.15 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 62.0 t -108.76 130.33 61.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-N 115.793 -0.639 . . . . 74.32 110.617 178.077 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.7 m -76.07 115.29 15.63 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 120.774 0.321 . . . . 73.41 111.737 -178.297 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.404 ' HB2' HG13 ' A' ' 16' ' ' ILE . 88.7 m95 -117.36 144.3 45.07 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.173 0.511 . . . . 75.21 111.52 177.795 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -111.01 115.39 29.39 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.053 -0.521 . . . . 75.42 110.817 176.688 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.539 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 91.4 mt-30 -97.49 125.4 42.15 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 120.727 0.298 . . . . 72.14 111.647 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.7 tp -90.49 115.08 27.36 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 122.281 -0.262 . . . . 70.1 110.336 173.269 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 58.3 mtt-85 -122.95 151.61 41.65 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 116.771 -0.195 . . . . 73.21 110.925 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -122.43 167.74 12.94 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 120.885 0.374 . . . . 64.04 111.782 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.3 p-10 -85.59 -30.55 23.22 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-O 121.097 0.475 . . . . 74.23 111.352 178.195 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -117.29 145.64 36.45 Favored Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 122.89 0.476 . . . . 72.25 110.799 176.303 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -72.28 -13.99 17.07 Favored 'Cis proline' 0 CA--C 1.543 0.951 0 C-N-CA 124.365 -1.098 . . . . 71.12 113.516 2.637 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -151.42 150.73 27.52 Favored Pre-proline 0 CA--C 1.539 0.551 0 CA-C-N 116.558 -0.292 . . . . 74.43 110.691 177.224 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -58.98 -24.73 74.61 Favored 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 122.747 2.298 . . . . 71.23 112.918 -178.728 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -82.68 3.02 30.73 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.741 -0.663 . . . . 72.54 111.897 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 89.2 p -64.81 105.09 0.93 Allowed 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 121.196 0.522 . . . . 45.31 111.851 -176.719 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 54.5 tp -91.92 111.09 22.49 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.169 -0.469 . . . . 73.15 110.35 175.579 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 44.7 mm -77.49 -51.81 17.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 CA-C-N 116.356 -0.384 . . . . 55.32 111.386 -179.413 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 94.5 p -168.77 159.03 9.46 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.049 0.452 . . . . 62.15 111.954 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.539 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 45.8 mt-10 -114.79 121.42 43.24 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.961 -0.563 . . . . 72.21 110.465 175.939 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -126.59 141.95 41.71 Favored Pre-proline 0 N--CA 1.47 0.574 0 O-C-N 122.081 -0.387 . . . . 71.25 111.721 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -71.78 -27.08 18.48 Favored 'Trans proline' 0 CA--C 1.542 0.888 0 C-N-CA 122.573 2.182 . . . . 70.45 113.616 -177.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 28.1 p -106.07 148.14 28.11 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.066 0.46 . . . . 74.22 111.781 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.438 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -64.14 -31.75 73.06 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.308 -0.406 . . . . 74.53 111.335 175.252 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 27.9 tp60 -57.01 -54.49 46.14 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 116.465 -0.334 . . . . 54.23 111.319 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -56.18 -42.45 77.11 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 120.897 0.379 . . . . 55.42 111.33 177.446 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.53 -41.68 99.02 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.873 0.368 . . . . 62.11 111.678 179.187 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.438 ' HG3' ' O ' ' A' ' 47' ' ' ALA . 66.0 mtt -64.97 -49.11 71.6 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.368 -0.378 . . . . 64.11 110.944 177.183 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -62.22 -37.62 86.06 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 111.779 0.288 . . . . 73.42 111.779 178.435 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.68 -43.36 89.5 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.514 -0.312 . . . . 74.31 111.048 176.064 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.484 ' HE3' ' O ' ' A' ' 11' ' ' ALA . 87.6 tttt -61.58 -53.97 49.26 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.466 -0.334 . . . . 73.31 111.109 176.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -56.9 -45.88 82.32 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.358 -0.383 . . . . 71.32 111.266 178.068 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 55.1 ttm-85 -56.74 -44.73 81.99 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.055 0.455 . . . . 71.42 110.929 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -63.26 -48.38 78.43 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.966 -0.561 . . . . 75.04 110.577 175.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -76.98 15.41 0.68 Allowed 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.743 0.646 . . . . 72.35 112.743 -175.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 52.0 m-20 . . . . . 0 CA--C 1.537 0.464 0 O-C-N 122.178 -0.326 . . . . 75.01 110.818 170.103 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 . . . . . 0 CA--C 1.537 0.456 0 CA-C-O 120.984 0.421 . . . . 73.23 111.767 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.43 ' HB2' ' CD2' ' A' ' 57' ' ' TYR . . . -128.78 152.47 48.42 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.981 -0.554 . . . . 72.12 111.511 179.188 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 33.9 p90 -142.27 168.79 18.91 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 120.856 0.36 . . . . 73.24 111.745 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 59.6 mt -109.81 136.87 44.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 N-CA-C 112.053 0.39 . . . . 63.12 112.053 -174.666 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 78.4 t -127.0 131.87 70.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 CA-C-N 116.46 -0.336 . . . . 70.53 110.731 175.799 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 68.2 p -89.91 123.05 33.51 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.312 0.486 . . . . 63.4 112.312 -177.289 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.483 HD13 ' NE2' ' A' ' 29' ' ' GLN . 37.1 pt -123.0 175.26 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 CA-C-N 116.326 -0.397 . . . . 72.4 110.495 173.447 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -134.61 137.89 44.08 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-O 120.935 0.398 . . . . 74.42 111.959 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 53.1 mttp -124.11 176.76 6.18 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 116.179 -0.464 . . . . 55.22 110.248 174.777 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.47 -142.48 15.87 Favored Glycine 0 CA--C 1.529 0.949 0 C-N-CA 121.214 -0.517 . . . . 50.32 113.635 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 9.4 mtpm? -104.01 146.37 32.41 Favored Pre-proline 0 N--CA 1.473 0.722 0 C-N-CA 122.574 0.35 . . . . 74.05 111.571 -178.34 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_exo -45.51 125.48 7.62 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 122.98 2.453 . . . . 35.14 113.039 178.239 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.94 -65.93 3.65 Favored Glycine 0 CA--C 1.525 0.682 0 C-N-CA 120.904 -0.665 . . . . 62.4 112.237 -175.562 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -83.05 68.55 9.57 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.284 0.564 . . . . 74.33 110.652 177.841 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 71.5 p -103.8 159.62 15.48 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 121.264 0.554 . . . . 74.4 112.288 -176.398 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 86.8 t -109.73 127.07 66.83 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-N 115.931 -0.577 . . . . 75.21 110.178 174.373 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 59.0 m -79.68 115.59 19.38 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.095 0.474 . . . . 64.42 111.719 -178.04 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 73.6 m95 -102.71 132.31 48.93 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.104 -0.498 . . . . 74.11 110.953 177.59 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -97.1 114.4 26.06 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.001 0.429 . . . . 73.01 110.907 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.737 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 92.0 mt-30 -95.3 120.75 36.07 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.123 -0.489 . . . . 73.2 111.696 -178.806 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 58.2 tp -85.09 105.3 15.72 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.309 -0.405 . . . . 62.04 110.418 175.204 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.455 ' NH2' ' HA ' ' A' ' 38' ' ' ASP . 15.2 mtp-105 -111.49 139.97 46.48 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.336 -0.393 . . . . 70.13 110.945 -177.307 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -109.86 149.17 30.26 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 120.932 0.396 . . . . 73.54 111.324 177.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -77.36 -22.76 51.26 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 112.422 0.527 . . . . 75.2 112.422 -175.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -128.22 148.26 66.97 Favored Pre-proline 0 N--CA 1.472 0.659 0 O-C-N 122.113 -0.367 . . . . 64.34 111.13 179.67 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -70.31 -42.28 0.79 Allowed 'Cis proline' 0 C--N 1.359 1.116 0 C-N-CA 124.215 -1.161 . . . . 73.41 113.32 0.192 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -103.65 145.8 31.3 Favored Pre-proline 0 N--CA 1.469 0.482 0 N-CA-C 110.293 -0.262 . . . . 74.44 110.293 175.069 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -62.85 -6.41 9.22 Favored 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 122.288 1.992 . . . . 74.42 113.124 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.455 ' HA ' ' NH2' ' A' ' 31' ' ' ARG . 5.5 m-20 -103.9 14.93 29.79 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.098 0.407 . . . . 63.14 112.098 178.665 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.7 m -65.52 87.27 0.08 Allowed 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.893 0.378 . . . . 71.23 111.093 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 59.0 tp -72.55 103.06 3.41 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 121.108 0.48 . . . . 64.1 111.081 178.05 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.2 mm -71.62 -43.36 71.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 CA-C-N 116.202 -0.453 . . . . 63.44 111.174 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.6 t -174.12 149.54 1.45 Allowed 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 112.069 0.396 . . . . 74.05 112.069 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.737 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 45.1 mt-10 -108.13 134.22 51.31 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 116.209 -0.451 . . . . 54.52 110.521 173.052 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -136.33 145.07 50.31 Favored Pre-proline 0 CA--C 1.538 0.504 0 O-C-N 122.236 -0.29 . . . . 75.23 111.311 178.066 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -73.66 -15.81 24.13 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 122.479 2.119 . . . . 50.24 112.851 179.679 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 34.8 p -115.97 142.33 46.93 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 120.936 0.398 . . . . 74.34 111.372 178.486 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.462 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -64.15 -35.6 81.3 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 120.967 0.413 . . . . 53.13 110.855 176.779 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -55.26 -49.34 72.29 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.282 -0.417 . . . . 73.35 111.529 178.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -62.49 -38.53 90.25 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 120.881 0.372 . . . . 73.53 111.126 177.611 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.32 -40.91 98.62 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 120.93 0.395 . . . . 72.32 111.221 178.239 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.462 ' HG3' ' O ' ' A' ' 47' ' ' ALA . 86.8 mtp -69.49 -44.42 71.14 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.018 0.437 . . . . 64.22 111.329 178.288 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.601 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 12.4 t70 -65.79 -41.68 91.68 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 120.967 0.413 . . . . 70.45 111.122 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.24 -36.58 84.57 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.019 0.437 . . . . 61.53 110.773 175.141 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 43.7 tttp -56.9 -49.14 76.46 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 115.986 -0.552 . . . . 71.22 111.345 175.054 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.601 ' HG2' ' O ' ' A' ' 52' ' ' ASP . 17.0 pttm -61.59 -43.97 97.88 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 121.084 -0.246 . . . . 53.42 110.854 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -65.2 -35.36 80.83 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 120.601 0.239 . . . . 72.41 111.497 -178.449 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.43 ' CD2' ' HB2' ' A' ' 11' ' ' ALA . 66.6 t80 -64.15 -47.56 79.4 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.867 0.365 . . . . 73.32 110.895 175.13 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -71.97 -21.57 61.57 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 116.288 -0.415 . . . . 50.31 111.512 -177.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 . . . . . 0 CA--C 1.543 0.69 0 N-CA-C 110.371 -0.233 . . . . 71.33 110.371 167.641 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 . . . . . 0 N--CA 1.471 0.623 0 N-CA-C 112.05 0.389 . . . . 74.32 112.05 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -138.03 162.07 35.08 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 120.801 0.334 . . . . 72.02 111.704 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 33.3 p90 -141.68 141.21 33.34 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 121.187 0.517 . . . . 71.41 111.952 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 62.4 mt -92.81 137.07 23.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-N 116.182 -0.463 . . . . 74.32 111.836 -177.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 48.2 t -123.65 137.62 56.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 C-N-CA 122.724 0.409 . . . . 74.15 110.854 177.444 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 77.8 p -98.07 129.74 44.89 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 112.376 0.51 . . . . 75.15 112.376 -177.526 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.415 HD13 ' NE2' ' A' ' 29' ' ' GLN . 41.3 pt -124.5 171.72 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-N 116.293 -0.412 . . . . 74.44 110.823 177.216 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -129.66 128.35 42.39 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.011 0.434 . . . . 72.43 111.909 -178.126 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -120.44 169.24 10.5 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 116.418 -0.356 . . . . 73.25 110.821 177.358 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.71 -141.76 15.52 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 120.957 -0.64 . . . . 31.43 114.049 177.74 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -94.49 141.3 23.28 Favored Pre-proline 0 CA--C 1.541 0.626 0 N-CA-C 111.997 0.369 . . . . 60.3 111.997 -173.609 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -55.63 99.6 0.07 OUTLIER 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.583 2.188 . . . . 72.41 111.935 175.328 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 116.21 -52.64 0.66 Allowed Glycine 0 CA--C 1.525 0.674 0 N-CA-C 111.537 -0.625 . . . . 43.24 111.537 -173.297 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.7 mm-40 -99.41 78.14 2.17 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.124 0.488 . . . . 53.02 110.67 173.359 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 81.6 p -105.89 164.73 11.72 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.342 0.592 . . . . 70.32 112.094 -177.595 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 61.7 t -121.49 118.43 55.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 115.797 -0.638 . . . . 72.45 109.633 173.472 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 87.9 m -76.07 115.33 15.67 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 120.945 0.402 . . . . 71.52 111.665 -177.66 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 36.9 m95 -97.37 151.08 20.29 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.079 -0.51 . . . . 74.23 111.271 177.752 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -109.67 115.0 29.06 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 116.204 -0.453 . . . . 73.01 111.34 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.615 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 92.6 mt-30 -98.26 130.21 44.97 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.002 -0.545 . . . . 74.14 111.041 178.083 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.5 tp -92.95 107.92 19.59 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 120.86 0.362 . . . . 65.33 111.121 175.853 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -102.95 163.97 11.89 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 120.917 0.389 . . . . 71.41 110.48 175.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -144.11 140.63 29.54 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.46 -0.336 . . . . 53.5 111.466 177.492 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -63.89 -17.79 63.55 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.014 0.435 . . . . 73.53 111.737 176.596 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 48.4 m80 -127.82 133.88 25.6 Favored Pre-proline 0 CA--C 1.544 0.745 0 CA-C-N 116.313 -0.403 . . . . 74.05 111.339 -174.411 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -77.96 -53.04 0.16 OUTLIER 'Cis proline' 0 CA--C 1.544 1.018 0 C-N-CA 123.853 -1.311 . . . . 72.55 113.334 -2.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.438 ' HE2' ' HD2' ' A' ' 37' ' ' PRO . 14.1 mmmm -77.92 141.49 63.63 Favored Pre-proline 0 CA--C 1.54 0.584 0 O-C-N 122.008 -0.433 . . . . 74.13 110.43 177.067 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.438 ' HD2' ' HE2' ' A' ' 36' ' ' LYS . 14.9 Cg_endo -56.22 -28.11 69.53 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 122.382 2.055 . . . . 34.1 112.871 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -99.05 22.73 9.92 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 116.558 -0.292 . . . . 72.4 111.7 177.455 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.0 t -57.85 94.99 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 121.014 0.435 . . . . 70.21 111.548 -178.827 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 58.8 tp -85.41 113.89 22.04 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.175 -0.466 . . . . 71.34 110.641 178.318 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.7 mm -81.27 -55.41 8.17 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 CA-C-N 116.61 -0.268 . . . . 72.23 111.624 -179.007 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 45.4 m -164.67 155.13 14.36 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-O 120.923 0.392 . . . . 71.42 111.631 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.615 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 45.2 mt-10 -105.45 139.45 40.06 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.189 -0.46 . . . . 75.53 110.296 174.271 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' HIS . . . . . 0.423 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 34.7 m80 -137.06 148.07 61.29 Favored Pre-proline 0 N--CA 1.473 0.702 0 N-CA-C 112.115 0.413 . . . . 74.22 112.115 179.245 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 44' ' ' HIS . 22.4 Cg_exo -63.65 -49.41 4.32 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 123.056 2.504 . . . . 73.24 113.499 178.872 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 34.0 p -101.64 158.97 15.71 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.352 0.596 . . . . 73.31 112.095 -178.723 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.425 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -64.68 -40.11 94.82 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.812 -0.631 . . . . 75.42 111.561 179.008 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.3 tp60 -58.94 -46.04 88.96 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.541 -0.3 . . . . 73.22 111.407 -178.087 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -56.36 -42.76 78.32 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 121.401 0.619 . . . . 62.13 111.001 175.26 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.88 -38.91 90.02 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.016 -0.538 . . . . 50.22 111.612 179.166 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.425 ' HG3' ' O ' ' A' ' 47' ' ' ALA . 73.6 mtp -70.98 -39.63 72.36 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.6 -0.273 . . . . 64.41 111.556 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.536 ' HA ' ' HD3' ' A' ' 55' ' ' LYS . 13.2 m-20 -59.92 -40.81 90.13 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 120.917 0.389 . . . . 53.23 111.343 174.747 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.8 -44.92 91.87 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.976 0.417 . . . . 63.53 110.942 174.015 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -56.88 -46.49 81.82 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.083 0.468 . . . . 73.12 110.896 176.299 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.536 ' HD3' ' HA ' ' A' ' 52' ' ' ASP . 47.3 mtpt -55.12 -53.94 49.51 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.77 -0.65 . . . . 74.14 111.174 175.187 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 56' ' ' ARG . 13.8 mtp180 -56.69 -26.56 56.89 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 111.992 0.367 . . . . 64.23 111.992 178.929 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -80.03 -47.15 15.34 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 111.645 0.239 . . . . 75.11 111.645 176.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -84.17 -16.13 44.58 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.687 0.625 . . . . 64.02 112.687 -173.704 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 . . . . . 0 CA--C 1.541 0.628 0 O-C-N 122.311 -0.243 . . . . 74.21 110.97 176.429 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 . . . . . 0 N--CA 1.47 0.554 0 CA-C-O 120.89 0.376 . . . . 74.2 111.62 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.581 ' HA ' ' HA ' ' A' ' 32' ' ' ALA . . . -131.72 156.87 45.16 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 116.156 -0.474 . . . . 52.25 111.663 176.864 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 55.5 p90 -149.22 169.56 20.48 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 121.04 0.448 . . . . 74.14 111.63 178.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 69.2 mt -113.04 130.12 67.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 N-CA-C 112.238 0.458 . . . . 72.32 112.238 -175.081 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.49 HG21 ' HD2' ' A' ' 31' ' ' ARG . 60.1 t -111.5 124.59 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-N 116.395 -0.366 . . . . 75.42 111.083 177.376 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 68.2 p -90.2 113.0 24.71 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 122.029 -0.419 . . . . 72.04 111.986 -178.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.438 HD13 ' NE2' ' A' ' 29' ' ' GLN . 32.4 pt -115.87 160.06 15.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 120.64 0.257 . . . . 75.53 111.101 176.697 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -124.39 121.61 35.4 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.131 0.491 . . . . 75.5 111.266 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 5.3 mtpm? -118.0 175.28 5.75 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 116.011 -0.541 . . . . 55.52 110.678 -178.007 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.29 -136.88 12.94 Favored Glycine 0 CA--C 1.526 0.733 0 C-N-CA 120.564 -0.827 . . . . 62.43 113.62 177.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.583 ' HD2' ' N ' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -96.28 156.45 36.92 Favored Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 122.526 0.33 . . . . 65.22 111.47 -175.16 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -56.38 123.28 13.47 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.686 2.257 . . . . 52.1 112.424 174.916 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 80.38 -60.73 4.5 Favored Glycine 0 CA--C 1.526 0.746 0 C-N-CA 120.88 -0.676 . . . . 74.13 112.494 -176.02 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -80.15 73.5 6.97 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.514 0.673 . . . . 64.42 110.628 176.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 78.2 p -100.01 167.96 10.16 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.558 -0.746 . . . . 75.42 112.638 -175.206 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 59.2 t -118.36 126.06 74.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.241 -0.89 . . . . 62.04 109.455 170.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 35.5 m -81.13 114.67 20.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.917 0.389 . . . . 70.44 110.866 -179.19 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -108.88 131.0 55.44 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.094 0.473 . . . . 75.45 110.847 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -98.1 114.27 26.41 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 116.361 -0.381 . . . . 74.21 110.953 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.474 ' HB2' ' HB ' ' A' ' 14' ' ' VAL . 68.8 mt-30 -88.6 117.78 27.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.369 -0.378 . . . . 75.31 111.645 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.6 tp -81.16 103.94 11.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.914 0.388 . . . . 72.31 110.195 173.249 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.49 ' HD2' HG21 ' A' ' 14' ' ' VAL . 58.8 mtt180 -114.27 171.41 7.63 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.518 -0.31 . . . . 73.34 110.752 178.756 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.581 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . . . -126.77 150.59 49.04 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.117 0.484 . . . . 61.14 111.865 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -72.17 -25.31 61.64 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.168 0.509 . . . . 72.42 111.43 175.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -132.45 141.83 42.7 Favored Pre-proline 0 CA--C 1.544 0.745 0 CA-C-N 116.2 -0.454 . . . . 64.41 111.105 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -77.17 -30.36 6.04 Favored 'Cis proline' 0 C--N 1.355 0.872 0 C-N-CA 124.068 -1.221 . . . . 73.13 113.31 0.733 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -124.53 143.73 44.11 Favored Pre-proline 0 CA--C 1.54 0.584 0 CA-C-O 120.568 0.223 . . . . 74.23 111.532 -176.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -55.26 -27.78 58.84 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.718 2.278 . . . . 62.25 113.22 177.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -92.9 13.44 20.49 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.098 0.407 . . . . 75.31 112.098 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.7 m -68.4 83.84 0.26 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.159 0.504 . . . . 75.22 110.336 174.534 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 58.1 tp -82.94 122.32 28.12 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 116.015 -0.539 . . . . 72.11 111.772 -177.347 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 45.9 mm -87.67 -49.98 14.11 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-N 116.284 -0.416 . . . . 61.14 111.495 179.14 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.7 t -172.74 148.79 1.93 Allowed 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 111.851 0.315 . . . . 75.3 111.851 -177.788 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -103.61 133.55 48.44 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.027 0.441 . . . . 73.14 110.856 175.144 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' HIS . . . . . 0.559 ' HB3' ' HB3' ' A' ' 49' ' ' GLU . 45.0 m-70 -128.63 143.53 48.76 Favored Pre-proline 0 N--CA 1.47 0.542 0 O-C-N 122.287 -0.258 . . . . 75.54 111.473 -178.011 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -71.87 -26.93 18.33 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 C-N-CA 122.827 2.351 . . . . 74.21 114.492 -174.034 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 25.6 p -114.47 151.18 33.65 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.85 -0.531 . . . . 73.0 111.964 -178.143 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.04 -39.71 86.87 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.196 -0.456 . . . . 63.42 111.62 177.309 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.9 tp60 -61.77 -42.58 99.17 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 120.665 0.269 . . . . 75.14 110.942 178.166 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.559 ' HB3' ' HB3' ' A' ' 44' ' ' HIS . 12.0 mm-40 -56.24 -47.06 79.25 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.993 0.425 . . . . 61.23 111.355 174.393 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.82 -50.91 69.1 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.136 -0.484 . . . . 64.13 111.959 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 93.5 mmm -63.15 -39.38 94.49 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 111.894 0.331 . . . . 73.43 111.894 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.445 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 32.8 t70 -64.06 -49.69 71.33 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.952 0.406 . . . . 74.3 110.844 179.51 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.23 -37.71 86.43 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.1 0.476 . . . . 73.53 111.306 175.739 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.7 tttm -56.01 -47.47 77.73 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.027 -0.533 . . . . 63.43 111.264 177.258 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -58.98 -43.76 91.46 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.025 0.441 . . . . 64.31 111.482 176.617 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.445 ' HG3' ' O ' ' A' ' 52' ' ' ASP . 51.5 mtt-85 -62.27 -32.97 73.75 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.167 -0.47 . . . . 74.32 111.359 -179.49 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.445 ' CD2' ' HB2' ' A' ' 11' ' ' ALA . 57.2 t80 -76.89 -44.08 33.27 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.442 -0.345 . . . . 72.51 111.775 177.451 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -80.18 5.75 13.63 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.517 0.562 . . . . 75.13 112.517 -175.439 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.8 t70 . . . . . 0 CA--C 1.547 0.83 0 N-CA-C 109.532 -0.544 . . . . 63.42 109.532 174.925 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 . . . . . 0 CA--C 1.542 0.668 0 CA-C-O 121.487 0.661 . . . . 75.31 112.489 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.417 ' HB1' ' O ' ' A' ' 31' ' ' ARG . . . -139.31 -174.8 3.97 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.53 -0.759 . . . . 71.41 111.048 -177.803 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -152.33 145.72 24.8 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.066 0.46 . . . . 55.35 111.605 178.718 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 70.2 mt -101.56 131.09 50.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-N 116.348 -0.387 . . . . 71.21 111.417 -179.273 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 59.9 t -105.84 127.31 60.96 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-N 116.394 -0.366 . . . . 72.4 111.05 177.825 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.6 p -91.29 112.68 24.69 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.741 0.305 . . . . 71.51 111.712 -178.711 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.516 HD11 ' HE3' ' A' ' 18' ' ' LYS . 29.3 pt -115.77 170.53 5.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 116.476 -0.329 . . . . 70.55 110.97 177.877 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.437 ' HB2' ' HB ' ' A' ' 24' ' ' THR . 9.9 pt-20 -133.17 126.47 31.72 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.442 0.639 . . . . 74.44 111.58 176.899 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.516 ' HE3' HD11 ' A' ' 16' ' ' ILE . 98.5 mttt -114.61 178.15 4.39 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.848 -0.614 . . . . 63.41 111.203 -178.171 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.32 -136.93 12.96 Favored Glycine 0 CA--C 1.527 0.811 0 C-N-CA 121.107 -0.568 . . . . 70.14 113.309 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 48.7 mmtm -119.18 154.23 53.54 Favored Pre-proline 0 CA--C 1.539 0.537 0 O-C-N 122.663 -0.316 . . . . 72.43 111.337 -178.304 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -49.09 127.5 17.47 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 122.609 2.206 . . . . 65.45 112.76 176.841 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.51 -51.91 3.35 Favored Glycine 0 CA--C 1.526 0.758 0 C-N-CA 120.942 -0.647 . . . . 74.32 112.369 -175.605 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -99.66 74.32 1.86 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.871 0.367 . . . . 70.31 111.08 177.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.437 ' HB ' ' HB2' ' A' ' 17' ' ' GLU . 76.9 p -103.08 145.64 29.6 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.384 0.611 . . . . 74.53 112.156 -178.452 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 54.0 t -108.93 124.88 65.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 CA-C-N 115.801 -0.636 . . . . 64.22 110.176 174.904 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.2 m -75.31 115.55 15.07 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.629 0.252 . . . . 73.3 111.238 -178.628 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 82.0 m95 -108.51 132.8 53.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.267 0.556 . . . . 71.02 111.235 177.754 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -99.28 115.03 28.22 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.976 -0.556 . . . . 75.2 110.858 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.481 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 83.9 mt-30 -98.44 114.65 27.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.086 -0.506 . . . . 63.32 111.552 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 60.6 tp -79.22 111.3 15.31 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.858 0.361 . . . . 71.54 110.572 176.54 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.417 ' O ' ' HB1' ' A' ' 11' ' ' ALA . 66.8 mtt180 -118.76 169.25 10.0 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.675 0.274 . . . . 71.45 110.885 178.185 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -140.66 143.91 35.39 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.93 0.395 . . . . 51.33 111.711 -178.747 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -68.75 -20.17 64.36 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 116.189 -0.46 . . . . 64.31 111.975 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 70.8 m80 -119.49 133.64 23.8 Favored Pre-proline 0 CA--C 1.543 0.681 0 CA-C-N 116.245 -0.434 . . . . 70.51 111.24 -176.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -80.18 -24.13 12.91 Favored 'Cis proline' 0 CA--C 1.539 0.766 0 C-N-CA 123.877 -1.301 . . . . 72.03 113.103 -0.469 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -131.68 129.5 22.07 Favored Pre-proline 0 N--CA 1.47 0.546 0 CA-C-N 116.615 -0.266 . . . . 54.4 110.995 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -67.72 7.74 0.53 Allowed 'Trans proline' 0 CA--C 1.544 0.993 0 C-N-CA 122.643 2.229 . . . . 73.42 113.445 -179.198 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.9 m-20 -101.17 -3.75 28.52 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 122.153 -0.342 . . . . 63.43 111.082 175.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.6 t -77.06 142.14 39.96 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.014 0.435 . . . . 74.21 112.064 -176.128 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 56.1 tp -115.73 123.59 48.67 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.128 -0.487 . . . . 72.41 111.051 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 44.4 mm -88.02 -53.95 8.85 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 N-CA-C 111.739 0.274 . . . . 72.34 111.739 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.8 t -163.43 154.15 16.22 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 112.319 0.488 . . . . 72.11 112.319 -178.018 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.481 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 46.4 mt-10 -113.91 132.57 55.88 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 116.333 -0.394 . . . . 74.24 110.757 177.43 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -141.16 139.73 19.74 Favored Pre-proline 0 N--CA 1.473 0.711 0 O-C-N 122.221 -0.3 . . . . 73.43 111.539 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo -72.64 -15.68 27.13 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 122.642 2.228 . . . . 73.43 113.641 -177.17 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 44.2 p -116.82 148.78 40.91 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 120.914 0.388 . . . . 44.22 111.534 177.609 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.71 -31.2 72.06 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.867 0.365 . . . . 75.05 111.439 177.306 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.423 ' O ' ' HB2' ' A' ' 52' ' ' ASP . 0.1 OUTLIER -60.62 -52.33 65.63 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.271 -0.422 . . . . 71.42 110.571 179.43 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -55.97 -45.85 78.8 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 120.897 0.379 . . . . 74.31 111.803 178.795 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.81 -49.24 78.49 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 120.99 0.424 . . . . 71.12 111.447 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.441 ' O ' ' HG3' ' A' ' 55' ' ' LYS . 24.2 mmt -64.23 -33.84 76.72 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.195 0.522 . . . . 53.24 111.101 175.167 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.825 ' HA ' ' HE2' ' A' ' 55' ' ' LYS . 3.6 t70 -61.97 -46.29 89.9 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.93 -0.577 . . . . 65.4 110.846 -177.469 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.95 -33.39 72.05 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 116.016 -0.538 . . . . 70.45 111.231 175.499 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 65.7 tttm -61.49 -37.22 82.88 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.193 -0.458 . . . . 54.54 111.346 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.825 ' HE2' ' HA ' ' A' ' 52' ' ' ASP . 51.1 mtmt -51.97 -55.37 20.78 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.742 0.306 . . . . 71.31 111.242 177.041 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 15.8 mtp180 -67.05 -26.71 66.89 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.002 0.371 . . . . 64.33 112.002 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -66.19 -32.45 73.89 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.035 0.445 . . . . 73.21 110.535 173.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -77.92 -45.37 24.23 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.952 0.406 . . . . 61.53 110.845 175.528 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 . . . . . 0 CA--C 1.549 0.908 0 N-CA-C 112.256 0.465 . . . . 64.3 112.256 177.917 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 . . . . . 0 CA--C 1.538 0.485 0 CA-C-O 121.096 0.474 . . . . 73.1 110.932 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.41 ' O ' ' HE3' ' A' ' 54' ' ' LYS . . . -134.5 178.65 6.82 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 121.062 0.458 . . . . 70.3 111.824 -175.877 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 33.0 p90 -144.41 141.46 29.66 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.338 0.589 . . . . 75.53 111.383 178.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 57.3 mt -91.58 125.53 44.27 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 CA-C-N 116.075 -0.511 . . . . 73.41 111.786 -177.81 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.452 HG21 ' HD2' ' A' ' 31' ' ' ARG . 83.8 t -106.1 132.4 53.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 CA-C-O 120.862 0.363 . . . . 74.1 111.047 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 67.8 p -93.19 120.86 33.94 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.306 0.484 . . . . 71.01 112.306 -178.411 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 37.8 pt -123.89 171.83 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 CA-C-O 120.763 0.316 . . . . 73.01 110.877 176.013 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.557 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 45.6 mt-10 -136.0 127.68 28.99 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.22 0.533 . . . . 73.02 111.623 178.047 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -104.99 174.69 5.77 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.266 -0.424 . . . . 73.01 110.83 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.41 -140.27 14.83 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 120.789 -0.719 . . . . 64.34 113.864 177.07 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.55 ' HB2' ' HB2' ' A' ' 23' ' ' GLN . 1.9 mptp? -102.29 154.43 37.41 Favored Pre-proline 0 N--CA 1.471 0.618 0 C-N-CA 122.43 0.292 . . . . 63.33 111.328 -176.135 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -54.91 112.81 1.14 Allowed 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 122.346 2.031 . . . . 74.35 111.885 172.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 94.72 -45.51 2.16 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 121.265 -0.493 . . . . 74.2 112.323 -175.445 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.55 ' HB2' ' HB2' ' A' ' 20' ' ' LYS . 27.8 mm-40 -96.52 71.63 2.69 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.322 0.582 . . . . 74.05 110.521 175.54 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.557 ' HB ' ' HB3' ' A' ' 17' ' ' GLU . 40.1 p -101.84 168.63 9.31 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.964 0.727 . . . . 71.33 112.964 -174.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 57.7 t -127.31 125.37 65.84 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 CA-C-N 115.217 -0.901 . . . . 71.4 110.159 176.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 90.6 m -68.86 124.74 24.51 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.384 0.513 . . . . 75.52 112.384 -177.284 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -130.29 150.71 51.41 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.109 0.48 . . . . 75.14 111.292 176.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -117.34 115.26 24.9 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.222 -0.445 . . . . 63.4 111.436 -179.29 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.626 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 70.9 mt-30 -94.48 107.33 19.31 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.914 0.388 . . . . 64.33 111.087 175.253 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.6 tp -74.81 111.66 10.23 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.634 -0.257 . . . . 72.4 110.594 175.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.452 ' HD2' HG21 ' A' ' 14' ' ' VAL . 74.4 mtt180 -116.43 142.61 46.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.781 0.324 . . . . 65.24 111.004 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -109.6 140.23 43.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.836 0.35 . . . . 73.31 111.662 -178.466 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.524 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 26.6 t70 -68.74 -21.58 64.36 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.136 0.494 . . . . 65.54 111.482 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.415 ' HA ' ' C ' ' A' ' 35' ' ' PRO . 78.9 m-70 -123.58 136.43 27.24 Favored Pre-proline 0 CA--C 1.543 0.7 0 CA-C-N 116.461 -0.336 . . . . 60.32 111.483 -176.107 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.415 ' C ' ' HA ' ' A' ' 34' ' ' HIS . 21.1 Cg_exo -67.36 -51.57 0.16 OUTLIER 'Cis proline' 0 C--N 1.359 1.1 0 C-N-CA 124.287 -1.13 . . . . 73.11 113.363 -0.383 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 31.5 mtmm -109.23 139.25 20.85 Favored Pre-proline 0 N--CA 1.472 0.629 0 O-C-N 122.298 -0.251 . . . . 71.4 110.897 176.801 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.524 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 77.2 Cg_exo -52.05 -29.78 37.74 Favored 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 123.182 2.588 . . . . 54.14 114.45 -177.222 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -78.34 6.78 7.59 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 112.222 0.453 . . . . 61.24 112.222 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 43.8 t -70.41 93.35 0.87 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.001 0.429 . . . . 60.44 111.511 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 59.8 tp -71.71 114.17 9.52 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 116.4 -0.364 . . . . 43.43 110.848 176.832 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.0 mm -79.02 -45.8 24.06 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-N 116.227 -0.442 . . . . 72.15 111.459 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 86.2 p -176.1 149.19 0.86 Allowed 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 112.473 0.546 . . . . 64.45 112.473 178.404 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.626 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 49.1 mt-10 -95.95 136.65 36.11 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 116.182 -0.463 . . . . 73.13 110.884 173.344 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -142.66 143.19 25.1 Favored Pre-proline 0 N--CA 1.471 0.623 0 C-N-CA 122.18 0.192 . . . . 73.15 111.393 177.222 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -71.75 -18.99 28.1 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.387 2.058 . . . . 71.0 112.921 -178.082 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 66.4 p -119.19 150.08 40.65 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.128 0.49 . . . . 73.21 111.524 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.442 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -67.77 -33.37 74.71 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.224 -0.444 . . . . 52.35 111.144 177.616 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -59.46 -48.34 82.04 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.28 -0.418 . . . . 72.41 111.629 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -63.34 -34.43 77.7 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.801 0.334 . . . . 71.33 111.862 177.155 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.51 -40.3 92.86 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 120.904 0.383 . . . . 74.23 110.786 174.426 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.442 ' HG3' ' O ' ' A' ' 47' ' ' ALA . 64.7 mtt -67.08 -34.41 77.59 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.285 -0.416 . . . . 75.13 111.42 176.768 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.493 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 12.7 t70 -57.27 -53.19 60.97 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.05 0.452 . . . . 73.35 110.823 176.137 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.07 -31.56 72.15 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 116.239 -0.437 . . . . 54.34 111.331 178.369 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.435 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 87.8 tttt -62.59 -49.01 76.95 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 116.241 -0.436 . . . . 71.42 110.95 175.795 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -59.43 -43.64 93.06 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 116.277 -0.419 . . . . 64.32 111.217 176.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.493 ' HG3' ' O ' ' A' ' 52' ' ' ASP . 78.5 mtp180 -59.03 -38.71 79.92 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.81 0.338 . . . . 72.3 111.174 176.651 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -64.93 -39.55 93.68 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-O 121.062 0.458 . . . . 71.02 110.979 175.615 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 54' ' ' LYS . 42.3 mt-10 -69.52 -36.25 76.25 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.168 -0.469 . . . . 73.33 111.569 179.372 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 . . . . . 0 CA--C 1.543 0.69 0 C-N-CA 122.42 0.288 . . . . 73.34 111.129 174.61 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 . . . . . 0 N--CA 1.473 0.699 0 N-CA-C 112.016 0.376 . . . . 54.02 112.016 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.435 ' O ' ' HE2' ' A' ' 54' ' ' LYS . . . -120.85 155.58 33.8 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.837 0.351 . . . . 33.52 111.335 175.368 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 26.2 p90 -139.04 142.24 38.24 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.168 0.508 . . . . 73.11 111.588 178.469 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 64.8 mt -94.02 131.13 41.79 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 116.12 -0.491 . . . . 74.14 111.51 -178.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 67.3 t -117.91 127.79 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-O 120.817 0.342 . . . . 71.21 111.18 178.779 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 75.3 p -86.79 112.81 22.07 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.136 0.493 . . . . 74.21 111.95 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.5 pt -114.85 176.83 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 116.084 -0.507 . . . . 62.1 110.57 174.531 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.551 ' HB2' ' HB ' ' A' ' 24' ' ' THR . 10.2 pt-20 -140.83 126.91 19.51 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.266 0.555 . . . . 72.31 111.879 177.511 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -104.94 170.25 7.98 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.115 -0.493 . . . . 74.22 110.745 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 98.88 -168.33 22.36 Favored Glycine 0 CA--C 1.527 0.84 0 C-N-CA 120.846 -0.692 . . . . 32.22 113.562 177.281 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -70.04 143.12 91.14 Favored Pre-proline 0 N--CA 1.472 0.65 0 N-CA-C 112.064 0.394 . . . . 62.32 112.064 -178.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -54.32 119.45 6.38 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.465 2.11 . . . . 62.2 111.815 176.217 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.2 -47.71 1.34 Allowed Glycine 0 CA--C 1.526 0.74 0 C-N-CA 121.322 -0.466 . . . . 35.25 112.373 -174.721 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -99.33 60.43 1.17 Allowed 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.047 0.451 . . . . 73.12 110.65 176.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.551 ' HB ' ' HB2' ' A' ' 17' ' ' GLU . 38.6 p -98.52 154.46 17.88 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 113.029 0.751 . . . . 51.32 113.029 -174.469 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 56.9 t -110.8 127.12 68.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-N 115.618 -0.719 . . . . 62.42 110.458 175.272 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 88.2 m -72.96 115.33 12.14 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 112.25 0.463 . . . . 75.5 112.25 -178.36 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 56.7 m95 -110.07 141.37 43.01 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.227 -0.442 . . . . 64.13 111.104 176.693 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -103.29 115.27 30.24 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.529 -0.305 . . . . 71.23 110.876 178.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.588 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 90.0 mt-30 -94.33 119.22 32.77 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 120.959 0.409 . . . . 53.43 111.572 176.675 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.2 tp -84.51 110.97 19.08 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 120.863 0.363 . . . . 75.3 110.122 174.723 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 47.0 mtp180 -118.92 166.64 12.58 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.473 -0.33 . . . . 73.21 110.673 -176.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -133.04 144.03 49.78 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 111.68 0.252 . . . . 54.42 111.68 178.325 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -79.41 -28.52 41.79 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 111.963 0.357 . . . . 73.43 111.963 178.447 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 85.7 m-70 -107.01 128.34 26.27 Favored Pre-proline 0 CA--C 1.542 0.67 0 CA-C-N 116.605 -0.27 . . . . 71.03 111.385 -175.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -85.84 -22.36 13.32 Favored 'Cis proline' 0 C--N 1.354 0.864 0 C-N-CA 123.969 -1.263 . . . . 70.11 113.249 -2.598 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -117.7 141.94 29.82 Favored Pre-proline 0 N--CA 1.469 0.51 0 CA-C-N 116.32 -0.4 . . . . 74.45 111.114 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_exo -61.19 -24.44 79.07 Favored 'Trans proline' 0 N--CA 1.479 0.631 0 C-N-CA 122.594 2.196 . . . . 70.12 112.088 177.123 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -82.13 10.84 5.98 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.504 -0.771 . . . . 54.51 111.982 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 51.7 m -73.56 89.31 1.7 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.065 0.459 . . . . 61.44 111.007 177.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 60.8 tp -85.57 125.1 32.84 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.19 -0.459 . . . . 65.41 110.861 178.198 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.6 mm -92.25 -53.92 8.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-O 120.741 0.305 . . . . 72.1 111.561 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 84.0 p -168.71 152.37 5.51 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 112.194 0.442 . . . . 73.21 112.194 -178.578 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.588 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 49.2 mt-10 -105.15 135.65 46.11 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 116.215 -0.448 . . . . 74.12 110.587 174.687 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -138.41 136.79 19.46 Favored Pre-proline 0 CA--C 1.539 0.534 0 O-C-N 122.394 -0.191 . . . . 64.42 111.497 179.329 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -76.57 -4.31 14.85 Favored 'Trans proline' 0 CA--C 1.54 0.824 0 C-N-CA 122.622 2.214 . . . . 73.24 113.569 -177.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 71.1 p -129.73 144.08 51.12 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.095 0.474 . . . . 74.44 111.24 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.76 -38.73 86.24 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.239 -0.437 . . . . 60.41 111.531 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -55.2 -49.32 72.21 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.642 0.258 . . . . 73.11 111.11 178.335 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -63.28 -35.92 81.96 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 120.936 0.398 . . . . 74.13 111.664 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.37 -52.91 50.46 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.048 0.452 . . . . 61.33 111.203 176.514 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 87.8 mtp -62.09 -37.7 86.07 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 116.012 -0.54 . . . . 74.25 111.347 177.084 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.478 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 20.2 t70 -61.09 -52.23 65.78 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.874 -0.603 . . . . 64.14 110.924 178.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.56 -39.94 92.93 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.241 -0.436 . . . . 60.11 111.398 176.809 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.435 ' HE2' ' O ' ' A' ' 11' ' ' ALA . 61.0 tttm -56.27 -54.92 39.6 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 120.93 0.395 . . . . 74.15 111.448 179.35 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.478 ' HG2' ' O ' ' A' ' 52' ' ' ASP . 22.4 pttm -58.28 -40.81 82.88 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.563 -0.29 . . . . 73.41 110.328 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 69.5 mtp180 -67.21 -25.69 66.24 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 111.985 0.365 . . . . 64.43 111.985 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 75.4 t80 -77.02 -29.67 55.45 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 120.909 0.385 . . . . 64.3 111.509 174.797 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -102.54 -15.71 16.34 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.445 0.905 . . . . 74.01 113.445 -177.14 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 . . . . . 0 N--CA 1.475 0.792 0 O-C-N 121.993 -0.442 . . . . 64.32 112.039 179.225 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.62 0 N-CA-C 110.197 -0.297 . . . . 63.11 110.197 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.481 ' HB3' ' HG3' ' A' ' 54' ' ' LYS . . . -113.06 166.28 11.57 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.674 0.273 . . . . 74.5 111.009 176.737 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 22.6 p90 -155.78 143.56 19.67 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.248 0.547 . . . . 63.45 111.907 177.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 57.1 mt -96.85 111.32 26.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 CA-C-N 115.949 -0.568 . . . . 64.32 112.277 -175.096 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 72.4 t -106.26 126.89 61.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 122.518 0.327 . . . . 72.44 111.188 178.025 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 61.7 p -87.23 124.12 32.98 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 122.201 -0.312 . . . . 74.02 111.544 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.521 HD13 ' NE2' ' A' ' 29' ' ' GLN . 43.3 pt -114.63 154.37 16.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 CA-C-O 121.005 0.431 . . . . 75.43 111.705 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -100.74 109.68 21.72 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.19 -0.459 . . . . 71.42 111.733 -179.04 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.509 ' HE2' HD11 ' A' ' 16' ' ' ILE . 67.6 mttm -104.47 177.7 4.77 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 120.756 0.312 . . . . 75.4 110.285 175.594 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 88.32 -136.58 13.83 Favored Glycine 0 CA--C 1.527 0.793 0 C-N-CA 120.682 -0.77 . . . . 73.4 113.721 176.013 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -102.4 160.59 25.89 Favored Pre-proline 0 CA--C 1.54 0.578 0 CA-C-O 120.739 0.305 . . . . 62.42 111.669 -177.38 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -60.42 132.44 43.58 Favored 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 122.034 1.823 . . . . 74.33 111.685 169.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 80.37 -61.49 4.42 Favored Glycine 0 CA--C 1.528 0.864 0 C-N-CA 120.794 -0.717 . . . . 44.41 112.426 -175.513 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -87.39 75.8 9.17 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 121.449 0.642 . . . . 72.44 110.426 174.193 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 65.4 p -94.46 165.04 12.75 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.608 0.718 . . . . 64.12 112.632 -177.57 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 40.4 t -122.2 110.44 27.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-N 115.33 -0.85 . . . . 73.14 109.58 172.319 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 59.0 m -78.03 115.57 17.86 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.986 0.422 . . . . 72.11 111.963 -177.094 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 40.4 m95 -108.44 140.03 42.33 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.084 0.469 . . . . 73.52 111.561 178.562 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -92.35 114.31 26.82 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.228 -0.442 . . . . 70.51 110.931 178.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.692 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 76.6 mt-30 -97.84 116.99 31.16 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.341 -0.39 . . . . 74.43 111.553 178.334 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 49.8 tp -85.61 103.75 14.72 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 120.768 0.318 . . . . 73.2 110.183 173.339 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -103.71 148.24 26.29 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 110.319 -0.252 . . . . 70.33 110.319 178.195 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -124.02 149.11 46.44 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 112.139 0.422 . . . . 62.31 112.139 -178.652 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.635 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 34.4 t70 -66.38 -25.07 66.61 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 113.344 0.868 . . . . 72.32 113.344 -173.357 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 43.8 m-70 -122.06 142.5 36.68 Favored Pre-proline 0 N--CA 1.475 0.809 0 O-C-N 121.739 -0.601 . . . . 72.33 111.729 -178.139 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -74.42 -28.92 7.04 Favored 'Cis proline' 0 C--N 1.359 1.087 0 C-N-CA 124.182 -1.174 . . . . 62.12 113.385 0.577 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm -121.21 143.79 38.14 Favored Pre-proline 0 N--CA 1.467 0.408 0 N-CA-C 110.152 -0.314 . . . . 75.0 110.152 174.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.635 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 11.0 Cg_endo -52.36 -31.88 49.3 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.025 2.483 . . . . 72.35 114.62 -171.368 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -99.79 20.83 13.45 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 112.618 0.599 . . . . 72.22 112.618 -177.155 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 26.7 m -62.18 101.15 0.2 Allowed 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 121.266 0.555 . . . . 31.22 110.975 174.702 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.414 HD13 ' HB3' ' A' ' 29' ' ' GLN . 50.9 tp -72.41 106.51 4.56 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.764 -0.653 . . . . 65.41 112.259 -177.287 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 47.3 mm -65.31 -54.29 30.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-N 116.274 -0.421 . . . . 72.52 111.099 176.844 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 42.1 t -169.22 149.77 4.22 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 112.043 0.386 . . . . 74.35 112.043 -178.832 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.692 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 46.1 mt-10 -103.03 125.12 49.64 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 116.251 -0.431 . . . . 73.34 110.802 176.493 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 84.7 m-70 -128.2 148.62 68.46 Favored Pre-proline 0 N--CA 1.477 0.905 0 N-CA-C 111.797 0.295 . . . . 75.02 111.797 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -73.61 -21.25 19.47 Favored 'Trans proline' 0 CA--C 1.544 1.018 0 C-N-CA 122.547 2.165 . . . . 72.55 113.451 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 33.4 p -118.73 152.36 36.29 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 120.927 0.394 . . . . 45.35 111.654 179.217 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.41 -35.21 77.32 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.313 -0.403 . . . . 60.22 111.394 176.386 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -53.6 -49.12 68.46 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 120.767 0.318 . . . . 64.52 111.834 -179.394 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -58.76 -44.07 90.48 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 120.991 0.424 . . . . 74.14 111.743 178.485 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.38 -40.72 85.71 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 116.273 -0.421 . . . . 64.45 111.77 179.565 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 65.7 mtt -64.47 -43.22 94.86 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.856 0.36 . . . . 73.1 110.964 177.701 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -55.09 -51.1 67.46 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.076 0.465 . . . . 73.11 110.602 175.105 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.62 -35.58 78.3 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.011 -0.54 . . . . 71.3 111.487 179.094 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.481 ' HG3' ' HB3' ' A' ' 11' ' ' ALA . 63.2 tttm -63.6 -56.02 19.14 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 116.487 -0.324 . . . . 64.11 111.315 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 11.9 mptt -59.14 -43.72 92.02 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.102 0.477 . . . . 72.13 111.103 176.185 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 51.2 ttm-85 -65.85 -30.67 71.32 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.087 -0.506 . . . . 64.51 111.478 -178.278 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -67.88 -41.87 82.14 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 116.224 -0.443 . . . . 71.32 110.96 175.625 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -77.78 -8.58 58.2 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 112.696 0.628 . . . . 73.44 112.696 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 38.0 t70 . . . . . 0 CA--C 1.546 0.799 0 CA-C-O 121.014 0.435 . . . . 75.21 111.189 179.035 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 . . . . . 0 CA--C 1.537 0.464 0 CA-C-O 120.89 0.376 . . . . 75.04 111.678 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -129.49 158.04 40.33 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.114 -0.494 . . . . 54.22 111.119 177.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 39.5 p90 -151.37 155.24 38.26 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.099 0.476 . . . . 62.14 112.004 -177.409 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 60.1 mt -98.12 128.39 49.6 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 N-CA-C 112.401 0.519 . . . . 73.44 112.401 -176.797 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 48.7 t -115.67 141.7 31.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 122.604 0.362 . . . . 73.53 110.944 176.449 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 60.8 p -102.1 128.47 48.55 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 121.166 0.508 . . . . 74.44 112.005 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.545 HD13 ' NE2' ' A' ' 29' ' ' GLN . 41.9 pt -132.72 176.35 9.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-O 121.005 0.431 . . . . 73.04 111.094 176.674 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.54 ' HB2' ' HB ' ' A' ' 24' ' ' THR . 9.1 pt-20 -137.23 137.96 39.63 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.097 0.475 . . . . 73.44 111.674 177.622 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.401 ' HE3' HD11 ' A' ' 16' ' ' ILE . 95.4 mttt -127.53 164.91 20.92 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.113 -0.494 . . . . 73.25 111.016 179.638 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.74 -140.16 14.76 Favored Glycine 0 CA--C 1.533 1.18 0 N-CA-C 114.698 0.639 . . . . 71.13 114.698 175.191 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -86.1 157.11 57.18 Favored Pre-proline 0 N--CA 1.473 0.687 0 N-CA-C 112.279 0.474 . . . . 70.52 112.279 -173.825 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.35 141.4 68.1 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 122.092 1.861 . . . . 73.44 111.82 174.577 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.2 -61.75 3.79 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 120.949 -0.643 . . . . 74.25 112.477 -176.303 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -92.23 71.78 5.34 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 121.277 0.56 . . . . 74.13 111.099 176.088 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.54 ' HB ' ' HB2' ' A' ' 17' ' ' GLU . 63.1 p -93.88 159.2 15.29 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.737 -0.665 . . . . 61.24 111.236 178.883 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 61.0 t -108.98 127.78 65.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-N 116.521 -0.309 . . . . 64.3 111.028 178.109 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 37.8 m -76.78 116.11 17.15 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.773 0.32 . . . . 72.44 111.849 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -112.31 131.08 55.71 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.051 0.453 . . . . 75.2 111.281 176.346 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -96.9 114.13 25.72 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.034 0.445 . . . . 74.04 110.637 177.79 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.545 ' NE2' HD13 ' A' ' 16' ' ' ILE . 92.5 mt-30 -94.37 119.28 32.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.053 -0.521 . . . . 54.41 111.546 179.429 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.8 tp -83.45 107.36 15.89 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.197 -0.297 . . . . 74.5 110.197 172.368 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 31' ' ' ARG . 50.9 mtt180 -111.86 161.31 16.5 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 120.918 0.389 . . . . 71.12 111.231 179.435 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -123.25 166.88 14.51 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 120.988 0.423 . . . . 53.42 111.343 178.298 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -86.79 -37.71 17.55 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 116.381 -0.372 . . . . 62.15 111.841 -178.203 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 43.6 m80 -115.22 147.79 39.29 Favored Pre-proline 0 N--CA 1.475 0.777 0 C-N-CA 122.439 0.296 . . . . 74.2 111.555 178.738 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -82.7 -2.19 52.3 Favored 'Cis proline' 0 C--N 1.355 0.918 0 C-N-CA 124.147 -1.189 . . . . 74.54 112.851 -2.244 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -140.66 135.54 15.77 Favored Pre-proline 0 N--CA 1.466 0.372 0 CA-C-N 115.742 -0.663 . . . . 64.41 110.246 177.448 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -61.73 -20.95 70.98 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 121.939 1.759 . . . . 74.53 111.687 175.293 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -80.38 -3.03 48.08 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 115.632 -0.713 . . . . 73.12 111.629 177.564 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 42.5 t -60.79 96.61 0.05 OUTLIER 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 121.05 0.452 . . . . 75.13 112.176 -175.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 64.9 tp -81.39 106.47 13.38 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.067 0.46 . . . . 65.21 111.062 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.2 mm -71.6 -51.73 30.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 116.386 -0.37 . . . . 54.1 111.135 179.224 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 43.2 t -171.53 149.55 2.67 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 116.382 -0.372 . . . . 72.32 111.747 178.701 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.483 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 52.0 mt-10 -102.1 141.26 35.22 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 116.452 -0.34 . . . . 71.35 110.885 177.862 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -144.07 141.22 18.0 Favored Pre-proline 0 CA--C 1.539 0.53 0 O-C-N 122.304 -0.247 . . . . 73.3 111.269 178.132 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.49 -12.64 24.95 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 122.431 2.087 . . . . 71.51 113.156 -178.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 80.3 p -122.58 141.88 51.23 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-O 121.051 0.453 . . . . 73.43 111.212 177.485 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.28 -31.84 72.44 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.356 -0.384 . . . . 63.51 111.696 -179.474 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.51 -46.98 73.62 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 120.704 0.288 . . . . 45.11 110.755 177.614 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -60.92 -39.48 89.58 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.996 0.427 . . . . 74.32 111.575 175.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.68 -37.89 89.13 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 116.331 -0.395 . . . . 72.14 111.023 176.727 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 67.3 mtt -68.44 -51.97 37.81 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.594 -0.276 . . . . 74.31 111.515 177.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -57.36 -41.35 79.97 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 120.773 0.32 . . . . 70.15 111.854 178.099 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.07 -40.19 87.0 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 120.85 0.357 . . . . 61.5 111.132 175.648 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 52.5 tttp -62.77 -58.64 6.73 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 122.669 0.387 . . . . 71.2 112.024 178.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -56.45 -36.39 68.97 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 121.207 0.527 . . . . 71.21 111.655 -179.397 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 32.5 ttp180 -80.44 -26.5 38.35 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 116.007 -0.542 . . . . 74.33 111.798 -178.237 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -81.6 -42.72 19.65 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.752 0.31 . . . . 73.34 111.537 178.004 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -64.42 -9.71 20.1 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 121.491 0.662 . . . . 72.42 111.155 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.8 t70 . . . . . 0 CA--C 1.548 0.897 0 CA-C-N 115.406 -0.815 . . . . 61.33 109.657 171.502 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 . . . . . 0 CA--C 1.537 0.46 0 CA-C-O 120.595 0.236 . . . . 74.11 111.264 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.537 ' O ' ' HE2' ' A' ' 54' ' ' LYS . . . -106.73 146.31 30.97 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 120.614 0.245 . . . . 73.44 111.427 179.345 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 40.2 p90 -144.98 153.24 41.29 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.162 0.506 . . . . 73.41 112.132 179.747 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.2 mt -96.18 135.21 31.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-N 116.095 -0.502 . . . . 71.03 111.951 -178.125 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 95.4 t -123.9 134.56 66.15 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-N 116.143 -0.48 . . . . 75.5 110.897 177.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 65.3 p -96.45 124.96 40.62 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 120.899 0.38 . . . . 71.2 111.807 -178.427 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.419 HD13 ' NE2' ' A' ' 29' ' ' GLN . 35.2 pt -126.14 170.79 15.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-N 116.317 -0.401 . . . . 75.4 111.462 179.22 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -128.49 135.11 49.0 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 116.351 -0.386 . . . . 74.41 110.858 178.481 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -122.43 158.11 30.45 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 120.896 0.379 . . . . 75.03 111.844 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.62 -138.79 14.08 Favored Glycine 0 CA--C 1.529 0.931 0 CA-C-N 116.268 -0.424 . . . . 63.51 113.966 177.141 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 54.2 mttp -94.64 155.46 39.43 Favored Pre-proline 0 CA--C 1.541 0.609 0 N-CA-C 111.926 0.343 . . . . 74.14 111.926 -174.618 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -52.96 130.3 37.22 Favored 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 122.879 2.386 . . . . 72.54 113.185 -178.056 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 77.46 -64.47 3.22 Favored Glycine 0 CA--C 1.523 0.55 0 C-N-CA 121.123 -0.561 . . . . 72.3 112.822 -178.208 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 69.6 mm-40 -80.93 71.53 7.89 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.272 0.558 . . . . 63.31 110.942 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 45.6 p -106.6 172.24 6.92 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.429 0.633 . . . . 75.31 112.201 -176.389 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 91.1 t -111.25 128.66 67.58 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-N 115.745 -0.662 . . . . 75.13 109.981 169.149 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 87.2 m -83.94 115.37 22.27 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.122 0.487 . . . . 71.23 111.762 -176.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 65.1 m95 -109.07 149.76 28.81 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 116.132 -0.485 . . . . 73.11 111.612 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -112.94 116.06 29.39 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.237 -0.438 . . . . 72.11 111.078 -179.212 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.699 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 85.4 mt-30 -101.02 133.33 45.67 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.297 -0.411 . . . . 62.24 111.882 -179.871 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.472 HD11 ' HB1' ' A' ' 11' ' ' ALA . 56.7 tp -91.66 111.35 22.82 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 110.145 -0.317 . . . . 73.15 110.145 172.92 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 37.5 mtp180 -115.12 148.67 38.68 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 110.17 -0.307 . . . . 73.54 110.17 -178.902 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -115.06 160.81 19.19 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.923 0.712 . . . . 73.52 112.923 -175.057 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -71.16 -36.0 71.86 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 115.461 -0.79 . . . . 73.25 112.498 -177.318 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.488 ' HA ' ' C ' ' A' ' 35' ' ' PRO . 45.6 m-70 -137.45 157.14 74.49 Favored Pre-proline 0 CA--C 1.544 0.724 0 C-N-CA 122.289 0.235 . . . . 74.34 111.473 -179.365 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.488 ' C ' ' HA ' ' A' ' 34' ' ' HIS . 24.5 Cg_endo -60.47 -47.98 0.18 OUTLIER 'Cis proline' 0 C--N 1.363 1.334 0 C-N-CA 124.906 -0.872 . . . . 55.22 113.85 2.387 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -112.85 150.12 42.31 Favored Pre-proline 0 CA--C 1.538 0.489 0 CA-C-O 120.466 0.174 . . . . 74.21 110.702 175.372 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -65.82 -22.85 56.04 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 122.091 1.86 . . . . 70.43 112.602 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -75.88 -9.32 58.51 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 116.434 -0.348 . . . . 64.43 111.159 178.593 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 98.5 p -53.91 116.68 2.67 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 121.407 0.622 . . . . 63.2 112.267 -176.176 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 57.8 tp -95.09 117.43 30.17 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.156 -0.474 . . . . 64.03 111.006 177.061 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 50.3 mm -78.73 -54.23 12.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-O 120.909 0.385 . . . . 74.53 110.944 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 36.9 t -168.94 162.14 11.03 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.024 0.44 . . . . 74.04 111.729 179.051 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.699 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 40.6 mt-10 -116.85 138.12 51.73 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 116.003 -0.544 . . . . 72.34 110.887 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 50.4 m80 -143.25 147.27 39.81 Favored Pre-proline 0 N--CA 1.472 0.647 0 CA-C-O 120.597 0.236 . . . . 71.31 111.102 178.074 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -77.38 -4.37 14.64 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.571 2.181 . . . . 61.31 113.268 -178.407 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 31.1 p -128.0 144.4 51.1 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 120.831 0.348 . . . . 74.04 111.185 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.409 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -66.37 -33.71 76.34 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 120.829 0.347 . . . . 52.13 111.104 177.43 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.67 -52.13 64.9 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 116.264 -0.425 . . . . 75.03 111.116 179.331 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -58.32 -41.0 83.57 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.063 0.459 . . . . 74.01 111.533 177.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.75 -38.65 88.76 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.938 0.399 . . . . 63.02 111.27 178.12 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.468 ' O ' ' HG3' ' A' ' 55' ' ' LYS . 66.2 mtt -68.48 -43.51 76.76 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 116.277 -0.42 . . . . 74.2 110.884 176.344 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -54.68 -44.11 73.07 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.274 0.559 . . . . 74.21 111.236 177.097 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.07 -39.16 75.79 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 116.155 -0.475 . . . . 71.14 111.56 176.42 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.537 ' HE2' ' O ' ' A' ' 11' ' ' ALA . 62.2 tttm -56.09 -50.09 72.0 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 121.081 0.467 . . . . 75.14 110.928 177.723 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 51' ' ' MET . 62.7 mttm -61.15 -47.65 85.26 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.983 -0.553 . . . . 72.21 111.241 179.479 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 41.9 ttp180 -65.69 -25.18 67.21 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 115.969 -0.559 . . . . 73.01 111.713 -177.939 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -79.0 -51.58 9.4 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 121.131 0.491 . . . . 71.02 111.339 176.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -67.4 -32.43 73.33 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 116.351 -0.386 . . . . 73.22 111.75 -177.171 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 . . . . . 0 CA--C 1.536 0.432 0 N-CA-C 110.134 -0.321 . . . . 61.33 110.134 171.252 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.724 0 CA-C-O 121.123 0.487 . . . . 71.21 111.91 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -138.7 -174.85 3.94 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 116.174 -0.466 . . . . 63.41 111.7 -179.303 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -159.56 169.66 23.34 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.92 0.39 . . . . 75.4 111.325 179.381 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.9 mt -112.12 139.15 38.11 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 CA-C-O 120.995 0.426 . . . . 74.11 111.7 179.411 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.515 HG21 ' HD2' ' A' ' 31' ' ' ARG . 89.3 t -115.62 136.31 52.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 CA-C-N 116.444 -0.344 . . . . 71.52 110.79 175.863 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 50.7 p -104.09 113.2 26.57 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 112.184 0.439 . . . . 71.24 112.184 -178.498 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 38.8 pt -114.06 168.09 6.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 CA-C-N 116.432 -0.349 . . . . 61.43 110.994 176.728 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -126.12 134.68 51.27 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 121.218 0.532 . . . . 74.15 111.611 -177.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -129.15 160.24 33.49 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 116.231 -0.441 . . . . 72.42 111.294 178.765 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.52 -137.22 13.13 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 121.132 -0.556 . . . . 61.13 113.91 177.393 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -87.66 144.28 35.05 Favored Pre-proline 0 N--CA 1.469 0.507 0 O-C-N 122.682 -0.305 . . . . 63.3 111.64 -176.172 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -50.81 -43.78 44.81 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 122.987 2.458 . . . . 75.22 113.685 -177.654 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.08 -61.23 3.31 Favored Glycine 0 CA--C 1.526 0.725 0 C-N-CA 121.117 -0.564 . . . . 44.51 112.747 179.62 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -100.06 84.09 2.8 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.111 0.481 . . . . 64.51 111.161 178.76 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 48.2 p -85.69 159.13 19.88 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.405 0.622 . . . . 64.33 111.936 178.44 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 57.4 t -109.3 124.11 65.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 CA-C-N 115.899 -0.591 . . . . 74.44 109.983 173.679 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 85.8 m -80.91 115.27 20.31 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.11 0.481 . . . . 74.42 111.643 -178.035 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 60.7 m95 -105.75 131.25 53.33 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.027 -0.533 . . . . 74.34 110.999 176.999 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 51.9 m-85 -97.09 114.18 25.82 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.138 -0.483 . . . . 62.14 111.087 -178.153 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.534 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 87.7 mt-30 -91.83 108.81 20.18 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.223 -0.444 . . . . 70.51 111.186 176.531 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.0 tp -71.1 109.54 5.23 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.026 0.441 . . . . 61.01 110.434 172.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.515 ' HD2' HG21 ' A' ' 14' ' ' VAL . 58.5 mtt180 -125.17 158.11 34.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.145 0.498 . . . . 74.2 111.406 -178.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -118.14 157.44 26.92 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.236 -0.438 . . . . 72.52 110.325 172.397 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.439 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 29.4 t70 -86.82 -20.12 28.01 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.441 0.638 . . . . 75.34 110.486 174.918 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 48.5 m80 -126.65 138.78 33.19 Favored Pre-proline 0 CA--C 1.542 0.644 0 CA-C-N 115.9 -0.591 . . . . 61.4 110.858 -179.084 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -82.69 -1.34 52.59 Favored 'Cis proline' 0 CA--C 1.542 0.882 0 C-N-CA 124.292 -1.128 . . . . 74.2 113.417 0.011 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -136.99 142.77 39.68 Favored Pre-proline 0 N--CA 1.469 0.515 0 CA-C-N 116.311 -0.404 . . . . 71.11 110.409 177.381 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.439 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 55.6 Cg_endo -71.15 -37.13 6.33 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 122.264 1.976 . . . . 71.31 112.817 -177.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -89.0 24.44 2.09 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.984 -0.448 . . . . 74.32 111.725 176.703 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.9 p -65.26 97.38 0.27 Allowed 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.223 0.535 . . . . 75.1 110.904 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 37.7 tp -78.85 102.83 8.41 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 120.99 0.424 . . . . 63.01 111.143 -178.53 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 39.3 mm -84.33 -47.86 17.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-O 120.983 0.42 . . . . 73.34 111.205 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 43.7 t -164.3 157.08 17.28 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 116.426 -0.352 . . . . 74.13 111.945 -178.824 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.534 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 45.2 mt-10 -130.36 125.03 33.61 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 122.453 0.301 . . . . 75.34 110.816 176.256 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 78.3 m-70 -139.6 146.17 46.71 Favored Pre-proline 0 N--CA 1.473 0.71 0 CA-C-O 120.693 0.283 . . . . 72.2 111.615 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -76.28 -12.14 19.12 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.573 2.182 . . . . 65.31 113.411 -176.053 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 32.2 p -118.54 142.89 47.16 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 120.897 0.38 . . . . 63.22 111.219 178.46 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.73 -33.21 75.34 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 120.612 0.244 . . . . 50.14 111.401 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 26.0 tp60 -53.85 -48.17 70.24 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.471 -0.331 . . . . 71.54 111.505 177.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -62.73 -42.67 99.77 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.889 0.376 . . . . 74.15 111.545 177.635 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.58 -43.94 92.27 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.333 -0.394 . . . . 65.41 111.575 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 90.8 mtp -67.08 -39.21 86.77 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.362 -0.381 . . . . 74.41 111.399 179.229 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.421 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 37.9 t70 -63.56 -40.35 96.77 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 120.961 0.41 . . . . 70.32 111.157 177.405 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -75.49 -32.8 60.68 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 116.132 -0.486 . . . . 52.22 111.433 177.453 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -59.55 -52.21 66.54 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.471 -0.331 . . . . 60.23 111.242 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' 52' ' ' ASP . 19.3 pttm -58.45 -25.97 62.82 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.383 0.611 . . . . 75.12 110.985 177.907 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -78.08 -44.78 25.29 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.8 -0.637 . . . . 74.34 111.397 -179.019 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -68.32 -37.03 80.16 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.915 0.388 . . . . 75.31 111.377 178.158 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -78.56 13.87 1.47 Allowed 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.436 -0.347 . . . . 63.14 111.915 -178.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 16.8 t0 . . . . . 0 CA--C 1.544 0.742 0 N-CA-C 110.118 -0.327 . . . . 71.05 110.118 175.647 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 . . . . . 0 N--CA 1.472 0.645 0 N-CA-C 112.418 0.525 . . . . 62.23 112.418 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.51 160.42 21.77 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.086 -0.506 . . . . 74.23 111.594 178.45 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 50.6 p90 -142.59 145.38 33.49 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.471 -0.331 . . . . 72.12 110.819 177.83 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 62.2 mt -104.01 131.32 53.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-O 121.074 0.464 . . . . 75.42 111.838 -178.728 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 63.0 t -116.03 125.49 73.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 CA-C-N 116.246 -0.434 . . . . 51.13 111.043 177.397 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 42.9 p -87.19 120.84 28.88 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 120.975 0.417 . . . . 73.45 111.39 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.452 HD13 ' NE2' ' A' ' 29' ' ' GLN . 35.1 pt -118.08 166.9 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-O 120.863 0.363 . . . . 73.4 111.348 178.387 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.436 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 44.0 mt-10 -125.1 114.82 19.56 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.494 -0.321 . . . . 62.23 110.865 178.486 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -122.45 174.16 7.21 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 116.608 -0.269 . . . . 64.32 111.661 -177.758 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.71 -136.89 12.94 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 121.013 -0.613 . . . . 73.13 112.808 -178.67 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -79.21 153.91 77.04 Favored Pre-proline 0 CA--C 1.539 0.545 0 O-C-N 122.469 -0.43 . . . . 70.34 111.22 178.571 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -57.78 -44.23 42.71 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.396 2.064 . . . . 74.31 112.474 176.899 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -82.89 -46.01 6.46 Favored Glycine 0 CA--C 1.528 0.853 0 C-N-CA 121.301 -0.476 . . . . 43.21 112.839 177.107 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -96.83 79.5 2.94 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.1 0.476 . . . . 74.43 111.286 178.171 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.436 ' HB ' ' HB3' ' A' ' 17' ' ' GLU . 69.3 p -88.23 146.18 25.49 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.969 -0.56 . . . . 74.01 111.54 178.194 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 54.8 t -109.47 128.6 65.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.917 -0.583 . . . . 73.44 110.33 174.689 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 94.6 m -79.21 114.22 17.97 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.135 0.493 . . . . 65.3 111.082 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -110.07 131.29 55.19 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 116.146 -0.479 . . . . 74.25 111.52 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -93.28 114.21 26.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.834 0.35 . . . . 74.35 110.538 176.793 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.816 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 72.9 mt-30 -98.01 113.65 25.56 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.412 -0.358 . . . . 70.15 111.668 -179.342 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 54.8 tp -79.53 116.72 19.91 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.352 -0.385 . . . . 74.41 110.513 174.865 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.426 HH11 ' HD3' ' A' ' 31' ' ' ARG . 51.7 mtt180 -129.26 170.5 13.53 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.869 0.366 . . . . 71.14 111.97 -177.231 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -136.01 167.09 21.88 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.981 0.42 . . . . 73.52 111.129 175.837 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -95.53 -9.74 31.57 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 112.271 0.471 . . . . 74.04 112.271 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 39.9 m80 -142.81 149.53 50.18 Favored Pre-proline 0 CA--C 1.541 0.606 0 O-C-N 122.357 -0.214 . . . . 54.42 110.95 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -70.54 -21.98 10.61 Favored 'Cis proline' 0 C--N 1.356 0.95 0 C-N-CA 124.392 -1.087 . . . . 70.43 113.244 -0.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -118.55 135.28 23.57 Favored Pre-proline 0 N--CA 1.47 0.557 0 CA-C-N 116.705 -0.225 . . . . 73.02 110.708 176.957 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.0 -27.21 84.37 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 122.219 1.946 . . . . 64.11 111.592 174.436 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -77.77 -2.39 36.09 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 115.2 -0.909 . . . . 74.23 112.504 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 90.2 p -58.44 110.46 0.98 Allowed 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.271 0.558 . . . . 73.31 112.327 -173.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 56.4 tp -104.03 114.45 28.71 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.918 -0.583 . . . . 71.41 110.463 176.082 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.3 mm -83.64 -53.6 10.91 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 116.288 -0.415 . . . . 74.34 111.935 -177.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.413 ' HG ' ' CD2' ' A' ' 44' ' ' HIS . 40.6 t -162.78 157.53 21.64 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.389 0.514 . . . . 64.24 112.389 -175.58 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.816 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 37.4 mt-10 -120.96 118.41 29.79 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 116.243 -0.435 . . . . 73.02 110.753 177.135 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' HIS . . . . . 0.413 ' CD2' ' HG ' ' A' ' 42' ' ' SER . 61.8 m170 -123.49 143.6 41.9 Favored Pre-proline 0 N--CA 1.475 0.791 0 O-C-N 122.375 -0.203 . . . . 74.0 111.278 -178.707 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -70.1 -22.93 29.85 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 122.632 2.221 . . . . 44.15 114.13 -176.627 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.461 ' OG1' ' HB2' ' A' ' 49' ' ' GLU . 59.6 p -120.74 153.78 36.52 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.11 0.481 . . . . 71.51 111.508 178.826 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.17 -45.32 70.31 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.262 -0.426 . . . . 65.12 111.811 -177.407 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -55.81 -50.58 70.14 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 120.954 0.407 . . . . 64.32 110.637 179.346 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.461 ' HB2' ' OG1' ' A' ' 46' ' ' THR . 0.7 OUTLIER -56.28 -39.59 72.92 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 121.357 0.599 . . . . 73.31 110.45 178.718 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.74 -41.29 75.47 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 116.292 -0.413 . . . . 45.34 111.857 177.395 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 85.1 mtp -67.59 -34.67 77.49 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 112.075 0.398 . . . . 65.54 112.075 -178.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.656 ' HA ' ' HE3' ' A' ' 55' ' ' LYS . 4.6 t70 -64.5 -30.86 71.89 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-O 121.128 0.489 . . . . 75.03 110.934 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -75.88 -40.3 54.78 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.343 0.592 . . . . 72.43 110.618 170.752 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 66.4 tttm -54.84 -47.51 74.06 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 115.563 -0.744 . . . . 75.32 111.691 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.656 ' HE3' ' HA ' ' A' ' 52' ' ' ASP . 18.6 ptpt -57.71 -38.86 75.98 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 116.558 -0.292 . . . . 74.53 111.521 179.347 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 80.1 ttt180 -73.79 -26.02 60.42 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 120.821 0.343 . . . . 74.42 111.798 -178.562 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -73.33 -51.27 18.08 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 120.854 0.359 . . . . 74.31 110.999 175.567 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -73.02 -34.51 66.4 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.241 -0.436 . . . . 64.1 112.096 -176.159 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 . . . . . 0 CA--C 1.549 0.906 0 CA-C-N 116.365 -0.38 . . . . 51.13 111.434 179.198 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.54 ' HA ' ' HG2' ' A' ' 58' ' ' GLU . 13.2 pt-20 . . . . . 0 CA--C 1.539 0.538 0 CA-C-O 120.884 0.374 . . . . 71.43 110.736 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.449 ' HB2' ' CD2' ' A' ' 57' ' ' TYR . . . -124.29 171.87 9.54 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 120.794 0.33 . . . . 70.32 111.534 179.259 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 36.9 p90 -147.36 157.62 43.65 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.139 0.495 . . . . 71.31 111.923 178.838 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 58.6 mt -100.4 137.26 28.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 CA-C-N 116.073 -0.512 . . . . 74.15 111.838 -177.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 61.1 t -117.07 127.44 74.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-N 116.163 -0.471 . . . . 64.24 110.571 177.256 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 65.1 p -95.06 114.41 26.21 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.017 0.437 . . . . 73.51 111.861 -178.562 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.4 pt -121.51 172.18 9.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 121.021 0.439 . . . . 51.12 111.259 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.405 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 1.6 mp0 -128.91 148.84 50.95 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 120.856 0.36 . . . . 61.15 111.057 177.806 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -134.15 166.68 22.21 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-O 120.844 0.354 . . . . 70.43 111.441 178.307 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.53 -143.17 16.17 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 121.234 -0.508 . . . . 71.43 113.734 178.145 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -81.26 142.93 51.43 Favored Pre-proline 0 N--CA 1.471 0.577 0 O-C-N 122.575 -0.368 . . . . 71.04 111.636 -178.716 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -53.44 116.93 3.3 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.371 2.048 . . . . 63.13 112.365 176.324 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 97.61 -67.41 0.8 Allowed Glycine 0 CA--C 1.526 0.751 0 C-N-CA 121.249 -0.501 . . . . 61.12 112.283 -174.37 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -80.95 75.56 7.91 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 121.361 0.6 . . . . 74.43 110.277 176.677 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.405 ' HB ' ' HB3' ' A' ' 17' ' ' GLU . 64.7 p -107.84 163.91 12.71 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.596 -0.729 . . . . 61.42 112.895 -173.917 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 59.0 t -110.14 127.65 66.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-N 115.489 -0.778 . . . . 74.43 110.201 171.271 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 51.4 m -82.26 118.86 23.44 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.402 0.519 . . . . 72.23 112.402 -175.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 67.7 m95 -110.37 149.42 30.27 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.191 -0.458 . . . . 75.5 111.512 178.217 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -110.2 114.63 28.27 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.878 0.371 . . . . 74.14 111.193 178.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.721 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 72.8 mt-30 -95.59 121.57 37.43 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.919 0.39 . . . . 75.14 111.542 178.23 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.6 tp -83.02 109.89 17.5 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.571 -0.286 . . . . 71.52 110.322 173.788 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 53.2 mtt180 -123.4 162.17 23.3 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.448 0.642 . . . . 71.24 112.184 -178.672 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -140.83 -179.35 6.01 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.516 -0.765 . . . . 65.53 110.72 175.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.511 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 20.4 m-20 -103.1 -0.98 29.87 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.203 0.525 . . . . 54.44 111.209 175.512 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -123.72 129.54 24.79 Favored Pre-proline 0 CA--C 1.544 0.725 0 CA-C-N 116.354 -0.384 . . . . 71.51 111.066 -178.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -78.76 -14.86 30.23 Favored 'Cis proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.757 -1.351 . . . . 60.42 113.206 -1.408 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -129.03 143.32 48.31 Favored Pre-proline 0 N--CA 1.472 0.663 0 C-N-CA 122.445 0.298 . . . . 61.24 111.101 -178.723 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.511 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 53.8 Cg_exo -54.54 -28.9 57.43 Favored 'Trans proline' 0 CA--C 1.545 1.073 0 C-N-CA 122.338 2.025 . . . . 42.32 113.023 174.26 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -88.98 16.64 6.7 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-O 121.03 0.443 . . . . 63.04 111.309 177.07 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 83.1 p -66.52 96.13 0.36 Allowed 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.45 0.643 . . . . 63.24 111.474 -179.458 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 56.7 tp -87.26 107.6 18.57 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.071 -0.513 . . . . 73.31 110.539 176.081 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 44.0 mm -73.47 -53.96 16.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 120.914 0.388 . . . . 75.24 111.054 178.775 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 70.1 m -163.55 149.94 11.87 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 120.953 0.406 . . . . 70.11 111.691 -178.674 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.721 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 42.4 mt-10 -108.2 119.22 38.85 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 116.181 -0.463 . . . . 74.5 110.511 174.883 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' HIS . . . . . 0.49 ' HB3' ' HB2' ' A' ' 49' ' ' GLU . 37.7 m170 -128.23 151.14 75.8 Favored Pre-proline 0 CA--C 1.543 0.696 0 N-CA-C 112.187 0.439 . . . . 55.33 112.187 -176.608 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.35 -31.89 8.71 Favored 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 122.857 2.371 . . . . 73.54 114.358 -176.669 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.449 ' OG1' ' HG2' ' A' ' 49' ' ' GLU . 43.9 p -115.06 152.05 33.18 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.192 0.52 . . . . 65.05 111.886 -177.266 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.48 -29.94 70.29 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.009 -0.541 . . . . 55.04 110.758 175.722 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 25.0 tp60 -59.09 -51.33 70.52 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.475 -0.33 . . . . 63.2 111.281 175.543 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.49 ' HB2' ' HB3' ' A' ' 44' ' ' HIS . 78.9 mm-40 -62.96 -30.93 71.96 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.086 0.469 . . . . 54.22 111.475 178.591 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.89 -47.93 34.49 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.392 -0.367 . . . . 62.44 111.35 177.634 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 90.1 mmm -64.59 -43.43 93.87 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 112.307 0.484 . . . . 74.32 112.307 -178.708 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.513 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 16.8 t70 -59.31 -51.14 71.24 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.821 0.343 . . . . 73.42 111.11 -179.343 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.39 -36.45 84.01 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.273 0.559 . . . . 64.11 111.296 176.434 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.521 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 43.7 tttp -53.94 -49.96 67.53 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.855 -0.612 . . . . 75.24 111.469 176.824 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -65.71 -27.02 68.03 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.231 0.456 . . . . 74.42 112.231 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.513 ' HG3' ' O ' ' A' ' 52' ' ' ASP . 44.9 mtt180 -72.94 -29.08 62.82 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 120.943 0.402 . . . . 75.04 111.073 177.259 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.449 ' CD2' ' HB2' ' A' ' 11' ' ' ALA . 89.5 t80 -77.35 -37.05 53.11 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.287 0.565 . . . . 75.44 110.849 174.125 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.54 ' HG2' ' HA ' ' A' ' 10' ' ' GLU . 56.6 mt-10 -76.97 -25.45 52.8 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.006 -0.543 . . . . 65.15 111.639 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.1 t70 . . . . . 0 CA--C 1.54 0.571 0 CA-C-O 120.698 0.285 . . . . 62.4 110.345 175.856 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 . . . . . 0 CA--C 1.537 0.46 0 CA-C-O 120.882 0.372 . . . . 61.22 110.518 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -93.31 153.84 18.33 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.914 0.388 . . . . 74.13 110.838 178.788 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 45.2 p90 -141.09 159.34 42.41 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.188 0.518 . . . . 74.54 111.569 -179.29 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 67.2 mt -99.74 138.05 25.33 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-N 115.947 -0.569 . . . . 65.53 111.511 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 59.2 t -119.95 121.16 65.27 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 122.509 0.323 . . . . 75.43 110.766 176.592 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 32.5 p -86.77 112.59 21.84 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.463 0.542 . . . . 45.35 112.463 -178.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.5 pt -113.92 175.87 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-N 116.296 -0.411 . . . . 71.4 110.523 175.027 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -138.53 128.43 25.26 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.125 0.488 . . . . 74.31 111.44 179.778 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -115.67 159.9 20.75 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 116.531 -0.304 . . . . 63.43 111.561 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.56 -153.74 19.29 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 121.294 -0.479 . . . . 63.15 113.845 178.633 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -79.84 155.49 75.46 Favored Pre-proline 0 CA--C 1.54 0.566 0 O-C-N 122.668 -0.313 . . . . 73.44 111.294 -176.289 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -52.97 -37.68 78.66 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 122.487 2.125 . . . . 70.03 113.002 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -84.69 -48.08 5.11 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 121.106 -0.569 . . . . 74.14 112.619 175.928 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -99.46 83.38 2.8 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.224 0.535 . . . . 65.54 111.691 178.654 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 75.2 p -99.64 155.89 17.36 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.769 -0.65 . . . . 74.11 111.457 175.59 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 48.8 t -116.97 128.08 74.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 CA-C-N 116.089 -0.505 . . . . 63.34 110.246 174.572 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 36.1 m -74.44 115.35 13.87 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.762 0.315 . . . . 62.22 111.444 -179.883 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 67.3 m95 -113.53 131.08 56.21 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.086 0.469 . . . . 65.21 111.265 177.517 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -100.76 114.13 27.62 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.109 -0.496 . . . . 74.01 110.813 -179.365 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.457 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 78.0 mt-30 -96.29 120.58 36.85 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.885 0.374 . . . . 75.15 111.637 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 55.9 tp -83.3 107.48 15.86 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 120.737 0.304 . . . . 72.02 110.259 175.196 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 54.4 mtt180 -120.92 166.28 14.03 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.158 0.504 . . . . 72.31 111.787 -178.143 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -139.02 158.57 43.96 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.935 -0.575 . . . . 72.2 111.114 178.179 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -80.8 -21.72 40.67 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 116.521 -0.309 . . . . 71.32 111.686 -179.448 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -112.27 144.3 30.55 Favored Pre-proline 0 CA--C 1.542 0.65 0 N-CA-C 111.573 0.212 . . . . 73.01 111.573 -177.096 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -74.67 -28.47 7.44 Favored 'Cis proline' 0 CA--C 1.542 0.881 0 C-N-CA 123.794 -1.336 . . . . 63.32 112.98 -4.292 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.403 ' HB3' ' HD2' ' A' ' 37' ' ' PRO . 58.1 mttp -131.23 160.28 67.76 Favored Pre-proline 0 CA--C 1.541 0.603 0 C-N-CA 122.426 0.29 . . . . 51.44 110.941 176.028 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.403 ' HD2' ' HB3' ' A' ' 36' ' ' LYS . 28.8 Cg_endo -61.43 -7.03 7.84 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 C-N-CA 122.573 2.182 . . . . 62.43 113.173 177.451 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -77.79 -7.12 56.15 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.554 -0.294 . . . . 72.41 111.422 176.329 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 68.6 m -65.44 92.17 0.13 Allowed 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.523 0.564 . . . . 74.22 112.523 -175.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 48.7 tp -100.06 105.11 16.73 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.067 -0.515 . . . . 74.1 109.974 172.464 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.5 ' N ' HD12 ' A' ' 41' ' ' ILE . 2.3 mp -71.06 -53.87 19.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 CA-C-N 116.383 -0.371 . . . . 61.42 111.397 -175.885 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 71.1 p -169.58 149.8 3.98 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.178 0.513 . . . . 62.12 111.397 -179.712 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.457 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 45.2 mt-10 -100.56 140.66 34.5 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.274 -0.421 . . . . 75.43 110.795 177.843 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 83.0 m-70 -136.74 135.91 20.89 Favored Pre-proline 0 CA--C 1.538 0.516 0 O-C-N 122.219 -0.301 . . . . 72.2 111.183 -178.158 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.0 -5.57 16.47 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 122.594 2.196 . . . . 64.41 113.58 -179.472 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 35.8 p -136.14 155.08 50.7 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-O 120.933 0.397 . . . . 45.21 111.345 177.578 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.55 -41.14 89.13 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.287 -0.415 . . . . 74.22 111.725 178.901 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 20.1 tp60 -56.55 -51.68 67.67 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 111.396 0.147 . . . . 70.44 111.396 177.631 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -61.39 -29.09 69.71 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 120.93 0.395 . . . . 62.42 111.82 179.144 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.54 -47.45 40.76 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 120.889 0.376 . . . . 72.32 111.464 176.05 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 65.6 mtt -65.89 -35.9 81.92 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.008 0.432 . . . . 61.23 111.451 178.727 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -60.52 -49.93 75.58 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.34 0.59 . . . . 64.33 110.37 176.794 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.27 -39.32 94.25 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.803 -0.635 . . . . 60.43 111.758 176.765 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 44.1 tttp -54.76 -48.55 72.49 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.709 0.29 . . . . 72.14 111.76 178.088 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 47.4 mtmt -61.56 -48.75 79.57 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.179 0.514 . . . . 63.44 111.223 177.619 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 45.2 mtp180 -65.5 -26.07 67.75 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.944 -0.571 . . . . 65.2 111.97 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -71.21 -46.95 60.1 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.965 0.412 . . . . 75.14 111.214 176.245 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -81.49 -21.64 38.53 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 112.387 0.514 . . . . 63.25 112.387 -178.408 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 . . . . . 0 CA--C 1.544 0.717 0 CA-C-O 120.768 0.318 . . . . 75.41 111.146 175.154 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 . . . . . 0 N--CA 1.469 0.488 0 CA-C-O 120.886 0.374 . . . . 45.52 110.849 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -131.61 154.66 48.66 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 116.161 -0.472 . . . . 64.05 110.706 178.295 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 13.1 p90 -135.11 146.13 48.54 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.272 0.558 . . . . 72.02 111.932 -177.701 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 62.9 mt -91.06 117.35 34.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 115.81 -0.632 . . . . 61.13 111.359 -177.356 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.54 HG21 ' HD2' ' A' ' 31' ' ' ARG . 61.9 t -105.61 126.63 60.86 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 CA-C-O 120.782 0.325 . . . . 41.11 111.277 -179.203 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 66.4 p -93.53 115.71 28.22 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 120.763 0.316 . . . . 74.45 111.228 178.319 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 42.3 pt -111.69 166.86 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 CA-C-O 121.004 0.431 . . . . 62.34 111.61 -179.304 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -115.34 114.98 25.85 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.257 -0.429 . . . . 64.4 111.787 -177.305 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -108.8 165.12 11.8 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 122.095 -0.378 . . . . 71.53 110.677 174.782 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.3 -137.09 13.06 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 121.024 -0.608 . . . . 55.45 113.652 -179.371 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -102.17 158.54 31.58 Favored Pre-proline 0 N--CA 1.473 0.684 0 N-CA-C 112.032 0.382 . . . . 75.14 112.032 -175.194 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -60.69 124.31 14.76 Favored 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 122.18 1.92 . . . . 71.15 111.714 173.617 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 89.27 -47.8 3.35 Favored Glycine 0 CA--C 1.525 0.692 0 C-N-CA 120.859 -0.686 . . . . 71.44 112.406 -176.158 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -99.08 79.15 2.31 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.347 0.594 . . . . 74.12 110.41 175.351 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 77.6 p -107.84 156.56 19.02 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.684 -0.689 . . . . 60.15 112.371 -175.661 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 63.6 t -113.27 132.31 62.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-N 115.639 -0.709 . . . . 71.44 110.359 175.223 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 95.0 m -79.73 117.28 20.49 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 120.912 0.387 . . . . 72.15 111.833 -179.427 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 76.9 m95 -114.87 131.62 56.79 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 116.377 -0.374 . . . . 74.55 111.163 175.48 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -92.81 114.73 27.36 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.946 0.403 . . . . 75.22 111.131 -178.305 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.64 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 86.0 mt-30 -102.08 130.13 48.58 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.472 -0.331 . . . . 73.11 111.393 177.447 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.8 tp -87.51 104.51 16.54 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.779 0.323 . . . . 65.43 110.441 174.521 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.54 ' HD2' HG21 ' A' ' 14' ' ' VAL . 86.5 mtt180 -111.48 154.72 24.3 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.555 -0.293 . . . . 63.43 110.953 179.079 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.29 140.25 51.49 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 120.574 0.226 . . . . 74.41 111.375 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -62.62 -24.54 67.64 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.157 0.429 . . . . 73.25 112.157 -179.148 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.482 ' HA ' ' C ' ' A' ' 35' ' ' PRO . 83.5 m-70 -122.18 134.22 24.69 Favored Pre-proline 0 CA--C 1.541 0.633 0 O-C-N 122.329 -0.232 . . . . 73.03 111.154 179.654 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.482 ' C ' ' HA ' ' A' ' 34' ' ' HIS . 22.2 Cg_exo -65.42 -42.12 0.66 Allowed 'Cis proline' 0 C--N 1.358 1.037 0 C-N-CA 124.643 -0.982 . . . . 70.14 113.709 3.393 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -137.0 145.85 52.27 Favored Pre-proline 0 N--CA 1.471 0.59 0 O-C-N 122.376 -0.202 . . . . 65.11 110.688 178.062 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -50.84 -22.0 9.28 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 C-N-CA 122.933 2.422 . . . . 73.42 113.914 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -84.23 10.89 9.23 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-O 121.052 0.453 . . . . 40.2 111.677 178.385 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 66.5 m -81.1 100.31 8.97 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.098 0.475 . . . . 55.42 111.109 178.006 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.401 HD13 ' HB3' ' A' ' 29' ' ' GLN . 56.3 tp -87.1 116.52 25.22 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.193 -0.458 . . . . 73.43 111.366 -179.721 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 47.8 mm -76.76 -54.87 12.31 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-O 120.663 0.268 . . . . 74.54 110.835 176.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 64.0 m -165.8 154.1 11.12 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.603 0.361 . . . . 73.32 111.404 179.009 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.64 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 50.8 mt-10 -100.31 150.11 22.92 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.03 0.443 . . . . 72.31 111.448 176.409 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' HIS . . . . . 0.466 ' ND1' ' HB3' ' A' ' 49' ' ' GLU . 89.7 m-70 -147.08 142.2 16.73 Favored Pre-proline 0 CA--C 1.542 0.649 0 CA-C-N 116.454 -0.339 . . . . 65.53 111.215 176.931 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -74.6 -25.09 13.08 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 122.31 2.006 . . . . 72.2 113.243 177.662 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 31.2 p -114.9 151.01 34.74 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-O 121.179 0.514 . . . . 75.41 111.737 -179.311 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.23 -44.25 92.44 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.062 -0.517 . . . . 73.21 112.303 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 24.0 tp60 -53.45 -42.56 67.27 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 111.744 0.275 . . . . 70.52 111.744 -179.086 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.466 ' HB3' ' ND1' ' A' ' 44' ' ' HIS . 47.1 mt-10 -61.31 -43.13 99.39 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.899 0.38 . . . . 73.31 111.342 176.087 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.08 -43.67 97.9 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.059 0.457 . . . . 74.13 111.385 178.416 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 58.6 mtt -63.76 -38.12 89.92 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.336 0.589 . . . . 71.14 110.958 176.152 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.453 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 34.0 t70 -62.95 -51.85 65.31 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.761 -0.654 . . . . 73.52 110.971 177.592 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.16 -42.72 86.56 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 116.091 -0.504 . . . . 71.32 111.443 177.285 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -55.65 -49.79 71.96 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.243 -0.435 . . . . 73.21 111.052 175.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 23.5 mtpp -60.06 -28.97 68.23 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.305 -0.407 . . . . 63.54 112.056 178.418 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.453 ' HG3' ' O ' ' A' ' 52' ' ' ASP . 72.7 mtt180 -73.58 -40.68 63.71 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 122.062 -0.399 . . . . 62.44 110.561 176.439 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -63.5 -33.32 75.33 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.341 0.591 . . . . 73.33 110.523 176.408 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -80.53 -34.37 35.62 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.909 -0.587 . . . . 74.12 111.836 176.127 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 28.3 t70 . . . . . 0 CA--C 1.544 0.717 0 CA-C-O 120.962 0.411 . . . . 65.32 111.177 -176.006 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 . . . . . 0 N--CA 1.468 0.469 0 CA-C-O 120.89 0.376 . . . . 75.5 111.282 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -145.54 155.05 42.83 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.395 -0.366 . . . . 72.12 111.012 176.309 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 40.5 p90 -149.36 161.54 41.87 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.14 0.495 . . . . 75.31 111.628 -178.153 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 65.4 mt -101.89 136.86 31.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-O 121.077 0.465 . . . . 74.13 112.106 -177.935 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.439 HG21 ' HD2' ' A' ' 31' ' ' ARG . 98.4 t -119.07 126.38 75.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 116.353 -0.385 . . . . 72.32 110.802 176.391 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 46.8 p -86.64 114.42 23.33 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.587 0.232 . . . . 74.13 111.615 -179.137 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.513 HD13 ' NE2' ' A' ' 29' ' ' GLN . 37.8 pt -112.83 168.91 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 CA-C-O 121.19 0.519 . . . . 75.34 111.872 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -114.59 124.84 52.87 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.756 -0.656 . . . . 54.13 111.416 -179.674 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -119.25 159.61 23.75 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.764 0.316 . . . . 73.4 110.932 172.19 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.26 -146.21 17.6 Favored Glycine 0 CA--C 1.528 0.868 0 C-N-CA 121.314 -0.469 . . . . 65.52 113.401 -179.44 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -95.22 148.96 35.5 Favored Pre-proline 0 N--CA 1.471 0.606 0 N-CA-C 112.088 0.403 . . . . 73.34 112.088 -175.769 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -56.49 124.35 16.04 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.201 1.934 . . . . 65.12 112.065 176.225 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 95.17 -52.79 1.86 Allowed Glycine 0 CA--C 1.527 0.786 0 C-N-CA 121.133 -0.556 . . . . 73.25 112.384 -174.922 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 31.4 mm-40 -99.8 64.8 1.28 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.148 0.499 . . . . 64.31 110.882 176.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 59.9 p -92.05 167.63 11.95 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.376 0.608 . . . . 73.32 112.43 -175.79 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 60.8 t -124.34 124.7 69.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 CA-C-N 115.707 -0.679 . . . . 74.44 109.95 175.437 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 94.4 m -77.46 114.86 16.73 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.123 0.487 . . . . 43.03 112.015 -177.845 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 72.6 m95 -110.58 140.47 44.87 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.926 -0.579 . . . . 74.11 110.784 175.336 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -97.74 113.76 25.6 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 120.884 0.373 . . . . 74.0 111.298 -177.387 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.661 ' HG2' ' HG3' ' A' ' 43' ' ' GLU . 79.4 mt-30 -91.5 125.85 36.39 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.815 0.341 . . . . 71.3 111.362 177.726 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 60.4 tp -83.25 116.92 22.62 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.664 0.268 . . . . 74.11 110.495 173.536 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.439 ' HD2' HG21 ' A' ' 14' ' ' VAL . 99.0 mtt180 -126.94 164.7 20.88 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 120.926 0.393 . . . . 73.31 111.217 178.214 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -139.82 140.15 36.53 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.504 -0.316 . . . . 71.11 111.094 176.738 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.468 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 29.0 t70 -61.05 -38.61 86.78 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.313 0.578 . . . . 42.45 110.869 177.337 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 -105.96 130.54 22.84 Favored Pre-proline 0 CA--C 1.541 0.611 0 CA-C-N 116.105 -0.498 . . . . 72.02 110.392 177.09 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -77.45 -34.49 3.27 Favored 'Cis proline' 0 CA--C 1.545 1.033 0 C-N-CA 123.885 -1.298 . . . . 72.52 114.156 3.505 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -130.76 130.96 22.99 Favored Pre-proline 0 N--CA 1.474 0.766 0 O-C-N 122.393 -0.192 . . . . 73.51 110.943 -178.54 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.468 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 91.2 Cg_exo -45.47 -51.34 8.1 Favored 'Trans proline' 0 CA--C 1.542 0.916 0 C-N-CA 123.419 2.746 . . . . 41.01 114.49 -174.814 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -79.34 24.67 0.34 Allowed 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 112.703 0.631 . . . . 64.3 112.703 -177.35 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 45.2 p -66.6 89.77 0.15 Allowed 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.161 0.505 . . . . 74.53 111.413 177.661 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 38.2 tp -72.7 104.1 3.83 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 120.887 0.375 . . . . 64.21 111.476 178.087 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.3 mm -74.88 -54.1 15.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 116.272 -0.422 . . . . 73.32 110.754 175.429 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 29.3 t -175.76 149.87 0.99 Allowed 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 116.351 -0.386 . . . . 53.13 111.904 -178.944 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.661 ' HG3' ' HG2' ' A' ' 29' ' ' GLN . 1.9 mp0 -89.39 125.99 35.37 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 116.534 -0.303 . . . . 70.01 110.381 173.525 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 11.9 m170 -116.52 146.93 38.61 Favored Pre-proline 0 CA--C 1.542 0.638 0 C-N-CA 122.574 0.349 . . . . 61.02 111.008 179.519 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -67.0 -40.37 11.94 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.827 2.352 . . . . 75.24 114.173 -173.797 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.517 ' OG1' ' HB2' ' A' ' 49' ' ' GLU . 29.9 p -120.37 153.51 36.4 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 122.064 -0.398 . . . . 61.15 111.243 -179.435 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.21 -41.71 79.95 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 120.896 0.379 . . . . 74.31 111.251 178.02 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -61.27 -43.75 98.37 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 116.288 -0.415 . . . . 74.02 110.752 176.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.517 ' HB2' ' OG1' ' A' ' 46' ' ' THR . 0.6 OUTLIER -61.44 -33.1 73.16 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.343 0.592 . . . . 53.4 110.727 178.524 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.96 -42.76 56.99 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 116.212 -0.449 . . . . 71.23 111.371 176.436 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.557 ' SD ' ' HD3' ' A' ' 54' ' ' LYS . 22.2 mmt -57.29 -35.74 70.18 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 116.313 -0.403 . . . . 63.22 111.753 176.968 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -54.47 -43.83 72.06 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 116.133 -0.485 . . . . 75.32 111.088 177.765 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.08 -40.08 53.94 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.158 0.504 . . . . 50.44 111.408 175.802 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.557 ' HD3' ' SD ' ' A' ' 51' ' ' MET . 42.3 tttp -53.89 -49.76 67.84 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 115.872 -0.603 . . . . 75.53 112.004 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 60.6 mttp -53.7 -57.97 8.9 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 111.844 0.312 . . . . 64.52 111.844 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 53.0 mtp180 -62.24 -26.4 68.36 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 112.003 0.371 . . . . 63.3 112.003 -178.33 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -71.45 -34.47 70.28 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.002 0.43 . . . . 75.41 110.936 176.847 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.44 ' HG3' ' O ' ' A' ' 54' ' ' LYS . 44.1 mt-10 -86.25 -20.19 28.83 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.086 -0.507 . . . . 70.21 111.48 179.549 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 . . . . . 0 CA--C 1.543 0.68 0 CA-C-N 116.398 -0.365 . . . . 73.02 110.855 172.793 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.47 ' HA ' ' HG2' ' A' ' 58' ' ' GLU . 42.1 tt0 . . . . . 0 CA--C 1.539 0.542 0 CA-C-O 120.975 0.417 . . . . 73.03 111.698 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.434 ' O ' ' NZ ' ' A' ' 54' ' ' LYS . . . -124.89 175.06 7.54 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.049 -0.523 . . . . 72.13 110.96 177.415 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 41.2 p90 -148.47 153.09 38.0 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.098 0.475 . . . . 74.24 111.693 177.162 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 63.5 mt -101.66 135.51 37.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 116.107 -0.497 . . . . 74.33 111.557 -176.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.404 HG21 ' HD2' ' A' ' 31' ' ' ARG . 61.6 t -119.28 138.71 49.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-N 116.585 -0.28 . . . . 74.13 111.23 178.981 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 80.3 p -101.24 117.33 34.77 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 120.522 0.201 . . . . 73.24 111.506 178.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.499 HD13 ' NE2' ' A' ' 29' ' ' GLN . 42.8 pt -120.11 168.47 12.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-O 120.871 0.367 . . . . 72.53 111.614 178.573 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.408 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 47.4 mt-10 -116.12 126.87 54.3 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 116.357 -0.383 . . . . 62.12 111.193 177.233 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.425 ' HE3' HD12 ' A' ' 16' ' ' ILE . 95.1 mttt -130.4 166.63 20.06 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.781 0.325 . . . . 74.54 111.329 176.039 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.08 -136.88 12.94 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 121.186 -0.531 . . . . 53.45 113.164 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.422 ' HB2' ' HB2' ' A' ' 23' ' ' GLN . 75.5 mmtt -75.27 147.01 82.39 Favored Pre-proline 0 CA--C 1.539 0.52 0 O-C-N 122.437 -0.449 . . . . 74.21 111.332 179.093 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_exo -53.06 -46.89 30.73 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 122.781 2.32 . . . . 74.03 113.076 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -84.33 -52.91 3.42 Favored Glycine 0 CA--C 1.526 0.745 0 C-N-CA 121.118 -0.563 . . . . 73.24 112.825 175.246 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.422 ' HB2' ' HB2' ' A' ' 20' ' ' LYS . 32.9 mm-40 -83.81 77.27 9.92 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.119 0.485 . . . . 62.21 111.032 177.131 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.408 ' HB ' ' HB3' ' A' ' 17' ' ' GLU . 53.0 p -88.4 152.12 22.12 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.182 0.515 . . . . 65.43 111.745 179.839 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 58.0 t -114.84 129.4 71.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.033 -0.531 . . . . 62.32 109.976 174.272 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 31.2 m -75.36 115.58 15.17 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 120.697 0.284 . . . . 72.54 111.498 -179.298 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 77.9 m95 -106.58 132.3 52.74 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.053 0.454 . . . . 64.42 110.877 175.501 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -97.17 114.5 26.21 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.298 0.57 . . . . 64.01 111.138 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.735 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 95.5 mt-30 -97.46 122.29 40.33 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.678 -0.692 . . . . 73.03 111.723 -178.698 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.9 tp -83.24 109.87 17.59 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 120.788 0.328 . . . . 71.42 110.299 171.952 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.404 ' HD2' HG21 ' A' ' 14' ' ' VAL . 87.5 mtt-85 -121.41 158.63 27.9 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.053 0.454 . . . . 71.3 111.728 -178.635 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -146.01 146.49 31.01 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.241 -0.436 . . . . 73.21 111.211 178.259 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.495 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 3.9 m-20 -62.67 -22.6 66.59 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.058 0.456 . . . . 72.05 111.847 177.801 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.555 ' HA ' ' C ' ' A' ' 35' ' ' PRO . 35.3 m80 -125.82 141.39 39.18 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-N 116.365 -0.379 . . . . 75.55 110.52 179.064 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.555 ' C ' ' HA ' ' A' ' 34' ' ' HIS . 31.7 Cg_exo -59.93 -56.62 0.13 OUTLIER 'Cis proline' 0 N--CA 1.49 1.293 0 CA-C-N 119.662 0.915 . . . . 64.53 114.368 4.135 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -109.68 147.4 36.05 Favored Pre-proline 0 N--CA 1.471 0.576 0 O-C-N 122.231 -0.293 . . . . 73.43 111.229 179.011 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.495 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 75.9 Cg_exo -50.6 -31.13 30.62 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 122.948 2.432 . . . . 74.15 113.809 -179.344 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -98.74 20.87 12.25 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 120.839 0.352 . . . . 73.23 111.682 -179.61 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.4 t -72.42 107.4 4.97 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.019 0.437 . . . . 62.43 111.665 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 36.1 tp -92.48 109.82 21.22 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 116.114 -0.493 . . . . 64.52 111.027 177.051 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.8 mm -73.71 -54.61 14.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 116.115 -0.493 . . . . 74.23 111.747 -177.045 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.0 t -164.13 149.46 10.52 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 112.3 0.482 . . . . 71.12 112.3 -176.86 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.735 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 88.3 mt-10 -108.93 139.34 43.92 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.277 -0.419 . . . . 71.43 110.856 175.915 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 89.6 m-70 -138.77 140.32 26.97 Favored Pre-proline 0 CA--C 1.538 0.503 0 O-C-N 122.3 -0.25 . . . . 75.24 111.531 178.93 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -71.86 -24.13 21.47 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 122.458 2.105 . . . . 52.42 113.517 -179.267 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 30.4 p -113.07 143.7 43.89 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 121.085 0.469 . . . . 64.12 111.713 179.504 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.95 -34.69 73.6 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.053 -0.521 . . . . 73.4 111.9 177.005 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -56.5 -48.96 76.07 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 120.577 0.227 . . . . 72.31 110.894 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -58.66 -42.5 88.56 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.092 0.472 . . . . 63.13 111.199 177.424 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.71 -41.25 98.13 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.939 -0.573 . . . . 71.03 111.726 -179.781 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 67.1 mtt -65.06 -49.31 70.6 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 120.934 0.397 . . . . 55.52 111.004 177.379 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.547 ' HA ' ' HE2' ' A' ' 55' ' ' LYS . 11.2 m-20 -57.67 -41.29 81.24 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 121.056 0.455 . . . . 73.05 111.767 176.161 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.79 -43.42 93.26 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.953 0.406 . . . . 71.41 111.026 177.339 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.434 ' NZ ' ' O ' ' A' ' 11' ' ' ALA . 59.5 tttp -60.48 -52.43 65.23 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 116.316 -0.402 . . . . 62.14 111.781 178.673 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.547 ' HE2' ' HA ' ' A' ' 52' ' ' ASP . 63.7 pttt -64.81 -33.92 77.14 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 120.938 0.399 . . . . 75.13 111.567 -179.147 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 51.6 ttt180 -77.89 -26.29 49.08 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.948 0.404 . . . . 65.13 111.001 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -72.27 -43.26 64.55 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.05 0.452 . . . . 75.2 110.855 175.558 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.47 ' HG2' ' HA ' ' A' ' 10' ' ' GLU . 81.0 mt-10 -75.6 -33.64 60.56 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.935 -0.575 . . . . 73.4 111.849 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.5 m-20 . . . . . 0 CA--C 1.544 0.739 0 CA-C-O 120.859 0.362 . . . . 71.32 111.162 175.729 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 . . . . . 0 N--CA 1.474 0.739 0 CA-C-O 120.674 0.273 . . . . 71.13 111.318 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.489 ' O ' ' HE2' ' A' ' 54' ' ' LYS . . . -140.95 162.31 35.77 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 120.87 0.367 . . . . 61.13 111.889 -179.337 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -151.63 149.63 29.35 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.097 0.475 . . . . 63.15 111.63 178.757 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 60.2 mt -101.56 134.49 41.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-N 116.35 -0.386 . . . . 73.42 111.895 -176.299 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.4 t -129.18 122.85 57.12 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 116.289 -0.414 . . . . 64.25 110.49 176.062 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 45.9 p -86.91 129.45 34.88 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 120.817 0.341 . . . . 74.1 111.579 -178.723 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.51 HD13 ' NE2' ' A' ' 29' ' ' GLN . 43.3 pt -113.33 175.07 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-O 120.955 0.407 . . . . 72.15 111.423 178.039 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.453 ' HB2' ' HB ' ' A' ' 24' ' ' THR . 9.4 pt-20 -118.16 129.83 55.74 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 121.231 0.538 . . . . 71.11 111.754 178.905 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -124.97 178.51 5.47 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 116.384 -0.371 . . . . 53.3 110.933 175.198 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 84.29 -136.79 15.11 Favored Glycine 0 CA--C 1.526 0.733 0 C-N-CA 120.927 -0.654 . . . . 74.52 114.414 172.984 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -74.63 150.0 86.38 Favored Pre-proline 0 CA--C 1.542 0.635 0 N-CA-C 112.053 0.39 . . . . 60.35 112.053 -173.409 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -58.68 -38.07 91.06 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 122.701 2.267 . . . . 53.41 112.957 179.087 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -92.3 -52.14 2.25 Favored Glycine 0 CA--C 1.524 0.642 0 C-N-CA 121.173 -0.537 . . . . 71.01 112.492 177.57 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -93.35 80.87 4.41 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.493 0.663 . . . . 73.35 110.818 177.722 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.453 ' HB ' ' HB2' ' A' ' 17' ' ' GLU . 71.7 p -80.75 151.17 28.96 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.457 -0.792 . . . . 61.2 111.816 179.602 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 53.7 t -108.54 136.46 44.15 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 CA-C-N 116.176 -0.466 . . . . 72.33 110.852 -179.363 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 67.6 m -85.28 120.07 26.35 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.068 0.461 . . . . 71.12 112.125 -175.468 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 61.6 m95 -119.66 131.62 55.48 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.047 0.451 . . . . 70.41 111.28 175.286 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -91.57 114.71 27.31 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 116.358 -0.383 . . . . 62.3 111.187 -178.383 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.55 ' HG2' ' HG3' ' A' ' 43' ' ' GLU . 72.4 mt-30 -95.82 120.31 35.86 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.562 -0.29 . . . . 73.41 111.571 177.687 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 55.2 tp -85.67 103.47 14.51 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.872 0.368 . . . . 51.34 110.426 173.324 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 55.4 mtt180 -106.5 141.85 37.12 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.464 -0.334 . . . . 71.23 110.325 178.169 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.415 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . . . -109.6 167.9 9.8 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.808 0.67 . . . . 74.45 112.808 -173.275 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -77.36 -54.48 6.41 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 115.631 -0.713 . . . . 71.13 111.98 -176.762 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.537 ' HB3' ' HA ' ' A' ' 35' ' ' PRO . 60.0 m-70 -123.43 164.05 30.59 Favored Pre-proline 0 CA--C 1.547 0.83 0 C-N-CA 122.597 0.359 . . . . 63.41 110.929 178.694 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.537 ' HA ' ' HB3' ' A' ' 34' ' ' HIS . 36.8 Cg_endo -64.76 -50.16 0.17 OUTLIER 'Cis proline' 0 C--N 1.362 1.278 0 C-N-CA 124.825 -0.906 . . . . 61.3 113.572 1.158 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -98.6 149.05 35.36 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 122.169 0.188 . . . . 75.03 110.548 173.838 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -67.87 -14.9 42.76 Favored 'Trans proline' 0 CA--C 1.537 0.64 0 C-N-CA 122.212 1.942 . . . . 73.03 112.502 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -88.61 1.05 55.72 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.98 -0.555 . . . . 71.15 111.874 -179.759 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 64.0 m -56.78 92.52 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 112.259 0.466 . . . . 72.23 112.259 -175.898 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 49.6 tp -83.88 107.23 16.14 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 116.265 -0.425 . . . . 72.52 110.508 176.693 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 45.0 mm -69.44 -53.7 23.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 116.312 -0.404 . . . . 64.13 111.641 -177.884 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.9 t -175.24 149.64 1.08 Allowed 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 121.038 0.447 . . . . 63.41 112.01 -179.555 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.55 ' HG3' ' HG2' ' A' ' 29' ' ' GLN . 2.2 mp0 -100.42 130.81 46.55 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 116.044 -0.525 . . . . 75.04 110.595 176.963 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -134.95 147.04 61.13 Favored Pre-proline 0 N--CA 1.473 0.69 0 CA-C-O 120.839 0.352 . . . . 62.14 111.584 -179.047 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.84 -18.59 19.04 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 122.825 2.35 . . . . 60.1 114.146 -174.993 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 30.6 p -116.88 151.67 36.1 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.093 0.473 . . . . 71.32 111.399 179.522 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.34 -36.46 74.24 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.302 -0.408 . . . . 74.2 111.824 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 24.6 tp60 -56.8 -42.02 78.79 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.529 -0.305 . . . . 61.02 111.767 -177.833 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -59.23 -51.07 71.55 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 121.094 0.473 . . . . 64.23 111.35 176.414 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.07 -37.74 88.52 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.982 -0.553 . . . . 73.32 111.689 -178.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 95.1 mmm -68.28 -44.83 74.68 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 116.511 -0.313 . . . . 62.44 111.642 178.441 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -61.74 -48.58 80.05 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.05 0.452 . . . . 55.15 110.701 178.022 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.37 -33.84 76.42 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 116.029 -0.532 . . . . 64.02 111.452 177.073 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.489 ' HE2' ' O ' ' A' ' 11' ' ' ALA . 65.7 tttm -61.82 -57.34 12.22 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.91 0.386 . . . . 73.22 110.503 175.793 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -55.77 -44.65 77.88 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.205 -0.452 . . . . 70.22 111.297 178.528 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -61.11 -44.49 97.27 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.092 -0.504 . . . . 74.21 111.526 178.333 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 80.5 t80 -67.04 -38.9 86.67 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 116.373 -0.376 . . . . 75.12 111.375 179.832 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.464 ' HG3' ' O ' ' A' ' 54' ' ' LYS . 56.5 mt-10 -72.31 -5.41 35.95 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.371 0.508 . . . . 72.31 112.371 -176.987 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 68.4 m-20 . . . . . 0 CA--C 1.544 0.733 0 O-C-N 122.375 -0.203 . . . . 54.32 110.891 169.213 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 . . . . . 0 N--CA 1.469 0.505 0 CA-C-O 120.574 0.226 . . . . 74.14 110.439 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.465 ' HB2' ' CD2' ' A' ' 57' ' ' TYR . . . -117.96 167.03 11.81 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.626 0.602 . . . . 72.31 112.626 -174.808 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 28.5 p90 -147.88 150.47 34.17 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.533 -0.758 . . . . 63.53 110.883 178.872 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 55.1 mt -102.2 123.76 55.66 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-O 120.951 0.405 . . . . 73.15 111.339 -178.264 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.9 t -106.27 124.71 61.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-N 116.457 -0.338 . . . . 52.53 111.291 179.775 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 71.0 p -89.87 113.56 25.18 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.895 0.378 . . . . 54.02 111.285 178.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.447 HD12 ' HE3' ' A' ' 18' ' ' LYS . 30.0 pt -112.95 161.62 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-O 120.66 0.267 . . . . 62.23 111.337 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -124.14 130.07 51.92 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.165 0.507 . . . . 65.24 111.264 176.174 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.447 ' HE3' HD12 ' A' ' 16' ' ' ILE . 97.1 mttt -128.53 175.32 8.63 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 120.997 0.427 . . . . 72.34 111.131 177.898 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 90.52 -137.93 14.18 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 121.136 -0.554 . . . . 64.42 113.544 178.141 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -85.86 139.62 35.13 Favored Pre-proline 0 CA--C 1.541 0.599 0 C-N-CA 122.335 0.254 . . . . 75.03 111.503 -176.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -51.01 -45.33 37.12 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 C-N-CA 122.533 2.155 . . . . 73.4 112.833 178.008 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.03 -58.1 6.46 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 120.8 -0.714 . . . . 24.41 112.158 175.057 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -98.98 82.92 2.82 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 121.033 0.444 . . . . 72.41 110.702 179.078 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 46.0 p -86.12 150.22 24.57 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 116.003 -0.544 . . . . 70.41 112.202 179.154 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 47.2 t -111.79 116.33 52.25 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 115.965 -0.561 . . . . 71.12 110.458 174.779 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 94.5 m -81.75 117.95 22.47 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 111.888 0.329 . . . . 71.33 111.888 -178.87 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -110.92 131.63 54.89 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 120.88 0.371 . . . . 74.21 111.351 178.114 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -90.68 114.35 26.64 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.833 0.349 . . . . 72.34 110.907 177.939 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.404 ' HB3' HD13 ' A' ' 40' ' ' LEU . 80.5 mt-30 -103.92 120.51 41.17 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.304 -0.407 . . . . 75.04 111.588 -179.17 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.7 tp -83.32 110.97 18.56 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 120.62 0.248 . . . . 73.44 110.816 174.853 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 31' ' ' ARG . 60.3 mtt180 -123.29 166.44 15.27 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.805 0.336 . . . . 71.31 110.798 177.938 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.411 ' O ' ' HA ' ' A' ' 37' ' ' PRO . . . -137.79 171.99 13.62 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.529 -0.305 . . . . 73.25 111.096 178.839 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -90.2 -14.64 33.04 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.308 0.575 . . . . 71.42 110.594 175.282 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.409 ' HA ' ' C ' ' A' ' 35' ' ' PRO . 92.2 m-70 -122.03 130.98 24.5 Favored Pre-proline 0 CA--C 1.546 0.795 0 CA-C-N 116.005 -0.543 . . . . 73.22 110.261 173.923 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.409 ' C ' ' HA ' ' A' ' 34' ' ' HIS . 24.7 Cg_exo -64.85 -44.71 0.38 Allowed 'Cis proline' 0 C--N 1.357 0.992 0 C-N-CA 124.479 -1.05 . . . . 64.33 113.9 0.539 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -137.58 153.64 74.41 Favored Pre-proline 0 N--CA 1.474 0.754 0 C-N-CA 122.04 0.136 . . . . 74.14 111.058 179.144 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.411 ' HA ' ' O ' ' A' ' 32' ' ' ALA . 88.7 Cg_exo -50.49 -27.28 18.42 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 122.75 2.3 . . . . 75.1 113.372 175.405 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -74.67 -23.82 58.7 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 116.131 -0.486 . . . . 54.04 112.014 178.853 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 53.0 m -57.52 105.86 0.28 Allowed 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.146 0.498 . . . . 74.3 112.288 -175.961 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.404 HD13 ' HB3' ' A' ' 29' ' ' GLN . 49.7 tp -95.3 124.91 39.58 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 115.86 -0.609 . . . . 62.51 111.229 178.845 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.1 mm -86.01 -50.88 13.93 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 CA-C-O 120.981 0.419 . . . . 73.41 111.784 -179.625 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 29.1 t -168.77 149.02 4.43 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 120.991 0.424 . . . . 64.12 112.09 -178.556 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -106.91 140.22 40.08 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.216 -0.447 . . . . 73.41 110.334 174.384 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' HIS . . . . . 0.419 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 85.4 m-70 -139.81 151.26 65.33 Favored Pre-proline 0 N--CA 1.471 0.597 0 CA-C-O 120.795 0.331 . . . . 53.22 111.784 179.005 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 44' ' ' HIS . 9.9 Cg_exo -69.77 -37.22 9.45 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 122.853 2.369 . . . . 72.11 112.798 177.757 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 41.9 p -105.35 148.62 26.87 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 121.104 0.478 . . . . 74.54 111.718 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.444 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -65.79 -31.31 72.21 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.304 -0.407 . . . . 73.44 111.195 176.002 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 25.7 tp60 -57.16 -49.19 76.74 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 116.485 -0.325 . . . . 73.52 111.571 179.838 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -58.78 -43.55 90.44 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.34 0.591 . . . . 73.22 110.982 175.988 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.89 -35.21 79.27 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.767 -0.651 . . . . 50.34 111.497 177.982 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' MET . . . . . 0.497 ' O ' ' HG3' ' A' ' 55' ' ' LYS . 68.4 mtt -68.2 -42.61 79.61 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.477 -0.329 . . . . 44.04 111.226 176.458 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -56.99 -49.27 76.28 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.274 0.559 . . . . 70.33 110.507 176.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.02 -36.81 85.21 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 115.943 -0.572 . . . . 65.15 111.54 176.674 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.7 tttm -61.96 -42.88 99.62 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.078 0.466 . . . . 74.11 110.606 176.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.497 ' HG3' ' O ' ' A' ' 51' ' ' MET . 95.7 mttt -56.67 -55.1 38.3 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.426 0.632 . . . . 71.43 109.929 171.729 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 30.1 ttm-85 -60.23 -25.71 65.85 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 115.151 -0.931 . . . . 64.44 112.544 -174.197 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.465 ' CD2' ' HB2' ' A' ' 11' ' ' ALA . 90.1 t80 -76.68 -54.42 6.68 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 120.777 0.323 . . . . 61.14 111.505 176.454 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -74.59 -49.82 20.25 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.674 0.273 . . . . 65.43 111.246 -179.11 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 . . . . . 0 CA--C 1.537 0.47 0 N-CA-C 109.227 -0.657 . . . . 73.42 109.227 168.035 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.6 ptt? . . . . . 0 N--CA 1.488 1.469 0 N-CA-C 112.277 0.473 . . . . 70.35 112.277 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -92.47 150.25 2.94 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.051 2.5 . . . . 75.14 111.863 170.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.9 t -141.71 130.52 22.95 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.141 0.496 . . . . 71.31 111.91 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -114.67 109.83 47.5 Favored Pre-proline 0 CA--C 1.538 0.505 0 CA-C-N 116.018 -0.537 . . . . 61.4 110.661 176.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -71.72 161.45 45.13 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 122.574 2.183 . . . . 75.0 112.847 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.77 -23.75 73.19 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 122.594 2.196 . . . . 71.33 112.517 177.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -123.15 87.88 51.21 Favored Pre-proline 0 CA--C 1.54 0.591 0 CA-C-N 116.175 -0.466 . . . . 73.32 110.643 175.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -64.86 160.57 40.36 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 122.977 2.451 . . . . 60.35 113.914 -177.261 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.495 ' NH2' ' HB3' ' A' ' 62' ' ' LYS . 15.2 ptm180 -80.73 88.17 5.8 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.639 0.733 . . . . 75.35 110.956 179.544 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -124.42 138.89 54.32 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.897 -0.592 . . . . 65.21 111.798 -177.411 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -129.05 175.81 8.39 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 116.138 -0.483 . . . . 32.54 111.655 179.501 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 41.1 p90 -153.52 179.78 8.49 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 121.095 0.474 . . . . 71.5 111.336 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 58.1 mt -117.96 146.05 23.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-N 116.48 -0.327 . . . . 73.35 111.497 -177.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 57.4 t -128.09 121.1 55.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 122.546 0.338 . . . . 71.14 110.947 176.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 77.2 p -87.93 115.32 25.31 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 111.85 0.315 . . . . 72.23 111.85 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.446 HD11 ' HE3' ' A' ' 18' ' ' LYS . 37.4 pt -121.07 175.59 4.67 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-O 121.204 0.526 . . . . 73.04 111.772 -179.43 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.434 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 45.4 mt-10 -125.21 141.55 52.03 Favored 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 116.05 -0.523 . . . . 74.14 110.801 176.369 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.446 ' HE3' HD11 ' A' ' 16' ' ' ILE . 93.7 mttt -131.81 175.85 8.85 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.035 0.445 . . . . 74.55 111.724 178.73 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.27 -136.72 12.85 Favored Glycine 0 CA--C 1.525 0.687 0 C-N-CA 121.086 -0.578 . . . . 65.33 113.455 176.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -87.71 146.87 40.08 Favored Pre-proline 0 CA--C 1.538 0.485 0 C-N-CA 122.424 0.29 . . . . 75.41 111.54 -176.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -53.09 -31.51 54.66 Favored 'Trans proline' 0 C--N 1.354 0.859 0 C-N-CA 122.927 2.418 . . . . 51.42 113.088 -178.383 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -96.41 -42.64 3.39 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 121.14 -0.552 . . . . 42.44 112.709 175.11 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 81.4 mm-40 -99.69 85.24 3.07 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.144 0.497 . . . . 72.43 111.234 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.434 ' HB ' ' HB3' ' A' ' 17' ' ' GLU . 75.1 p -91.95 152.77 19.87 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 121.178 0.513 . . . . 74.3 112.349 -179.65 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 61.9 t -121.16 145.67 27.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 CA-C-N 115.902 -0.59 . . . . 60.31 110.505 176.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 41.7 m -78.5 127.97 32.9 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.256 0.465 . . . . 45.32 112.256 -176.435 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 44.4 m95 -132.13 151.21 51.9 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.235 0.54 . . . . 72.25 111.916 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -118.8 119.12 33.44 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.976 -0.557 . . . . 61.44 111.498 -179.18 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -100.58 129.84 46.57 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 120.967 0.413 . . . . 72.24 111.689 177.36 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 65.4 tp -88.77 111.72 22.33 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.398 -0.365 . . . . 54.53 110.592 174.269 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 31' ' ' ARG . 71.7 mtt-85 -127.24 153.87 45.57 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.707 0.289 . . . . 74.5 110.595 178.706 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -134.14 145.18 49.04 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.809 0.3 . . . . 72.43 111.809 -176.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -62.64 -17.35 60.25 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 121.44 0.638 . . . . 62.13 111.156 176.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 45.5 m-70 -120.29 128.81 25.64 Favored Pre-proline 0 CA--C 1.542 0.652 0 CA-C-N 115.736 -0.666 . . . . 70.23 110.777 -176.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -80.11 -17.6 26.39 Favored 'Cis proline' 0 CA--C 1.541 0.851 0 C-N-CA 123.815 -1.327 . . . . 74.42 113.276 0.144 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -143.35 143.34 23.85 Favored Pre-proline 0 N--CA 1.471 0.583 0 C-N-CA 122.439 0.296 . . . . 71.14 110.822 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -70.37 -8.61 24.02 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 122.513 2.142 . . . . 74.11 112.981 -174.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -97.1 -0.97 46.18 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 120.911 0.386 . . . . 75.41 111.229 175.414 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.6 t -72.64 103.87 3.72 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.103 0.477 . . . . 72.33 111.667 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 58.4 tp -82.99 122.62 28.54 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.989 -0.55 . . . . 74.14 110.295 176.463 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.4 mm -88.42 -54.16 8.36 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-O 120.987 0.423 . . . . 72.04 111.393 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 44.2 t -159.48 156.69 28.71 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 116.376 -0.375 . . . . 64.32 111.404 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -119.29 139.31 52.13 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.855 0.359 . . . . 65.42 111.036 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -143.32 143.07 22.88 Favored Pre-proline 0 N--CA 1.472 0.642 0 CA-C-N 116.643 -0.253 . . . . 75.52 111.377 -179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -75.35 -15.1 20.17 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 122.436 2.091 . . . . 70.14 113.355 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 44.6 p -116.91 148.69 41.12 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 121.118 0.485 . . . . 71.0 111.992 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.29 -42.71 99.11 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.075 -0.511 . . . . 51.22 112.165 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.2 tp60 -56.86 -46.42 81.8 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 111.89 0.33 . . . . 52.41 111.89 -178.067 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -59.75 -34.22 72.68 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 120.839 0.352 . . . . 75.43 111.462 177.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.97 -43.98 73.87 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 120.969 0.414 . . . . 73.15 111.458 178.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 66.2 mtt -65.33 -42.76 92.61 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.256 0.55 . . . . 72.32 111.311 177.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.423 ' O ' ' HD2' ' A' ' 56' ' ' ARG . 12.8 t70 -63.64 -47.99 79.09 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.919 -0.582 . . . . 73.1 110.563 178.408 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.57 -39.35 80.03 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.314 -0.403 . . . . 64.1 111.29 176.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 49.5 tttp -55.11 -44.32 74.87 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.326 -0.397 . . . . 72.13 110.718 174.361 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -63.1 -41.7 99.44 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 122.327 -0.233 . . . . 72.0 111.605 175.131 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.462 ' HA ' ' HE ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -56.27 -32.78 64.85 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 122.194 -0.317 . . . . 73.1 111.809 176.811 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -77.75 -37.59 48.84 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 111.878 0.325 . . . . 63.4 111.878 177.627 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -92.27 -22.8 19.56 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.084 0.772 . . . . 72.32 113.084 -172.483 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -76.05 155.07 84.68 Favored Pre-proline 0 CA--C 1.543 0.681 0 CA-C-O 120.935 0.398 . . . . 73.12 111.4 179.037 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -62.75 -6.51 9.25 Favored 'Trans proline' 0 C--N 1.354 0.847 0 C-N-CA 122.737 2.292 . . . . 54.4 113.507 -178.004 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -66.87 -36.9 83.36 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 120.7 0.286 . . . . 73.11 111.23 177.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.495 ' HB3' ' NH2' ' A' ' 9' ' ' ARG . 58.2 tptt -78.16 98.41 5.82 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.164 0.507 . . . . 62.31 109.862 173.268 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -75.68 168.94 19.07 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.662 -0.699 . . . . 72.3 112.336 -177.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 7.3 mp -63.1 103.55 0.48 Allowed 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 121.038 0.447 . . . . 70.14 110.765 178.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -96.14 16.72 17.33 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 121.283 0.563 . . . . 73.31 112.102 -173.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 78.4 m-70 -74.92 119.48 19.16 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.989 -0.444 . . . . 74.12 109.887 174.184 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 56.7 m80 -58.41 120.93 9.65 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.476 0.655 . . . . 74.24 112.574 -175.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 16.4 t-80 -53.25 114.34 1.44 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 114.956 -1.02 . . . . 73.5 112.572 -176.326 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 66.5 t60 53.86 35.06 20.73 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 116.066 -0.515 . . . . 70.13 112.05 176.101 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 72.6 m80 65.97 32.47 8.44 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.006 0.431 . . . . 71.13 112.15 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 76.6 t60 . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.635 -0.697 . . . . 61.13 111.146 175.58 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.4 mmm . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 120.709 0.29 . . . . 74.32 111.102 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -77.2 -9.19 17.73 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.715 2.276 . . . . 75.04 113.321 -178.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.441 HG22 ' O ' ' A' ' 3' ' ' THR . 9.0 m 66.35 23.19 10.72 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 121.502 0.667 . . . . 54.4 110.995 178.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 53.5 tttp -140.35 94.62 8.49 Favored Pre-proline 0 CA--C 1.542 0.664 0 CA-C-N 116.373 -0.376 . . . . 65.31 111.126 -177.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.461 ' HG2' ' HB3' ' A' ' 8' ' ' PRO . 2.8 Cg_endo -84.66 152.23 11.64 Favored 'Trans proline' 0 CA--C 1.544 1.022 0 C-N-CA 123.145 2.564 . . . . 43.24 112.46 174.741 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -68.52 -43.45 4.07 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.549 2.166 . . . . 73.11 113.319 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 60.7 m-85 -137.32 80.69 33.11 Favored Pre-proline 0 N--CA 1.474 0.74 0 CA-C-O 120.973 0.416 . . . . 72.51 111.53 177.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.461 ' HB3' ' HG2' ' A' ' 5' ' ' PRO . 49.8 Cg_endo -95.82 -0.13 2.22 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 122.999 2.466 . . . . 71.12 113.47 176.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.513 ' NH2' ' HA ' ' A' ' 58' ' ' GLU . 13.2 ptm180 -174.33 138.78 0.57 Allowed 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.785 0.661 . . . . 74.24 112.785 -175.645 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -152.78 139.26 18.62 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 122.856 0.462 . . . . 74.15 110.958 169.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.484 ' O ' ' HE3' ' A' ' 54' ' ' LYS . . . -101.52 143.92 30.91 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 120.725 0.297 . . . . 45.44 111.339 176.2 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 49.7 p90 -139.65 144.3 37.57 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 121.181 0.515 . . . . 74.53 111.725 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 62.3 mt -95.34 140.49 16.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-N 116.153 -0.476 . . . . 63.25 111.333 -178.721 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.0 t -122.47 140.52 46.04 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 C-N-CA 122.586 0.354 . . . . 51.51 111.05 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.4 p -102.86 113.47 26.93 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.036 0.446 . . . . 74.04 111.942 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.443 HD13 ' NE2' ' A' ' 29' ' ' GLN . 37.4 pt -120.96 176.01 4.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-O 121.103 0.478 . . . . 55.22 111.702 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.413 ' HB2' ' HB ' ' A' ' 24' ' ' THR . 12.3 pt-20 -142.27 132.11 24.28 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.266 -0.425 . . . . 64.0 110.836 177.158 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -117.22 161.04 20.12 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-O 120.833 0.349 . . . . 71.34 111.876 -178.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.19 -147.16 17.19 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 121.471 -0.395 . . . . 64.33 113.583 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.453 ' O ' HG23 ' A' ' 24' ' ' THR . 94.9 mttt -89.1 151.95 47.5 Favored Pre-proline 0 N--CA 1.473 0.68 0 N-CA-C 112.187 0.44 . . . . 74.23 112.187 -173.523 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -53.59 123.09 12.5 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 122.345 2.03 . . . . 71.31 111.932 175.665 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.33 -50.84 3.89 Favored Glycine 0 CA--C 1.528 0.883 0 C-N-CA 121.05 -0.595 . . . . 55.01 112.48 -175.1 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 17.8 mm-40 -95.33 76.75 3.4 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.259 0.552 . . . . 65.43 110.896 177.311 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.453 HG23 ' O ' ' A' ' 20' ' ' LYS . 33.0 p -118.09 161.42 19.87 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.718 0.636 . . . . 70.25 112.718 -177.15 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 62.0 t -108.76 130.33 61.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-N 115.793 -0.639 . . . . 74.32 110.617 178.077 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.7 m -76.07 115.29 15.63 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 120.774 0.321 . . . . 73.41 111.737 -178.297 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.404 ' HB2' HG13 ' A' ' 16' ' ' ILE . 88.7 m95 -117.36 144.3 45.07 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.173 0.511 . . . . 75.21 111.52 177.795 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -111.01 115.39 29.39 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.053 -0.521 . . . . 75.42 110.817 176.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.539 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 91.4 mt-30 -97.49 125.4 42.15 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 120.727 0.298 . . . . 72.14 111.647 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.7 tp -90.49 115.08 27.36 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 122.281 -0.262 . . . . 70.1 110.336 173.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 58.3 mtt-85 -122.95 151.61 41.65 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 116.771 -0.195 . . . . 73.21 110.925 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -122.43 167.74 12.94 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 120.885 0.374 . . . . 64.04 111.782 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.3 p-10 -85.59 -30.55 23.22 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-O 121.097 0.475 . . . . 74.23 111.352 178.195 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -117.29 145.64 36.45 Favored Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 122.89 0.476 . . . . 72.25 110.799 176.303 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -72.28 -13.99 17.07 Favored 'Cis proline' 0 CA--C 1.543 0.951 0 C-N-CA 124.365 -1.098 . . . . 71.12 113.516 2.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -151.42 150.73 27.52 Favored Pre-proline 0 CA--C 1.539 0.551 0 CA-C-N 116.558 -0.292 . . . . 74.43 110.691 177.224 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -58.98 -24.73 74.61 Favored 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 122.747 2.298 . . . . 71.23 112.918 -178.728 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -82.68 3.02 30.73 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.741 -0.663 . . . . 72.54 111.897 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 89.2 p -64.81 105.09 0.93 Allowed 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 121.196 0.522 . . . . 45.31 111.851 -176.719 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 54.5 tp -91.92 111.09 22.49 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.169 -0.469 . . . . 73.15 110.35 175.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 44.7 mm -77.49 -51.81 17.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 CA-C-N 116.356 -0.384 . . . . 55.32 111.386 -179.413 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 94.5 p -168.77 159.03 9.46 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.049 0.452 . . . . 62.15 111.954 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.539 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 45.8 mt-10 -114.79 121.42 43.24 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.961 -0.563 . . . . 72.21 110.465 175.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -126.59 141.95 41.71 Favored Pre-proline 0 N--CA 1.47 0.574 0 O-C-N 122.081 -0.387 . . . . 71.25 111.721 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -71.78 -27.08 18.48 Favored 'Trans proline' 0 CA--C 1.542 0.888 0 C-N-CA 122.573 2.182 . . . . 70.45 113.616 -177.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 28.1 p -106.07 148.14 28.11 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.066 0.46 . . . . 74.22 111.781 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.438 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -64.14 -31.75 73.06 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.308 -0.406 . . . . 74.53 111.335 175.252 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 27.9 tp60 -57.01 -54.49 46.14 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 116.465 -0.334 . . . . 54.23 111.319 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -56.18 -42.45 77.11 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 120.897 0.379 . . . . 55.42 111.33 177.446 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.53 -41.68 99.02 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.873 0.368 . . . . 62.11 111.678 179.187 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.438 ' HG3' ' O ' ' A' ' 47' ' ' ALA . 66.0 mtt -64.97 -49.11 71.6 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.368 -0.378 . . . . 64.11 110.944 177.183 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -62.22 -37.62 86.06 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 111.779 0.288 . . . . 73.42 111.779 178.435 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.68 -43.36 89.5 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.514 -0.312 . . . . 74.31 111.048 176.064 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.484 ' HE3' ' O ' ' A' ' 11' ' ' ALA . 87.6 tttt -61.58 -53.97 49.26 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.466 -0.334 . . . . 73.31 111.109 176.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -56.9 -45.88 82.32 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.358 -0.383 . . . . 71.32 111.266 178.068 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 55.1 ttm-85 -56.74 -44.73 81.99 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.055 0.455 . . . . 71.42 110.929 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -63.26 -48.38 78.43 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.966 -0.561 . . . . 75.04 110.577 175.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.513 ' HA ' ' NH2' ' A' ' 9' ' ' ARG . 6.0 mm-40 -76.98 15.41 0.68 Allowed 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.743 0.646 . . . . 72.35 112.743 -175.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 52.0 m-20 -90.18 132.76 34.95 Favored Pre-proline 0 CA--C 1.537 0.464 0 O-C-N 122.178 -0.326 . . . . 75.01 110.818 170.103 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -72.05 11.24 0.75 Allowed 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 122.494 2.13 . . . . 71.02 112.756 177.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -79.33 -34.4 42.24 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 116.127 -0.488 . . . . 72.42 111.331 178.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -100.25 136.54 39.98 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.177 0.513 . . . . 75.43 111.627 -178.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -85.79 -172.16 3.96 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.41 0.624 . . . . 72.12 112.177 -178.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 83.8 mt -71.25 99.78 1.98 Allowed 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.031 -0.531 . . . . 74.24 111.539 -178.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -63.6 90.85 0.05 Allowed 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.508 0.67 . . . . 70.45 109.878 175.452 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 19.5 p-80 -96.53 37.68 1.26 Allowed 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 112.915 0.709 . . . . 75.53 112.915 -169.358 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 46.8 t-80 -78.47 99.77 6.58 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.999 0.428 . . . . 72.01 110.02 173.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -78.34 31.4 0.18 Allowed 'General case' 0 CA--C 1.543 0.701 0 CA-C-O 120.83 0.348 . . . . 74.23 111.89 -174.147 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 44.0 t-80 56.57 13.97 1.54 Allowed 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 112.899 0.703 . . . . 70.15 112.899 -179.588 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 10.8 t60 -77.73 68.4 3.79 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 109.594 -0.521 . . . . 64.25 109.594 177.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 . . . . . 0 C--O 1.251 1.173 0 CA-C-N 115.481 -0.781 . . . . 51.43 111.107 -170.642 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.9 ptt? . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 121.087 0.47 . . . . 75.42 111.214 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -82.27 165.41 16.72 Favored 'Trans proline' 0 CA--C 1.538 0.703 0 C-N-CA 122.633 2.222 . . . . 74.42 113.071 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 54.3 p -66.88 107.1 2.09 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 120.912 0.386 . . . . 63.1 110.967 176.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt 59.5 84.73 0.2 Allowed Pre-proline 0 N--CA 1.471 0.616 0 CA-C-N 115.973 -0.558 . . . . 73.41 111.232 -171.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.416 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 17.1 Cg_exo -68.75 154.37 71.36 Favored 'Trans proline' 0 CA--C 1.541 0.835 0 C-N-CA 122.728 2.285 . . . . 74.0 113.357 -178.836 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 5' ' ' PRO . 37.1 Cg_exo -62.37 169.47 8.01 Favored 'Trans proline' 0 CA--C 1.541 0.828 0 C-N-CA 122.654 2.236 . . . . 64.31 112.593 173.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 14.9 p90 -118.27 95.23 48.24 Favored Pre-proline 0 CA--C 1.545 0.786 0 CA-C-O 121.089 0.471 . . . . 73.15 111.943 -177.783 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -73.12 64.42 4.24 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.861 2.374 . . . . 71.14 112.133 175.505 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.426 ' NH2' ' O ' ' A' ' 57' ' ' TYR . 30.7 mtp-105 -98.5 102.93 14.82 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.934 -0.575 . . . . 70.52 111.545 -176.081 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -145.57 144.88 30.76 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.984 0.421 . . . . 73.23 111.767 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.43 ' HB2' ' CD2' ' A' ' 57' ' ' TYR . . . -128.78 152.47 48.42 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.981 -0.554 . . . . 72.12 111.511 179.188 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 33.9 p90 -142.27 168.79 18.91 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 120.856 0.36 . . . . 73.24 111.745 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 59.6 mt -109.81 136.87 44.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 N-CA-C 112.053 0.39 . . . . 63.12 112.053 -174.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 78.4 t -127.0 131.87 70.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 CA-C-N 116.46 -0.336 . . . . 70.53 110.731 175.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 68.2 p -89.91 123.05 33.51 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.312 0.486 . . . . 63.4 112.312 -177.289 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.483 HD13 ' NE2' ' A' ' 29' ' ' GLN . 37.1 pt -123.0 175.26 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 CA-C-N 116.326 -0.397 . . . . 72.4 110.495 173.447 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -134.61 137.89 44.08 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-O 120.935 0.398 . . . . 74.42 111.959 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 53.1 mttp -124.11 176.76 6.18 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 116.179 -0.464 . . . . 55.22 110.248 174.777 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.47 -142.48 15.87 Favored Glycine 0 CA--C 1.529 0.949 0 C-N-CA 121.214 -0.517 . . . . 50.32 113.635 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 9.4 mtpm? -104.01 146.37 32.41 Favored Pre-proline 0 N--CA 1.473 0.722 0 C-N-CA 122.574 0.35 . . . . 74.05 111.571 -178.34 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_exo -45.51 125.48 7.62 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 122.98 2.453 . . . . 35.14 113.039 178.239 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.94 -65.93 3.65 Favored Glycine 0 CA--C 1.525 0.682 0 C-N-CA 120.904 -0.665 . . . . 62.4 112.237 -175.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -83.05 68.55 9.57 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.284 0.564 . . . . 74.33 110.652 177.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 71.5 p -103.8 159.62 15.48 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 121.264 0.554 . . . . 74.4 112.288 -176.398 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 86.8 t -109.73 127.07 66.83 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-N 115.931 -0.577 . . . . 75.21 110.178 174.373 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 59.0 m -79.68 115.59 19.38 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.095 0.474 . . . . 64.42 111.719 -178.04 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 73.6 m95 -102.71 132.31 48.93 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.104 -0.498 . . . . 74.11 110.953 177.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -97.1 114.4 26.06 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.001 0.429 . . . . 73.01 110.907 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.737 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 92.0 mt-30 -95.3 120.75 36.07 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.123 -0.489 . . . . 73.2 111.696 -178.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 58.2 tp -85.09 105.3 15.72 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.309 -0.405 . . . . 62.04 110.418 175.204 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.455 ' NH2' ' HA ' ' A' ' 38' ' ' ASP . 15.2 mtp-105 -111.49 139.97 46.48 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.336 -0.393 . . . . 70.13 110.945 -177.307 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -109.86 149.17 30.26 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 120.932 0.396 . . . . 73.54 111.324 177.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -77.36 -22.76 51.26 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 112.422 0.527 . . . . 75.2 112.422 -175.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -128.22 148.26 66.97 Favored Pre-proline 0 N--CA 1.472 0.659 0 O-C-N 122.113 -0.367 . . . . 64.34 111.13 179.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -70.31 -42.28 0.79 Allowed 'Cis proline' 0 C--N 1.359 1.116 0 C-N-CA 124.215 -1.161 . . . . 73.41 113.32 0.192 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -103.65 145.8 31.3 Favored Pre-proline 0 N--CA 1.469 0.482 0 N-CA-C 110.293 -0.262 . . . . 74.44 110.293 175.069 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -62.85 -6.41 9.22 Favored 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 122.288 1.992 . . . . 74.42 113.124 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.455 ' HA ' ' NH2' ' A' ' 31' ' ' ARG . 5.5 m-20 -103.9 14.93 29.79 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.098 0.407 . . . . 63.14 112.098 178.665 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.7 m -65.52 87.27 0.08 Allowed 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.893 0.378 . . . . 71.23 111.093 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 59.0 tp -72.55 103.06 3.41 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 121.108 0.48 . . . . 64.1 111.081 178.05 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.2 mm -71.62 -43.36 71.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 CA-C-N 116.202 -0.453 . . . . 63.44 111.174 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.6 t -174.12 149.54 1.45 Allowed 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 112.069 0.396 . . . . 74.05 112.069 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.737 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 45.1 mt-10 -108.13 134.22 51.31 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 116.209 -0.451 . . . . 54.52 110.521 173.052 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -136.33 145.07 50.31 Favored Pre-proline 0 CA--C 1.538 0.504 0 O-C-N 122.236 -0.29 . . . . 75.23 111.311 178.066 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -73.66 -15.81 24.13 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 122.479 2.119 . . . . 50.24 112.851 179.679 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 34.8 p -115.97 142.33 46.93 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 120.936 0.398 . . . . 74.34 111.372 178.486 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.462 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -64.15 -35.6 81.3 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 120.967 0.413 . . . . 53.13 110.855 176.779 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -55.26 -49.34 72.29 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.282 -0.417 . . . . 73.35 111.529 178.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -62.49 -38.53 90.25 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 120.881 0.372 . . . . 73.53 111.126 177.611 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.32 -40.91 98.62 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 120.93 0.395 . . . . 72.32 111.221 178.239 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.462 ' HG3' ' O ' ' A' ' 47' ' ' ALA . 86.8 mtp -69.49 -44.42 71.14 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.018 0.437 . . . . 64.22 111.329 178.288 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.601 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 12.4 t70 -65.79 -41.68 91.68 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 120.967 0.413 . . . . 70.45 111.122 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.24 -36.58 84.57 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.019 0.437 . . . . 61.53 110.773 175.141 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 43.7 tttp -56.9 -49.14 76.46 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 115.986 -0.552 . . . . 71.22 111.345 175.054 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.601 ' HG2' ' O ' ' A' ' 52' ' ' ASP . 17.0 pttm -61.59 -43.97 97.88 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 121.084 -0.246 . . . . 53.42 110.854 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -65.2 -35.36 80.83 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 120.601 0.239 . . . . 72.41 111.497 -178.449 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.467 ' HA ' ' HB2' ' A' ' 62' ' ' LYS . 66.6 t80 -64.15 -47.56 79.4 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.867 0.365 . . . . 73.32 110.895 175.13 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -71.97 -21.57 61.57 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 116.288 -0.415 . . . . 50.31 111.512 -177.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -64.84 148.93 96.98 Favored Pre-proline 0 CA--C 1.543 0.69 0 N-CA-C 110.371 -0.233 . . . . 71.33 110.371 167.641 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -54.49 -14.34 6.94 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 122.608 2.205 . . . . 71.33 113.276 177.448 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -57.25 -28.63 63.12 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 112.609 0.596 . . . . 72.13 112.609 179.067 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.602 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -119.34 101.14 7.76 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.215 0.82 . . . . 71.51 113.215 -177.641 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -122.43 108.72 13.52 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 108.806 -0.813 . . . . 71.42 108.806 167.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 84.4 mt -115.3 40.76 2.61 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.298 0.851 . . . . 62.23 113.298 -165.545 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -72.87 85.01 1.24 Allowed 'General case' 0 N--CA 1.468 0.454 0 O-C-N 121.698 -0.626 . . . . 74.1 111.384 176.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 64.0 t60 -70.45 85.48 0.61 Allowed 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 109.257 -0.646 . . . . 71.42 109.257 172.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 52.9 t60 -59.87 94.52 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.181 0.515 . . . . 74.41 111.933 -170.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 39.9 t60 -172.34 91.43 0.11 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.498 -0.774 . . . . 71.33 109.295 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -67.18 86.32 0.15 Allowed 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 112.46 0.541 . . . . 73.33 112.46 -170.021 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 38.7 t-80 -77.52 113.16 15.05 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.351 -0.386 . . . . 61.21 110.524 173.267 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 26.7 p-80 . . . . . 0 C--O 1.25 1.097 0 CA-C-O 119.19 -0.433 . . . . 74.42 111.291 177.046 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.595 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.1 mpt? . . . . . 0 N--CA 1.488 1.448 0 CA-C-O 120.319 0.104 . . . . 74.2 111.059 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_exo -57.48 -56.99 1.41 Allowed 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 122.938 2.425 . . . . 75.24 113.042 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 90.6 m 63.54 -73.71 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 116.116 -0.493 . . . . 72.3 111.537 -177.511 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -100.13 115.03 65.88 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 122.274 0.229 . . . . 71.2 110.772 176.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.425 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 92.6 Cg_endo -75.94 150.92 34.86 Favored 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 122.644 2.23 . . . . 74.54 113.119 -177.377 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 5' ' ' PRO . 12.1 Cg_exo -70.31 96.39 0.64 Allowed 'Trans proline' 0 CA--C 1.539 0.725 0 C-N-CA 122.43 2.087 . . . . 73.13 112.073 176.028 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -60.94 113.04 6.7 Favored Pre-proline 0 CA--C 1.542 0.656 0 CA-C-N 116.548 -0.297 . . . . 75.24 110.895 178.589 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -55.3 110.4 0.54 Allowed 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 122.986 2.457 . . . . 64.1 114.175 -173.125 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.61 ' HG3' ' HA ' ' A' ' 58' ' ' GLU . 20.0 tpp180 -86.01 90.49 8.11 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 121.0 0.428 . . . . 75.31 110.034 174.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -141.36 141.65 33.81 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 112.05 0.389 . . . . 74.32 112.05 -172.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -138.03 162.07 35.08 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 120.801 0.334 . . . . 72.02 111.704 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 33.3 p90 -141.68 141.21 33.34 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 121.187 0.517 . . . . 71.41 111.952 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 62.4 mt -92.81 137.07 23.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-N 116.182 -0.463 . . . . 74.32 111.836 -177.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 48.2 t -123.65 137.62 56.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 C-N-CA 122.724 0.409 . . . . 74.15 110.854 177.444 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 77.8 p -98.07 129.74 44.89 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 112.376 0.51 . . . . 75.15 112.376 -177.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.415 HD13 ' NE2' ' A' ' 29' ' ' GLN . 41.3 pt -124.5 171.72 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-N 116.293 -0.412 . . . . 74.44 110.823 177.216 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -129.66 128.35 42.39 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.011 0.434 . . . . 72.43 111.909 -178.126 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -120.44 169.24 10.5 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 116.418 -0.356 . . . . 73.25 110.821 177.358 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.71 -141.76 15.52 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 120.957 -0.64 . . . . 31.43 114.049 177.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -94.49 141.3 23.28 Favored Pre-proline 0 CA--C 1.541 0.626 0 N-CA-C 111.997 0.369 . . . . 60.3 111.997 -173.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -55.63 99.6 0.07 OUTLIER 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.583 2.188 . . . . 72.41 111.935 175.328 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 116.21 -52.64 0.66 Allowed Glycine 0 CA--C 1.525 0.674 0 N-CA-C 111.537 -0.625 . . . . 43.24 111.537 -173.297 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.7 mm-40 -99.41 78.14 2.17 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.124 0.488 . . . . 53.02 110.67 173.359 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 81.6 p -105.89 164.73 11.72 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.342 0.592 . . . . 70.32 112.094 -177.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 61.7 t -121.49 118.43 55.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 115.797 -0.638 . . . . 72.45 109.633 173.472 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 87.9 m -76.07 115.33 15.67 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 120.945 0.402 . . . . 71.52 111.665 -177.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 36.9 m95 -97.37 151.08 20.29 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.079 -0.51 . . . . 74.23 111.271 177.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -109.67 115.0 29.06 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 116.204 -0.453 . . . . 73.01 111.34 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.615 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 92.6 mt-30 -98.26 130.21 44.97 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.002 -0.545 . . . . 74.14 111.041 178.083 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.5 tp -92.95 107.92 19.59 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 120.86 0.362 . . . . 65.33 111.121 175.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -102.95 163.97 11.89 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 120.917 0.389 . . . . 71.41 110.48 175.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -144.11 140.63 29.54 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.46 -0.336 . . . . 53.5 111.466 177.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -63.89 -17.79 63.55 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.014 0.435 . . . . 73.53 111.737 176.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 48.4 m80 -127.82 133.88 25.6 Favored Pre-proline 0 CA--C 1.544 0.745 0 CA-C-N 116.313 -0.403 . . . . 74.05 111.339 -174.411 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -77.96 -53.04 0.16 OUTLIER 'Cis proline' 0 CA--C 1.544 1.018 0 C-N-CA 123.853 -1.311 . . . . 72.55 113.334 -2.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.438 ' HE2' ' HD2' ' A' ' 37' ' ' PRO . 14.1 mmmm -77.92 141.49 63.63 Favored Pre-proline 0 CA--C 1.54 0.584 0 O-C-N 122.008 -0.433 . . . . 74.13 110.43 177.067 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.438 ' HD2' ' HE2' ' A' ' 36' ' ' LYS . 14.9 Cg_endo -56.22 -28.11 69.53 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 122.382 2.055 . . . . 34.1 112.871 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -99.05 22.73 9.92 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 116.558 -0.292 . . . . 72.4 111.7 177.455 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.0 t -57.85 94.99 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 121.014 0.435 . . . . 70.21 111.548 -178.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 58.8 tp -85.41 113.89 22.04 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.175 -0.466 . . . . 71.34 110.641 178.318 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.7 mm -81.27 -55.41 8.17 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 CA-C-N 116.61 -0.268 . . . . 72.23 111.624 -179.007 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 45.4 m -164.67 155.13 14.36 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-O 120.923 0.392 . . . . 71.42 111.631 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.615 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 45.2 mt-10 -105.45 139.45 40.06 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.189 -0.46 . . . . 75.53 110.296 174.271 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' HIS . . . . . 0.423 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 34.7 m80 -137.06 148.07 61.29 Favored Pre-proline 0 N--CA 1.473 0.702 0 N-CA-C 112.115 0.413 . . . . 74.22 112.115 179.245 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 44' ' ' HIS . 22.4 Cg_exo -63.65 -49.41 4.32 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 123.056 2.504 . . . . 73.24 113.499 178.872 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 34.0 p -101.64 158.97 15.71 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.352 0.596 . . . . 73.31 112.095 -178.723 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.425 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -64.68 -40.11 94.82 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.812 -0.631 . . . . 75.42 111.561 179.008 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.3 tp60 -58.94 -46.04 88.96 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.541 -0.3 . . . . 73.22 111.407 -178.087 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -56.36 -42.76 78.32 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 121.401 0.619 . . . . 62.13 111.001 175.26 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.88 -38.91 90.02 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.016 -0.538 . . . . 50.22 111.612 179.166 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.425 ' HG3' ' O ' ' A' ' 47' ' ' ALA . 73.6 mtp -70.98 -39.63 72.36 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.6 -0.273 . . . . 64.41 111.556 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.536 ' HA ' ' HD3' ' A' ' 55' ' ' LYS . 13.2 m-20 -59.92 -40.81 90.13 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 120.917 0.389 . . . . 53.23 111.343 174.747 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.8 -44.92 91.87 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.976 0.417 . . . . 63.53 110.942 174.015 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -56.88 -46.49 81.82 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.083 0.468 . . . . 73.12 110.896 176.299 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.536 ' HD3' ' HA ' ' A' ' 52' ' ' ASP . 47.3 mtpt -55.12 -53.94 49.51 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.77 -0.65 . . . . 74.14 111.174 175.187 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 56' ' ' ARG . 13.8 mtp180 -56.69 -26.56 56.89 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 111.992 0.367 . . . . 64.23 111.992 178.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -80.03 -47.15 15.34 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 111.645 0.239 . . . . 75.11 111.645 176.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.61 ' HA ' ' HG3' ' A' ' 9' ' ' ARG . 48.1 mt-10 -84.17 -16.13 44.58 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.687 0.625 . . . . 64.02 112.687 -173.704 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -79.28 161.55 67.31 Favored Pre-proline 0 CA--C 1.541 0.628 0 O-C-N 122.311 -0.243 . . . . 74.21 110.97 176.429 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -47.53 88.83 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 122.751 2.3 . . . . 45.02 114.119 -177.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -68.31 1.07 3.19 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.805 -0.634 . . . . 74.02 112.176 178.099 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.587 ' HD2' ' N ' ' A' ' 62' ' ' LYS . 3.4 mptp? -84.1 -9.85 58.27 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 111.892 0.33 . . . . 53.44 111.892 -178.12 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.556 ' HG2' ' H ' ' A' ' 65' ' ' GLU . 35.6 tt0 -64.72 150.85 46.52 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 120.994 0.426 . . . . 63.43 111.364 179.049 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.444 HD22 ' N ' ' A' ' 64' ' ' LEU . 2.9 mm? -70.74 -42.37 70.61 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.403 -0.362 . . . . 73.22 111.04 176.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.556 ' H ' ' HG2' ' A' ' 63' ' ' GLU . 71.7 tt0 68.46 -9.32 0.53 Allowed 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.316 0.646 . . . . 73.22 112.259 -178.386 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 50.8 t-80 -80.05 129.37 34.44 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 122.106 -0.371 . . . . 71.2 110.383 176.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 47.4 t-80 71.62 -48.83 0.68 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.342 0.657 . . . . 74.15 111.663 -175.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 49.8 t-80 -64.55 88.38 0.06 Allowed 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.033 0.444 . . . . 74.0 110.826 174.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 35.6 p-80 -74.87 136.27 41.52 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.993 0.425 . . . . 71.13 112.004 -176.254 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 9.3 p-80 -86.76 -12.96 46.61 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 120.813 0.34 . . . . 71.21 111.306 177.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 73.2 t60 . . . . . 0 C--O 1.253 1.268 0 CA-C-O 118.641 -0.695 . . . . 73.4 110.999 176.998 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.4 ptm . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 120.434 0.159 . . . . 70.04 111.269 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -65.69 133.92 35.98 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 122.404 2.069 . . . . 63.21 112.394 173.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 63.5 p -86.83 17.1 4.24 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-O 120.885 0.374 . . . . 74.21 111.009 178.575 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 51.8 tptt -60.95 111.08 3.59 Favored Pre-proline 0 CA--C 1.544 0.726 0 CA-C-N 115.925 -0.579 . . . . 71.2 112.545 -174.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -89.57 157.38 5.3 Favored 'Trans proline' 0 CA--C 1.546 1.091 0 C-N-CA 122.931 2.421 . . . . 72.42 112.907 177.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -69.1 151.79 72.79 Favored 'Trans proline' 0 CA--C 1.542 0.897 0 C-N-CA 122.662 2.241 . . . . 65.31 112.555 174.22 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.411 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 25.5 p90 -114.07 147.36 37.66 Favored Pre-proline 0 CA--C 1.542 0.654 0 CA-C-N 116.724 -0.216 . . . . 74.34 111.374 178.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 7' ' ' TYR . 38.9 Cg_exo -58.83 121.73 10.44 Favored 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 122.962 2.441 . . . . 71.03 114.166 -177.549 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.442 ' NH2' ' O ' ' A' ' 57' ' ' TYR . 0.0 OUTLIER -137.36 80.69 1.82 Allowed 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.186 0.517 . . . . 74.42 111.119 176.715 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -88.28 164.64 15.5 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.94 -0.573 . . . . 74.2 111.62 -177.005 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.581 ' HA ' ' HA ' ' A' ' 32' ' ' ALA . . . -131.72 156.87 45.16 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 116.156 -0.474 . . . . 52.25 111.663 176.864 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 55.5 p90 -149.22 169.56 20.48 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 121.04 0.448 . . . . 74.14 111.63 178.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 69.2 mt -113.04 130.12 67.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 N-CA-C 112.238 0.458 . . . . 72.32 112.238 -175.081 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.49 HG21 ' HD2' ' A' ' 31' ' ' ARG . 60.1 t -111.5 124.59 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-N 116.395 -0.366 . . . . 75.42 111.083 177.376 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 68.2 p -90.2 113.0 24.71 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 122.029 -0.419 . . . . 72.04 111.986 -178.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.438 HD13 ' NE2' ' A' ' 29' ' ' GLN . 32.4 pt -115.87 160.06 15.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 120.64 0.257 . . . . 75.53 111.101 176.697 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -124.39 121.61 35.4 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.131 0.491 . . . . 75.5 111.266 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 5.3 mtpm? -118.0 175.28 5.75 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 116.011 -0.541 . . . . 55.52 110.678 -178.007 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.29 -136.88 12.94 Favored Glycine 0 CA--C 1.526 0.733 0 C-N-CA 120.564 -0.827 . . . . 62.43 113.62 177.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.583 ' HD2' ' N ' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -96.28 156.45 36.92 Favored Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 122.526 0.33 . . . . 65.22 111.47 -175.16 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -56.38 123.28 13.47 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.686 2.257 . . . . 52.1 112.424 174.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 80.38 -60.73 4.5 Favored Glycine 0 CA--C 1.526 0.746 0 C-N-CA 120.88 -0.676 . . . . 74.13 112.494 -176.02 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -80.15 73.5 6.97 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.514 0.673 . . . . 64.42 110.628 176.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 78.2 p -100.01 167.96 10.16 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.558 -0.746 . . . . 75.42 112.638 -175.206 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 59.2 t -118.36 126.06 74.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.241 -0.89 . . . . 62.04 109.455 170.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 35.5 m -81.13 114.67 20.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.917 0.389 . . . . 70.44 110.866 -179.19 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -108.88 131.0 55.44 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.094 0.473 . . . . 75.45 110.847 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -98.1 114.27 26.41 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 116.361 -0.381 . . . . 74.21 110.953 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.474 ' HB2' ' HB ' ' A' ' 14' ' ' VAL . 68.8 mt-30 -88.6 117.78 27.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.369 -0.378 . . . . 75.31 111.645 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.6 tp -81.16 103.94 11.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.914 0.388 . . . . 72.31 110.195 173.249 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.49 ' HD2' HG21 ' A' ' 14' ' ' VAL . 58.8 mtt180 -114.27 171.41 7.63 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.518 -0.31 . . . . 73.34 110.752 178.756 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.581 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . . . -126.77 150.59 49.04 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.117 0.484 . . . . 61.14 111.865 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -72.17 -25.31 61.64 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.168 0.509 . . . . 72.42 111.43 175.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -132.45 141.83 42.7 Favored Pre-proline 0 CA--C 1.544 0.745 0 CA-C-N 116.2 -0.454 . . . . 64.41 111.105 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -77.17 -30.36 6.04 Favored 'Cis proline' 0 C--N 1.355 0.872 0 C-N-CA 124.068 -1.221 . . . . 73.13 113.31 0.733 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -124.53 143.73 44.11 Favored Pre-proline 0 CA--C 1.54 0.584 0 CA-C-O 120.568 0.223 . . . . 74.23 111.532 -176.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -55.26 -27.78 58.84 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.718 2.278 . . . . 62.25 113.22 177.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -92.9 13.44 20.49 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.098 0.407 . . . . 75.31 112.098 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.7 m -68.4 83.84 0.26 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.159 0.504 . . . . 75.22 110.336 174.534 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 58.1 tp -82.94 122.32 28.12 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 116.015 -0.539 . . . . 72.11 111.772 -177.347 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 45.9 mm -87.67 -49.98 14.11 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-N 116.284 -0.416 . . . . 61.14 111.495 179.14 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.7 t -172.74 148.79 1.93 Allowed 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 111.851 0.315 . . . . 75.3 111.851 -177.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -103.61 133.55 48.44 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.027 0.441 . . . . 73.14 110.856 175.144 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' HIS . . . . . 0.559 ' HB3' ' HB3' ' A' ' 49' ' ' GLU . 45.0 m-70 -128.63 143.53 48.76 Favored Pre-proline 0 N--CA 1.47 0.542 0 O-C-N 122.287 -0.258 . . . . 75.54 111.473 -178.011 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -71.87 -26.93 18.33 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 C-N-CA 122.827 2.351 . . . . 74.21 114.492 -174.034 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 25.6 p -114.47 151.18 33.65 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.85 -0.531 . . . . 73.0 111.964 -178.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.04 -39.71 86.87 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.196 -0.456 . . . . 63.42 111.62 177.309 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.9 tp60 -61.77 -42.58 99.17 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 120.665 0.269 . . . . 75.14 110.942 178.166 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.559 ' HB3' ' HB3' ' A' ' 44' ' ' HIS . 12.0 mm-40 -56.24 -47.06 79.25 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.993 0.425 . . . . 61.23 111.355 174.393 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.82 -50.91 69.1 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.136 -0.484 . . . . 64.13 111.959 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 93.5 mmm -63.15 -39.38 94.49 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 111.894 0.331 . . . . 73.43 111.894 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.445 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 32.8 t70 -64.06 -49.69 71.33 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.952 0.406 . . . . 74.3 110.844 179.51 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.23 -37.71 86.43 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.1 0.476 . . . . 73.53 111.306 175.739 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.7 tttm -56.01 -47.47 77.73 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.027 -0.533 . . . . 63.43 111.264 177.258 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -58.98 -43.76 91.46 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.025 0.441 . . . . 64.31 111.482 176.617 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.445 ' HG3' ' O ' ' A' ' 52' ' ' ASP . 51.5 mtt-85 -62.27 -32.97 73.75 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.167 -0.47 . . . . 74.32 111.359 -179.49 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.445 ' CD2' ' HB2' ' A' ' 11' ' ' ALA . 57.2 t80 -76.89 -44.08 33.27 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.442 -0.345 . . . . 72.51 111.775 177.451 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -80.18 5.75 13.63 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.517 0.562 . . . . 75.13 112.517 -175.439 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -62.19 135.84 95.18 Favored Pre-proline 0 CA--C 1.547 0.83 0 N-CA-C 109.532 -0.544 . . . . 63.42 109.532 174.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_exo -37.75 -60.35 0.44 Allowed 'Trans proline' 0 CA--C 1.543 0.975 0 C-N-CA 123.735 2.957 . . . . 75.34 115.16 -172.257 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -149.33 23.35 0.92 Allowed 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.967 0.728 . . . . 70.41 112.967 -177.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.505 ' NZ ' ' HB2' ' A' ' 62' ' ' LYS . 3.5 ttmp? -63.81 135.18 56.42 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.931 0.396 . . . . 74.32 111.709 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -100.2 105.53 17.12 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.319 -0.4 . . . . 63.32 111.51 -178.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 88.0 mt -67.98 -25.43 65.42 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.488 0.661 . . . . 75.32 110.265 173.246 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -145.31 163.12 35.49 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.004 -0.998 . . . . 64.25 109.741 171.548 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 33.5 m80 -69.85 119.81 14.64 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.063 0.459 . . . . 74.1 112.063 -174.18 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 31.4 p-80 -57.59 138.77 54.92 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 116.223 -0.444 . . . . 71.4 111.304 178.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 19.2 p-80 -137.16 150.02 47.65 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.309 -0.405 . . . . 74.52 111.561 -176.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 43.0 t-80 -63.01 -68.41 0.34 Allowed 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 112.915 0.709 . . . . 72.35 112.915 -174.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 -158.94 157.81 32.1 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.132 0.492 . . . . 74.13 111.71 -175.675 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 82.8 t60 . . . . . 0 C--O 1.245 0.867 0 CA-C-O 118.54 -0.743 . . . . 75.12 110.814 172.148 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.6 mtm . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 120.453 0.168 . . . . 65.41 110.928 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -61.9 108.67 0.68 Allowed 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 122.61 2.207 . . . . 71.34 113.449 -176.223 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 48.1 p -103.49 -57.21 2.07 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.142 0.496 . . . . 71.41 111.175 178.034 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.719 ' HZ3' ' HB2' ' A' ' 4' ' ' LYS . 0.2 OUTLIER -102.55 102.09 23.97 Favored Pre-proline 0 N--CA 1.471 0.578 0 CA-C-N 116.224 -0.444 . . . . 72.33 110.576 175.47 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -93.43 163.54 2.4 Favored 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 123.012 2.474 . . . . 72.01 113.161 178.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -67.09 130.75 23.53 Favored 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 122.356 2.037 . . . . 75.11 111.496 171.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 -57.41 144.68 70.71 Favored Pre-proline 0 CA--C 1.542 0.661 0 N-CA-C 111.944 0.35 . . . . 63.44 111.944 -177.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -59.57 171.62 2.52 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 122.954 2.436 . . . . 72.44 113.51 -178.293 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.725 ' HB2' ' HA ' ' A' ' 58' ' ' GLU . 18.1 ptp180 -121.45 7.21 10.09 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.466 0.913 . . . . 73.04 113.466 -168.235 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -95.2 143.05 26.93 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-O 121.487 0.661 . . . . 75.31 112.489 -170.42 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.417 ' HB1' ' O ' ' A' ' 31' ' ' ARG . . . -139.31 -174.8 3.97 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.53 -0.759 . . . . 71.41 111.048 -177.803 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -152.33 145.72 24.8 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.066 0.46 . . . . 55.35 111.605 178.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 70.2 mt -101.56 131.09 50.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-N 116.348 -0.387 . . . . 71.21 111.417 -179.273 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 59.9 t -105.84 127.31 60.96 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-N 116.394 -0.366 . . . . 72.4 111.05 177.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.6 p -91.29 112.68 24.69 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.741 0.305 . . . . 71.51 111.712 -178.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.516 HD11 ' HE3' ' A' ' 18' ' ' LYS . 29.3 pt -115.77 170.53 5.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 116.476 -0.329 . . . . 70.55 110.97 177.877 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.437 ' HB2' ' HB ' ' A' ' 24' ' ' THR . 9.9 pt-20 -133.17 126.47 31.72 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.442 0.639 . . . . 74.44 111.58 176.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.516 ' HE3' HD11 ' A' ' 16' ' ' ILE . 98.5 mttt -114.61 178.15 4.39 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.848 -0.614 . . . . 63.41 111.203 -178.171 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.32 -136.93 12.96 Favored Glycine 0 CA--C 1.527 0.811 0 C-N-CA 121.107 -0.568 . . . . 70.14 113.309 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 48.7 mmtm -119.18 154.23 53.54 Favored Pre-proline 0 CA--C 1.539 0.537 0 O-C-N 122.663 -0.316 . . . . 72.43 111.337 -178.304 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -49.09 127.5 17.47 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 122.609 2.206 . . . . 65.45 112.76 176.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.51 -51.91 3.35 Favored Glycine 0 CA--C 1.526 0.758 0 C-N-CA 120.942 -0.647 . . . . 74.32 112.369 -175.605 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -99.66 74.32 1.86 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.871 0.367 . . . . 70.31 111.08 177.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.437 ' HB ' ' HB2' ' A' ' 17' ' ' GLU . 76.9 p -103.08 145.64 29.6 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.384 0.611 . . . . 74.53 112.156 -178.452 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 54.0 t -108.93 124.88 65.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 CA-C-N 115.801 -0.636 . . . . 64.22 110.176 174.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.2 m -75.31 115.55 15.07 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.629 0.252 . . . . 73.3 111.238 -178.628 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 82.0 m95 -108.51 132.8 53.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.267 0.556 . . . . 71.02 111.235 177.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -99.28 115.03 28.22 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.976 -0.556 . . . . 75.2 110.858 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.481 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 83.9 mt-30 -98.44 114.65 27.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.086 -0.506 . . . . 63.32 111.552 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 60.6 tp -79.22 111.3 15.31 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.858 0.361 . . . . 71.54 110.572 176.54 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.417 ' O ' ' HB1' ' A' ' 11' ' ' ALA . 66.8 mtt180 -118.76 169.25 10.0 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.675 0.274 . . . . 71.45 110.885 178.185 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -140.66 143.91 35.39 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.93 0.395 . . . . 51.33 111.711 -178.747 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -68.75 -20.17 64.36 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 116.189 -0.46 . . . . 64.31 111.975 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 70.8 m80 -119.49 133.64 23.8 Favored Pre-proline 0 CA--C 1.543 0.681 0 CA-C-N 116.245 -0.434 . . . . 70.51 111.24 -176.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -80.18 -24.13 12.91 Favored 'Cis proline' 0 CA--C 1.539 0.766 0 C-N-CA 123.877 -1.301 . . . . 72.03 113.103 -0.469 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -131.68 129.5 22.07 Favored Pre-proline 0 N--CA 1.47 0.546 0 CA-C-N 116.615 -0.266 . . . . 54.4 110.995 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -67.72 7.74 0.53 Allowed 'Trans proline' 0 CA--C 1.544 0.993 0 C-N-CA 122.643 2.229 . . . . 73.42 113.445 -179.198 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.9 m-20 -101.17 -3.75 28.52 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 122.153 -0.342 . . . . 63.43 111.082 175.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.6 t -77.06 142.14 39.96 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.014 0.435 . . . . 74.21 112.064 -176.128 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 56.1 tp -115.73 123.59 48.67 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.128 -0.487 . . . . 72.41 111.051 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 44.4 mm -88.02 -53.95 8.85 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 N-CA-C 111.739 0.274 . . . . 72.34 111.739 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.8 t -163.43 154.15 16.22 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 112.319 0.488 . . . . 72.11 112.319 -178.018 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.481 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 46.4 mt-10 -113.91 132.57 55.88 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 116.333 -0.394 . . . . 74.24 110.757 177.43 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -141.16 139.73 19.74 Favored Pre-proline 0 N--CA 1.473 0.711 0 O-C-N 122.221 -0.3 . . . . 73.43 111.539 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo -72.64 -15.68 27.13 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 122.642 2.228 . . . . 73.43 113.641 -177.17 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 44.2 p -116.82 148.78 40.91 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 120.914 0.388 . . . . 44.22 111.534 177.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.71 -31.2 72.06 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.867 0.365 . . . . 75.05 111.439 177.306 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.423 ' O ' ' HB2' ' A' ' 52' ' ' ASP . 0.1 OUTLIER -60.62 -52.33 65.63 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.271 -0.422 . . . . 71.42 110.571 179.43 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -55.97 -45.85 78.8 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 120.897 0.379 . . . . 74.31 111.803 178.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.81 -49.24 78.49 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 120.99 0.424 . . . . 71.12 111.447 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.441 ' O ' ' HG3' ' A' ' 55' ' ' LYS . 24.2 mmt -64.23 -33.84 76.72 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.195 0.522 . . . . 53.24 111.101 175.167 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.825 ' HA ' ' HE2' ' A' ' 55' ' ' LYS . 3.6 t70 -61.97 -46.29 89.9 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.93 -0.577 . . . . 65.4 110.846 -177.469 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.95 -33.39 72.05 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 116.016 -0.538 . . . . 70.45 111.231 175.499 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 65.7 tttm -61.49 -37.22 82.88 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.193 -0.458 . . . . 54.54 111.346 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.825 ' HE2' ' HA ' ' A' ' 52' ' ' ASP . 51.1 mtmt -51.97 -55.37 20.78 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.742 0.306 . . . . 71.31 111.242 177.041 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 15.8 mtp180 -67.05 -26.71 66.89 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.002 0.371 . . . . 64.33 112.002 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -66.19 -32.45 73.89 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.035 0.445 . . . . 73.21 110.535 173.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.725 ' HA ' ' HB2' ' A' ' 9' ' ' ARG . 52.0 mt-10 -77.92 -45.37 24.23 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.952 0.406 . . . . 61.53 110.845 175.528 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -67.51 167.57 15.28 Favored Pre-proline 0 CA--C 1.549 0.908 0 N-CA-C 112.256 0.465 . . . . 64.3 112.256 177.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.24 -7.11 20.38 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.382 2.055 . . . . 63.24 112.455 172.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -76.78 29.96 0.13 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 122.707 0.403 . . . . 71.13 111.783 177.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.438 ' HE3' ' HB2' ' A' ' 62' ' ' LYS . 37.0 ttmt -77.0 131.58 38.53 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 122.787 0.435 . . . . 72.44 111.065 -179.426 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 45.2 mm-40 -104.15 -11.45 17.28 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.395 0.517 . . . . 65.24 112.395 -173.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 94.1 mt -55.49 126.8 26.74 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 120.904 0.383 . . . . 72.12 111.766 179.349 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -68.75 164.13 22.46 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.236 0.541 . . . . 72.13 111.763 177.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 68.2 m-70 -74.5 105.45 5.63 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.365 -0.38 . . . . 74.45 110.152 176.242 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 46.6 m80 -79.43 139.24 37.73 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.258 -0.428 . . . . 62.15 111.702 -176.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 72.9 m80 -88.61 164.8 15.19 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.43 0.634 . . . . 75.14 112.124 -177.095 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 21.5 m80 -81.49 84.1 6.8 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.663 -0.698 . . . . 72.23 111.387 -175.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 75.6 t60 -68.51 129.38 39.75 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 120.897 0.379 . . . . 74.31 111.799 -177.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 75.8 m80 . . . . . 0 C--O 1.254 1.297 0 CA-C-O 118.533 -0.746 . . . . 73.24 111.224 176.137 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.488 1.443 0 N-CA-C 110.604 -0.147 . . . . 44.1 110.604 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -66.58 78.61 0.35 Allowed 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.315 2.01 . . . . 72.42 113.349 -179.102 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 92.5 m -92.34 94.58 9.21 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 109.758 -0.46 . . . . 74.53 109.758 172.175 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.434 ' O ' ' HG3' ' A' ' 4' ' ' LYS . 20.7 pttp -59.24 111.51 3.85 Favored Pre-proline 0 CA--C 1.545 0.772 0 N-CA-C 112.791 0.663 . . . . 65.14 112.791 -173.498 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_endo -87.69 151.63 7.46 Favored 'Trans proline' 0 CA--C 1.544 1.014 0 C-N-CA 122.531 2.154 . . . . 61.04 112.041 173.622 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -73.55 -1.3 10.5 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 122.44 2.093 . . . . 74.32 112.849 178.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 33.5 p90 -143.61 147.66 40.18 Favored Pre-proline 0 CA--C 1.543 0.676 0 CA-C-N 116.382 -0.372 . . . . 71.01 110.894 -178.222 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -66.66 122.26 9.63 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 122.377 2.052 . . . . 73.41 111.808 172.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.428 ' HD3' ' O ' ' A' ' 58' ' ' GLU . 2.8 ptp180 -104.24 87.99 2.88 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.45 0.643 . . . . 75.04 112.187 -177.052 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -151.82 156.61 40.54 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.542 -0.753 . . . . 73.1 110.932 175.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.41 ' O ' ' HE3' ' A' ' 54' ' ' LYS . . . -134.5 178.65 6.82 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 121.062 0.458 . . . . 70.3 111.824 -175.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 33.0 p90 -144.41 141.46 29.66 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.338 0.589 . . . . 75.53 111.383 178.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 57.3 mt -91.58 125.53 44.27 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 CA-C-N 116.075 -0.511 . . . . 73.41 111.786 -177.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.452 HG21 ' HD2' ' A' ' 31' ' ' ARG . 83.8 t -106.1 132.4 53.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 CA-C-O 120.862 0.363 . . . . 74.1 111.047 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 67.8 p -93.19 120.86 33.94 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.306 0.484 . . . . 71.01 112.306 -178.411 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 37.8 pt -123.89 171.83 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 CA-C-O 120.763 0.316 . . . . 73.01 110.877 176.013 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.557 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 45.6 mt-10 -136.0 127.68 28.99 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.22 0.533 . . . . 73.02 111.623 178.047 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -104.99 174.69 5.77 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.266 -0.424 . . . . 73.01 110.83 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.41 -140.27 14.83 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 120.789 -0.719 . . . . 64.34 113.864 177.07 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.55 ' HB2' ' HB2' ' A' ' 23' ' ' GLN . 1.9 mptp? -102.29 154.43 37.41 Favored Pre-proline 0 N--CA 1.471 0.618 0 C-N-CA 122.43 0.292 . . . . 63.33 111.328 -176.135 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -54.91 112.81 1.14 Allowed 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 122.346 2.031 . . . . 74.35 111.885 172.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 94.72 -45.51 2.16 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 121.265 -0.493 . . . . 74.2 112.323 -175.445 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.55 ' HB2' ' HB2' ' A' ' 20' ' ' LYS . 27.8 mm-40 -96.52 71.63 2.69 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.322 0.582 . . . . 74.05 110.521 175.54 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.557 ' HB ' ' HB3' ' A' ' 17' ' ' GLU . 40.1 p -101.84 168.63 9.31 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.964 0.727 . . . . 71.33 112.964 -174.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 57.7 t -127.31 125.37 65.84 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 CA-C-N 115.217 -0.901 . . . . 71.4 110.159 176.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 90.6 m -68.86 124.74 24.51 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.384 0.513 . . . . 75.52 112.384 -177.284 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -130.29 150.71 51.41 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.109 0.48 . . . . 75.14 111.292 176.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -117.34 115.26 24.9 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.222 -0.445 . . . . 63.4 111.436 -179.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.626 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 70.9 mt-30 -94.48 107.33 19.31 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.914 0.388 . . . . 64.33 111.087 175.253 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.6 tp -74.81 111.66 10.23 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.634 -0.257 . . . . 72.4 110.594 175.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.452 ' HD2' HG21 ' A' ' 14' ' ' VAL . 74.4 mtt180 -116.43 142.61 46.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.781 0.324 . . . . 65.24 111.004 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -109.6 140.23 43.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.836 0.35 . . . . 73.31 111.662 -178.466 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.524 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 26.6 t70 -68.74 -21.58 64.36 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.136 0.494 . . . . 65.54 111.482 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.415 ' HA ' ' C ' ' A' ' 35' ' ' PRO . 78.9 m-70 -123.58 136.43 27.24 Favored Pre-proline 0 CA--C 1.543 0.7 0 CA-C-N 116.461 -0.336 . . . . 60.32 111.483 -176.107 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.415 ' C ' ' HA ' ' A' ' 34' ' ' HIS . 21.1 Cg_exo -67.36 -51.57 0.16 OUTLIER 'Cis proline' 0 C--N 1.359 1.1 0 C-N-CA 124.287 -1.13 . . . . 73.11 113.363 -0.383 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 31.5 mtmm -109.23 139.25 20.85 Favored Pre-proline 0 N--CA 1.472 0.629 0 O-C-N 122.298 -0.251 . . . . 71.4 110.897 176.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.524 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 77.2 Cg_exo -52.05 -29.78 37.74 Favored 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 123.182 2.588 . . . . 54.14 114.45 -177.222 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -78.34 6.78 7.59 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 112.222 0.453 . . . . 61.24 112.222 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 43.8 t -70.41 93.35 0.87 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.001 0.429 . . . . 60.44 111.511 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 59.8 tp -71.71 114.17 9.52 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 116.4 -0.364 . . . . 43.43 110.848 176.832 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.0 mm -79.02 -45.8 24.06 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-N 116.227 -0.442 . . . . 72.15 111.459 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 86.2 p -176.1 149.19 0.86 Allowed 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 112.473 0.546 . . . . 64.45 112.473 178.404 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.626 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 49.1 mt-10 -95.95 136.65 36.11 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 116.182 -0.463 . . . . 73.13 110.884 173.344 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -142.66 143.19 25.1 Favored Pre-proline 0 N--CA 1.471 0.623 0 C-N-CA 122.18 0.192 . . . . 73.15 111.393 177.222 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -71.75 -18.99 28.1 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.387 2.058 . . . . 71.0 112.921 -178.082 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 66.4 p -119.19 150.08 40.65 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.128 0.49 . . . . 73.21 111.524 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.442 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -67.77 -33.37 74.71 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.224 -0.444 . . . . 52.35 111.144 177.616 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -59.46 -48.34 82.04 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.28 -0.418 . . . . 72.41 111.629 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -63.34 -34.43 77.7 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.801 0.334 . . . . 71.33 111.862 177.155 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.51 -40.3 92.86 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 120.904 0.383 . . . . 74.23 110.786 174.426 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.442 ' HG3' ' O ' ' A' ' 47' ' ' ALA . 64.7 mtt -67.08 -34.41 77.59 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.285 -0.416 . . . . 75.13 111.42 176.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.493 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 12.7 t70 -57.27 -53.19 60.97 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.05 0.452 . . . . 73.35 110.823 176.137 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.07 -31.56 72.15 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 116.239 -0.437 . . . . 54.34 111.331 178.369 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.435 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 87.8 tttt -62.59 -49.01 76.95 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 116.241 -0.436 . . . . 71.42 110.95 175.795 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -59.43 -43.64 93.06 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 116.277 -0.419 . . . . 64.32 111.217 176.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.493 ' HG3' ' O ' ' A' ' 52' ' ' ASP . 78.5 mtp180 -59.03 -38.71 79.92 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.81 0.338 . . . . 72.3 111.174 176.651 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -64.93 -39.55 93.68 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-O 121.062 0.458 . . . . 71.02 110.979 175.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 54' ' ' LYS . 42.3 mt-10 -69.52 -36.25 76.25 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.168 -0.469 . . . . 73.33 111.569 179.372 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.4 ' HB3' ' HD2' ' A' ' 60' ' ' PRO . 9.4 m-20 -80.88 164.27 51.69 Favored Pre-proline 0 CA--C 1.543 0.69 0 C-N-CA 122.42 0.288 . . . . 73.34 111.129 174.61 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.4 ' HD2' ' HB3' ' A' ' 59' ' ' ASP . 73.1 Cg_endo -74.38 46.58 1.42 Allowed 'Trans proline' 0 CA--C 1.545 1.056 0 C-N-CA 122.167 1.911 . . . . 71.23 113.05 176.373 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -67.23 -50.91 58.93 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-O 120.827 0.346 . . . . 72.4 111.716 -178.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -141.96 136.84 30.76 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 120.92 0.391 . . . . 65.42 111.095 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -90.15 143.01 27.16 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 120.882 0.372 . . . . 74.34 111.644 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.45 ' N ' HD12 ' A' ' 64' ' ' LEU . 5.7 mp -103.23 -10.03 19.09 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 112.223 0.453 . . . . 71.41 112.223 -176.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -81.0 143.47 32.5 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 122.225 -0.297 . . . . 74.32 111.74 -177.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -137.47 88.95 2.38 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.191 0.441 . . . . 75.44 112.191 -179.369 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 30.5 m-70 -133.95 142.17 47.59 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 122.687 0.395 . . . . 63.51 110.249 173.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 16.2 p80 -94.19 115.0 27.21 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.327 0.491 . . . . 73.24 112.327 -172.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 57.31 22.4 7.73 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 112.382 0.512 . . . . 63.41 112.382 173.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 55.5 t-80 -97.79 142.0 30.09 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.611 0.597 . . . . 73.13 112.611 -174.41 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 44.8 p-80 . . . . . 0 C--O 1.247 0.941 0 CA-C-N 115.717 -0.674 . . . . 64.1 110.514 170.284 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.534 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.1 mpt? . . . . . 0 N--CA 1.489 1.524 0 N-CA-C 111.156 0.058 . . . . 64.2 111.156 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -62.15 113.73 2.02 Favored 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 122.715 2.277 . . . . 63.4 112.538 176.331 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 69.7 p -89.44 -39.35 13.43 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.027 0.38 . . . . 74.25 112.027 -178.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt 59.19 91.61 0.07 OUTLIER Pre-proline 0 CA--C 1.543 0.694 0 CA-C-O 121.074 0.464 . . . . 64.32 111.438 -177.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -57.96 142.62 96.68 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 123.041 2.494 . . . . 70.13 113.833 -175.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.55 138.78 30.18 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.508 2.139 . . . . 70.14 112.207 173.585 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -60.83 145.09 89.15 Favored Pre-proline 0 CA--C 1.544 0.731 0 N-CA-C 111.957 0.355 . . . . 74.41 111.957 -177.244 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.04 95.14 0.04 OUTLIER 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 123.313 2.676 . . . . 75.41 114.718 -172.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -88.84 89.6 8.05 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 116.275 -0.42 . . . . 72.21 109.988 173.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -127.09 127.1 44.13 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 112.016 0.376 . . . . 54.02 112.016 -173.028 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.435 ' O ' ' HE2' ' A' ' 54' ' ' LYS . . . -120.85 155.58 33.8 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.837 0.351 . . . . 33.52 111.335 175.368 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 26.2 p90 -139.04 142.24 38.24 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.168 0.508 . . . . 73.11 111.588 178.469 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 64.8 mt -94.02 131.13 41.79 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 116.12 -0.491 . . . . 74.14 111.51 -178.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 67.3 t -117.91 127.79 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-O 120.817 0.342 . . . . 71.21 111.18 178.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 75.3 p -86.79 112.81 22.07 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.136 0.493 . . . . 74.21 111.95 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.5 pt -114.85 176.83 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 116.084 -0.507 . . . . 62.1 110.57 174.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.551 ' HB2' ' HB ' ' A' ' 24' ' ' THR . 10.2 pt-20 -140.83 126.91 19.51 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.266 0.555 . . . . 72.31 111.879 177.511 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -104.94 170.25 7.98 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.115 -0.493 . . . . 74.22 110.745 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 98.88 -168.33 22.36 Favored Glycine 0 CA--C 1.527 0.84 0 C-N-CA 120.846 -0.692 . . . . 32.22 113.562 177.281 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -70.04 143.12 91.14 Favored Pre-proline 0 N--CA 1.472 0.65 0 N-CA-C 112.064 0.394 . . . . 62.32 112.064 -178.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -54.32 119.45 6.38 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.465 2.11 . . . . 62.2 111.815 176.217 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.2 -47.71 1.34 Allowed Glycine 0 CA--C 1.526 0.74 0 C-N-CA 121.322 -0.466 . . . . 35.25 112.373 -174.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -99.33 60.43 1.17 Allowed 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.047 0.451 . . . . 73.12 110.65 176.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.551 ' HB ' ' HB2' ' A' ' 17' ' ' GLU . 38.6 p -98.52 154.46 17.88 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 113.029 0.751 . . . . 51.32 113.029 -174.469 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 56.9 t -110.8 127.12 68.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-N 115.618 -0.719 . . . . 62.42 110.458 175.272 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 88.2 m -72.96 115.33 12.14 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 112.25 0.463 . . . . 75.5 112.25 -178.36 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 56.7 m95 -110.07 141.37 43.01 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.227 -0.442 . . . . 64.13 111.104 176.693 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -103.29 115.27 30.24 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.529 -0.305 . . . . 71.23 110.876 178.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.588 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 90.0 mt-30 -94.33 119.22 32.77 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 120.959 0.409 . . . . 53.43 111.572 176.675 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.2 tp -84.51 110.97 19.08 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 120.863 0.363 . . . . 75.3 110.122 174.723 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 47.0 mtp180 -118.92 166.64 12.58 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.473 -0.33 . . . . 73.21 110.673 -176.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -133.04 144.03 49.78 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 111.68 0.252 . . . . 54.42 111.68 178.325 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -79.41 -28.52 41.79 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 111.963 0.357 . . . . 73.43 111.963 178.447 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 85.7 m-70 -107.01 128.34 26.27 Favored Pre-proline 0 CA--C 1.542 0.67 0 CA-C-N 116.605 -0.27 . . . . 71.03 111.385 -175.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -85.84 -22.36 13.32 Favored 'Cis proline' 0 C--N 1.354 0.864 0 C-N-CA 123.969 -1.263 . . . . 70.11 113.249 -2.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -117.7 141.94 29.82 Favored Pre-proline 0 N--CA 1.469 0.51 0 CA-C-N 116.32 -0.4 . . . . 74.45 111.114 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_exo -61.19 -24.44 79.07 Favored 'Trans proline' 0 N--CA 1.479 0.631 0 C-N-CA 122.594 2.196 . . . . 70.12 112.088 177.123 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -82.13 10.84 5.98 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.504 -0.771 . . . . 54.51 111.982 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 51.7 m -73.56 89.31 1.7 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.065 0.459 . . . . 61.44 111.007 177.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 60.8 tp -85.57 125.1 32.84 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.19 -0.459 . . . . 65.41 110.861 178.198 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.6 mm -92.25 -53.92 8.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-O 120.741 0.305 . . . . 72.1 111.561 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 84.0 p -168.71 152.37 5.51 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 112.194 0.442 . . . . 73.21 112.194 -178.578 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.588 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 49.2 mt-10 -105.15 135.65 46.11 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 116.215 -0.448 . . . . 74.12 110.587 174.687 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -138.41 136.79 19.46 Favored Pre-proline 0 CA--C 1.539 0.534 0 O-C-N 122.394 -0.191 . . . . 64.42 111.497 179.329 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -76.57 -4.31 14.85 Favored 'Trans proline' 0 CA--C 1.54 0.824 0 C-N-CA 122.622 2.214 . . . . 73.24 113.569 -177.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 71.1 p -129.73 144.08 51.12 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.095 0.474 . . . . 74.44 111.24 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.76 -38.73 86.24 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.239 -0.437 . . . . 60.41 111.531 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -55.2 -49.32 72.21 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.642 0.258 . . . . 73.11 111.11 178.335 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -63.28 -35.92 81.96 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 120.936 0.398 . . . . 74.13 111.664 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.37 -52.91 50.46 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.048 0.452 . . . . 61.33 111.203 176.514 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 87.8 mtp -62.09 -37.7 86.07 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 116.012 -0.54 . . . . 74.25 111.347 177.084 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.478 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 20.2 t70 -61.09 -52.23 65.78 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.874 -0.603 . . . . 64.14 110.924 178.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.56 -39.94 92.93 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.241 -0.436 . . . . 60.11 111.398 176.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.435 ' HE2' ' O ' ' A' ' 11' ' ' ALA . 61.0 tttm -56.27 -54.92 39.6 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 120.93 0.395 . . . . 74.15 111.448 179.35 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.478 ' HG2' ' O ' ' A' ' 52' ' ' ASP . 22.4 pttm -58.28 -40.81 82.88 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.563 -0.29 . . . . 73.41 110.328 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 69.5 mtp180 -67.21 -25.69 66.24 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 111.985 0.365 . . . . 64.43 111.985 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 75.4 t80 -77.02 -29.67 55.45 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 120.909 0.385 . . . . 64.3 111.509 174.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -102.54 -15.71 16.34 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.445 0.905 . . . . 74.01 113.445 -177.14 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 -69.07 159.28 83.71 Favored Pre-proline 0 N--CA 1.475 0.792 0 O-C-N 121.993 -0.442 . . . . 64.32 112.039 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_exo -57.52 -34.47 98.09 Favored 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 122.583 2.189 . . . . 74.13 112.742 175.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -75.62 98.83 4.13 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.133 0.492 . . . . 62.41 110.923 177.388 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -120.19 147.75 44.53 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.486 0.55 . . . . 73.43 112.486 -176.405 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 53.53 33.46 16.25 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 112.79 0.663 . . . . 75.2 112.79 171.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.434 HD23 ' H ' ' A' ' 64' ' ' LEU . 2.2 pt? -72.82 -0.28 12.97 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 112.394 0.516 . . . . 54.31 112.394 -179.408 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -69.81 88.67 0.55 Allowed 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.375 0.607 . . . . 74.31 112.119 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 15.9 p-80 -100.1 90.76 4.49 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.13 0.49 . . . . 73.01 110.51 173.076 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -88.78 143.52 26.85 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.071 -0.513 . . . . 62.41 110.062 -178.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 24.7 t60 -62.93 -12.73 27.35 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 112.412 0.523 . . . . 74.11 112.412 -175.013 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 51.4 m-70 -123.67 15.9 9.49 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-O 120.696 0.284 . . . . 65.33 111.616 175.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 32.5 t-80 -169.55 118.42 0.63 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 120.918 0.389 . . . . 70.3 111.849 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 . . . . . 0 C--O 1.25 1.125 0 CA-C-O 118.558 -0.734 . . . . 74.25 111.354 179.134 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 81.9 mtp . . . . . 0 N--CA 1.487 1.403 0 N-CA-C 111.608 0.225 . . . . 73.54 111.608 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -59.9 99.89 0.13 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 121.98 1.786 . . . . 72.1 111.098 170.542 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 59.0 p -67.03 83.51 0.12 Allowed 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.803 0.668 . . . . 70.14 112.803 -173.084 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -157.16 141.98 12.14 Favored Pre-proline 0 C--O 1.239 0.515 0 CA-C-N 115.468 -0.787 . . . . 71.53 110.357 174.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -54.37 142.61 68.79 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 122.627 2.218 . . . . 72.21 112.873 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -63.47 178.61 1.18 Allowed 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 122.527 2.152 . . . . 74.34 112.322 178.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.7 t80 61.97 62.93 2.22 Favored Pre-proline 0 CA--C 1.548 0.884 0 CA-C-O 121.529 0.681 . . . . 75.24 110.046 -175.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -91.56 5.25 3.84 Favored 'Trans proline' 0 CA--C 1.538 0.724 0 C-N-CA 122.987 2.458 . . . . 71.24 113.893 -175.009 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.443 ' NH2' ' HA ' ' A' ' 58' ' ' GLU . 22.0 ptt180 -165.8 146.26 6.69 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.014 0.435 . . . . 65.53 111.907 179.509 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.46 152.48 32.01 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 116.136 -0.483 . . . . 63.11 110.197 172.83 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.481 ' HB3' ' HG3' ' A' ' 54' ' ' LYS . . . -113.06 166.28 11.57 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.674 0.273 . . . . 74.5 111.009 176.737 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 22.6 p90 -155.78 143.56 19.67 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.248 0.547 . . . . 63.45 111.907 177.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 57.1 mt -96.85 111.32 26.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 CA-C-N 115.949 -0.568 . . . . 64.32 112.277 -175.096 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 72.4 t -106.26 126.89 61.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 122.518 0.327 . . . . 72.44 111.188 178.025 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 61.7 p -87.23 124.12 32.98 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 122.201 -0.312 . . . . 74.02 111.544 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.521 HD13 ' NE2' ' A' ' 29' ' ' GLN . 43.3 pt -114.63 154.37 16.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 CA-C-O 121.005 0.431 . . . . 75.43 111.705 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -100.74 109.68 21.72 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.19 -0.459 . . . . 71.42 111.733 -179.04 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.509 ' HE2' HD11 ' A' ' 16' ' ' ILE . 67.6 mttm -104.47 177.7 4.77 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 120.756 0.312 . . . . 75.4 110.285 175.594 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 88.32 -136.58 13.83 Favored Glycine 0 CA--C 1.527 0.793 0 C-N-CA 120.682 -0.77 . . . . 73.4 113.721 176.013 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -102.4 160.59 25.89 Favored Pre-proline 0 CA--C 1.54 0.578 0 CA-C-O 120.739 0.305 . . . . 62.42 111.669 -177.38 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -60.42 132.44 43.58 Favored 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 122.034 1.823 . . . . 74.33 111.685 169.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 80.37 -61.49 4.42 Favored Glycine 0 CA--C 1.528 0.864 0 C-N-CA 120.794 -0.717 . . . . 44.41 112.426 -175.513 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -87.39 75.8 9.17 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 121.449 0.642 . . . . 72.44 110.426 174.193 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 65.4 p -94.46 165.04 12.75 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.608 0.718 . . . . 64.12 112.632 -177.57 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 40.4 t -122.2 110.44 27.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-N 115.33 -0.85 . . . . 73.14 109.58 172.319 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 59.0 m -78.03 115.57 17.86 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.986 0.422 . . . . 72.11 111.963 -177.094 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 40.4 m95 -108.44 140.03 42.33 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.084 0.469 . . . . 73.52 111.561 178.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -92.35 114.31 26.82 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.228 -0.442 . . . . 70.51 110.931 178.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.692 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 76.6 mt-30 -97.84 116.99 31.16 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.341 -0.39 . . . . 74.43 111.553 178.334 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 49.8 tp -85.61 103.75 14.72 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 120.768 0.318 . . . . 73.2 110.183 173.339 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -103.71 148.24 26.29 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 110.319 -0.252 . . . . 70.33 110.319 178.195 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -124.02 149.11 46.44 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 112.139 0.422 . . . . 62.31 112.139 -178.652 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.635 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 34.4 t70 -66.38 -25.07 66.61 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 113.344 0.868 . . . . 72.32 113.344 -173.357 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 43.8 m-70 -122.06 142.5 36.68 Favored Pre-proline 0 N--CA 1.475 0.809 0 O-C-N 121.739 -0.601 . . . . 72.33 111.729 -178.139 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -74.42 -28.92 7.04 Favored 'Cis proline' 0 C--N 1.359 1.087 0 C-N-CA 124.182 -1.174 . . . . 62.12 113.385 0.577 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm -121.21 143.79 38.14 Favored Pre-proline 0 N--CA 1.467 0.408 0 N-CA-C 110.152 -0.314 . . . . 75.0 110.152 174.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.635 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 11.0 Cg_endo -52.36 -31.88 49.3 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.025 2.483 . . . . 72.35 114.62 -171.368 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -99.79 20.83 13.45 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 112.618 0.599 . . . . 72.22 112.618 -177.155 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 26.7 m -62.18 101.15 0.2 Allowed 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 121.266 0.555 . . . . 31.22 110.975 174.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.414 HD13 ' HB3' ' A' ' 29' ' ' GLN . 50.9 tp -72.41 106.51 4.56 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.764 -0.653 . . . . 65.41 112.259 -177.287 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 47.3 mm -65.31 -54.29 30.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-N 116.274 -0.421 . . . . 72.52 111.099 176.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 42.1 t -169.22 149.77 4.22 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 112.043 0.386 . . . . 74.35 112.043 -178.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.692 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 46.1 mt-10 -103.03 125.12 49.64 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 116.251 -0.431 . . . . 73.34 110.802 176.493 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 84.7 m-70 -128.2 148.62 68.46 Favored Pre-proline 0 N--CA 1.477 0.905 0 N-CA-C 111.797 0.295 . . . . 75.02 111.797 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -73.61 -21.25 19.47 Favored 'Trans proline' 0 CA--C 1.544 1.018 0 C-N-CA 122.547 2.165 . . . . 72.55 113.451 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 33.4 p -118.73 152.36 36.29 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 120.927 0.394 . . . . 45.35 111.654 179.217 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.41 -35.21 77.32 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.313 -0.403 . . . . 60.22 111.394 176.386 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -53.6 -49.12 68.46 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 120.767 0.318 . . . . 64.52 111.834 -179.394 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -58.76 -44.07 90.48 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 120.991 0.424 . . . . 74.14 111.743 178.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.38 -40.72 85.71 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 116.273 -0.421 . . . . 64.45 111.77 179.565 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 65.7 mtt -64.47 -43.22 94.86 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.856 0.36 . . . . 73.1 110.964 177.701 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -55.09 -51.1 67.46 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.076 0.465 . . . . 73.11 110.602 175.105 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.62 -35.58 78.3 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.011 -0.54 . . . . 71.3 111.487 179.094 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.481 ' HG3' ' HB3' ' A' ' 11' ' ' ALA . 63.2 tttm -63.6 -56.02 19.14 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 116.487 -0.324 . . . . 64.11 111.315 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 11.9 mptt -59.14 -43.72 92.02 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.102 0.477 . . . . 72.13 111.103 176.185 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 51.2 ttm-85 -65.85 -30.67 71.32 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.087 -0.506 . . . . 64.51 111.478 -178.278 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -67.88 -41.87 82.14 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 116.224 -0.443 . . . . 71.32 110.96 175.625 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.443 ' HA ' ' NH2' ' A' ' 9' ' ' ARG . 66.0 mm-40 -77.78 -8.58 58.2 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 112.696 0.628 . . . . 73.44 112.696 179.514 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -56.91 115.26 9.82 Favored Pre-proline 0 CA--C 1.546 0.799 0 CA-C-O 121.014 0.435 . . . . 75.21 111.189 179.035 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -83.2 88.32 1.21 Allowed 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.737 2.292 . . . . 63.33 113.964 -174.227 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -82.14 95.31 7.46 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.99 -0.55 . . . . 70.42 109.902 172.407 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.0 tptt -151.44 116.41 5.23 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.52 0.563 . . . . 70.35 112.52 -173.114 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -74.21 120.87 20.38 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.269 -0.423 . . . . 62.42 109.902 172.126 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.3 pp -144.68 174.23 11.15 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 112.92 0.711 . . . . 72.42 112.92 -178.031 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 37.9 mm-40 -99.8 105.0 16.73 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.729 -0.669 . . . . 74.45 111.645 177.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.2 p-80 -86.28 152.77 22.49 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 109.97 -0.381 . . . . 64.35 109.97 171.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 46.1 t60 -54.66 110.94 0.71 Allowed 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 120.742 0.306 . . . . 74.33 111.485 -178.371 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -140.55 142.28 35.19 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 120.938 0.399 . . . . 73.35 111.942 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 31.4 t-80 -66.52 107.42 2.07 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.099 -0.5 . . . . 75.33 111.748 179.393 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -92.86 146.33 23.72 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 116.379 -0.373 . . . . 73.01 110.837 176.243 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 54.9 t-80 . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.663 -0.684 . . . . 72.44 111.723 178.666 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.426 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 62.0 mtt . . . . . 0 N--CA 1.492 1.654 0 N-CA-C 111.847 0.314 . . . . 74.25 111.847 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 1' ' ' MET . 7.2 Cg_exo -75.14 35.64 0.43 Allowed 'Trans proline' 0 CA--C 1.544 0.991 0 C-N-CA 123.218 2.612 . . . . 73.52 113.09 176.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 91.2 m -54.76 116.51 2.76 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.069 0.461 . . . . 74.31 112.14 -175.612 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -98.65 128.01 34.01 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-N 116.271 -0.422 . . . . 61.54 111.63 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -64.8 119.93 7.08 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 C-N-CA 122.569 2.18 . . . . 64.23 112.144 174.364 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.6 161.05 46.83 Favored 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 122.85 2.367 . . . . 75.25 113.422 -176.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -103.97 107.53 57.19 Favored Pre-proline 0 CA--C 1.542 0.669 0 CA-C-N 116.018 -0.537 . . . . 72.32 111.325 -176.264 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -60.94 104.39 0.27 Allowed 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 122.219 1.946 . . . . 63.13 111.712 176.518 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 34.6 ttt180 -85.63 91.76 8.36 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.206 0.527 . . . . 74.14 110.848 -175.607 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -114.0 131.79 56.22 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.006 -0.543 . . . . 75.04 111.678 -175.228 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -129.49 158.04 40.33 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.114 -0.494 . . . . 54.22 111.119 177.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 39.5 p90 -151.37 155.24 38.26 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.099 0.476 . . . . 62.14 112.004 -177.409 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 60.1 mt -98.12 128.39 49.6 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 N-CA-C 112.401 0.519 . . . . 73.44 112.401 -176.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 48.7 t -115.67 141.7 31.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 122.604 0.362 . . . . 73.53 110.944 176.449 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 60.8 p -102.1 128.47 48.55 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 121.166 0.508 . . . . 74.44 112.005 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.545 HD13 ' NE2' ' A' ' 29' ' ' GLN . 41.9 pt -132.72 176.35 9.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-O 121.005 0.431 . . . . 73.04 111.094 176.674 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.54 ' HB2' ' HB ' ' A' ' 24' ' ' THR . 9.1 pt-20 -137.23 137.96 39.63 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.097 0.475 . . . . 73.44 111.674 177.622 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.401 ' HE3' HD11 ' A' ' 16' ' ' ILE . 95.4 mttt -127.53 164.91 20.92 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.113 -0.494 . . . . 73.25 111.016 179.638 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.74 -140.16 14.76 Favored Glycine 0 CA--C 1.533 1.18 0 N-CA-C 114.698 0.639 . . . . 71.13 114.698 175.191 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -86.1 157.11 57.18 Favored Pre-proline 0 N--CA 1.473 0.687 0 N-CA-C 112.279 0.474 . . . . 70.52 112.279 -173.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.35 141.4 68.1 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 122.092 1.861 . . . . 73.44 111.82 174.577 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.2 -61.75 3.79 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 120.949 -0.643 . . . . 74.25 112.477 -176.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -92.23 71.78 5.34 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 121.277 0.56 . . . . 74.13 111.099 176.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.54 ' HB ' ' HB2' ' A' ' 17' ' ' GLU . 63.1 p -93.88 159.2 15.29 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.737 -0.665 . . . . 61.24 111.236 178.883 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 61.0 t -108.98 127.78 65.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-N 116.521 -0.309 . . . . 64.3 111.028 178.109 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 37.8 m -76.78 116.11 17.15 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.773 0.32 . . . . 72.44 111.849 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -112.31 131.08 55.71 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.051 0.453 . . . . 75.2 111.281 176.346 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -96.9 114.13 25.72 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.034 0.445 . . . . 74.04 110.637 177.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.545 ' NE2' HD13 ' A' ' 16' ' ' ILE . 92.5 mt-30 -94.37 119.28 32.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.053 -0.521 . . . . 54.41 111.546 179.429 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.8 tp -83.45 107.36 15.89 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.197 -0.297 . . . . 74.5 110.197 172.368 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 31' ' ' ARG . 50.9 mtt180 -111.86 161.31 16.5 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 120.918 0.389 . . . . 71.12 111.231 179.435 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -123.25 166.88 14.51 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 120.988 0.423 . . . . 53.42 111.343 178.298 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -86.79 -37.71 17.55 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 116.381 -0.372 . . . . 62.15 111.841 -178.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 43.6 m80 -115.22 147.79 39.29 Favored Pre-proline 0 N--CA 1.475 0.777 0 C-N-CA 122.439 0.296 . . . . 74.2 111.555 178.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -82.7 -2.19 52.3 Favored 'Cis proline' 0 C--N 1.355 0.918 0 C-N-CA 124.147 -1.189 . . . . 74.54 112.851 -2.244 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -140.66 135.54 15.77 Favored Pre-proline 0 N--CA 1.466 0.372 0 CA-C-N 115.742 -0.663 . . . . 64.41 110.246 177.448 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -61.73 -20.95 70.98 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 121.939 1.759 . . . . 74.53 111.687 175.293 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -80.38 -3.03 48.08 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 115.632 -0.713 . . . . 73.12 111.629 177.564 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 42.5 t -60.79 96.61 0.05 OUTLIER 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 121.05 0.452 . . . . 75.13 112.176 -175.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 64.9 tp -81.39 106.47 13.38 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.067 0.46 . . . . 65.21 111.062 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.2 mm -71.6 -51.73 30.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 116.386 -0.37 . . . . 54.1 111.135 179.224 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 43.2 t -171.53 149.55 2.67 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 116.382 -0.372 . . . . 72.32 111.747 178.701 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.483 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 52.0 mt-10 -102.1 141.26 35.22 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 116.452 -0.34 . . . . 71.35 110.885 177.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -144.07 141.22 18.0 Favored Pre-proline 0 CA--C 1.539 0.53 0 O-C-N 122.304 -0.247 . . . . 73.3 111.269 178.132 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.49 -12.64 24.95 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 122.431 2.087 . . . . 71.51 113.156 -178.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 80.3 p -122.58 141.88 51.23 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-O 121.051 0.453 . . . . 73.43 111.212 177.485 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.28 -31.84 72.44 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.356 -0.384 . . . . 63.51 111.696 -179.474 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.51 -46.98 73.62 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 120.704 0.288 . . . . 45.11 110.755 177.614 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -60.92 -39.48 89.58 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.996 0.427 . . . . 74.32 111.575 175.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.68 -37.89 89.13 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 116.331 -0.395 . . . . 72.14 111.023 176.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 67.3 mtt -68.44 -51.97 37.81 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.594 -0.276 . . . . 74.31 111.515 177.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -57.36 -41.35 79.97 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 120.773 0.32 . . . . 70.15 111.854 178.099 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.07 -40.19 87.0 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 120.85 0.357 . . . . 61.5 111.132 175.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 52.5 tttp -62.77 -58.64 6.73 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 122.669 0.387 . . . . 71.2 112.024 178.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -56.45 -36.39 68.97 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 121.207 0.527 . . . . 71.21 111.655 -179.397 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 32.5 ttp180 -80.44 -26.5 38.35 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 116.007 -0.542 . . . . 74.33 111.798 -178.237 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -81.6 -42.72 19.65 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.752 0.31 . . . . 73.34 111.537 178.004 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -64.42 -9.71 20.1 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 121.491 0.662 . . . . 72.42 111.155 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -100.91 139.05 20.21 Favored Pre-proline 0 CA--C 1.548 0.897 0 CA-C-N 115.406 -0.815 . . . . 61.33 109.657 171.502 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -58.67 -6.88 3.64 Favored 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 122.816 2.344 . . . . 73.31 114.575 -176.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -59.41 -50.6 73.32 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 112.289 0.478 . . . . 75.24 112.289 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.15 117.06 24.74 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 112.043 0.386 . . . . 72.13 112.043 -178.113 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -120.8 -178.98 3.86 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.876 0.369 . . . . 63.14 110.923 175.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.505 ' N ' HD23 ' A' ' 64' ' ' LEU . 1.6 pt? -158.85 89.69 0.96 Allowed 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 121.347 0.594 . . . . 63.21 110.719 176.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -88.19 174.9 7.95 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.16 0.505 . . . . 73.24 111.215 -179.289 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 19.6 p80 -149.44 110.6 4.39 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.156 -0.474 . . . . 71.33 111.435 178.124 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 -72.27 -24.96 61.43 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.229 0.538 . . . . 51.24 110.462 175.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 19.8 p80 -152.1 135.74 16.19 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.629 -0.714 . . . . 75.22 109.807 171.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 1.5 p80 -66.84 143.01 57.13 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 112.744 0.646 . . . . 73.43 112.744 -176.44 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 25.8 m170 -79.14 -38.64 35.55 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 120.889 0.376 . . . . 75.54 110.614 174.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 . . . . . 0 C--O 1.252 1.234 0 CA-C-O 118.135 -0.936 . . . . 75.34 111.708 -178.605 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.434 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 62.8 mtm . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.558 0.218 . . . . 43.55 110.676 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 1' ' ' MET . 31.2 Cg_exo -60.04 105.37 0.28 Allowed 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 122.436 2.09 . . . . 52.21 113.979 -177.07 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.466 ' O ' ' HD3' ' A' ' 5' ' ' PRO . 22.3 m -82.07 130.37 35.06 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 116.478 -0.328 . . . . 63.44 110.131 170.621 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.532 ' HD2' ' N ' ' A' ' 4' ' ' LYS . 10.3 mptt -92.54 110.09 42.78 Favored Pre-proline 0 CA--C 1.541 0.623 0 N-CA-C 111.859 0.318 . . . . 74.11 111.859 -175.204 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.466 ' HD3' ' O ' ' A' ' 3' ' ' THR . 87.6 Cg_endo -91.62 146.8 3.32 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 122.684 2.256 . . . . 73.22 112.141 173.375 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.53 93.93 0.04 OUTLIER 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 122.278 1.985 . . . . 73.23 112.56 177.138 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -147.05 75.2 11.79 Favored Pre-proline 0 CA--C 1.54 0.567 0 CA-C-O 121.384 0.612 . . . . 73.54 110.708 179.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -73.09 107.43 2.37 Favored 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 122.912 2.408 . . . . 65.54 112.607 -179.13 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 44.7 mtm-85 -79.48 83.74 5.45 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.076 0.465 . . . . 73.21 110.196 177.662 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -88.32 123.68 33.15 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.093 -0.503 . . . . 74.11 111.264 -176.606 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.537 ' O ' ' HE2' ' A' ' 54' ' ' LYS . . . -106.73 146.31 30.97 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 120.614 0.245 . . . . 73.44 111.427 179.345 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 40.2 p90 -144.98 153.24 41.29 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.162 0.506 . . . . 73.41 112.132 179.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.2 mt -96.18 135.21 31.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-N 116.095 -0.502 . . . . 71.03 111.951 -178.125 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 95.4 t -123.9 134.56 66.15 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-N 116.143 -0.48 . . . . 75.5 110.897 177.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 65.3 p -96.45 124.96 40.62 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 120.899 0.38 . . . . 71.2 111.807 -178.427 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.419 HD13 ' NE2' ' A' ' 29' ' ' GLN . 35.2 pt -126.14 170.79 15.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-N 116.317 -0.401 . . . . 75.4 111.462 179.22 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -128.49 135.11 49.0 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 116.351 -0.386 . . . . 74.41 110.858 178.481 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -122.43 158.11 30.45 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 120.896 0.379 . . . . 75.03 111.844 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.62 -138.79 14.08 Favored Glycine 0 CA--C 1.529 0.931 0 CA-C-N 116.268 -0.424 . . . . 63.51 113.966 177.141 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 54.2 mttp -94.64 155.46 39.43 Favored Pre-proline 0 CA--C 1.541 0.609 0 N-CA-C 111.926 0.343 . . . . 74.14 111.926 -174.618 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -52.96 130.3 37.22 Favored 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 122.879 2.386 . . . . 72.54 113.185 -178.056 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 77.46 -64.47 3.22 Favored Glycine 0 CA--C 1.523 0.55 0 C-N-CA 121.123 -0.561 . . . . 72.3 112.822 -178.208 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 69.6 mm-40 -80.93 71.53 7.89 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.272 0.558 . . . . 63.31 110.942 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 45.6 p -106.6 172.24 6.92 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.429 0.633 . . . . 75.31 112.201 -176.389 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 91.1 t -111.25 128.66 67.58 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-N 115.745 -0.662 . . . . 75.13 109.981 169.149 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 87.2 m -83.94 115.37 22.27 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.122 0.487 . . . . 71.23 111.762 -176.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 65.1 m95 -109.07 149.76 28.81 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 116.132 -0.485 . . . . 73.11 111.612 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -112.94 116.06 29.39 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.237 -0.438 . . . . 72.11 111.078 -179.212 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.699 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 85.4 mt-30 -101.02 133.33 45.67 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.297 -0.411 . . . . 62.24 111.882 -179.871 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.472 HD11 ' HB1' ' A' ' 11' ' ' ALA . 56.7 tp -91.66 111.35 22.82 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 110.145 -0.317 . . . . 73.15 110.145 172.92 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 37.5 mtp180 -115.12 148.67 38.68 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 110.17 -0.307 . . . . 73.54 110.17 -178.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -115.06 160.81 19.19 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.923 0.712 . . . . 73.52 112.923 -175.057 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -71.16 -36.0 71.86 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 115.461 -0.79 . . . . 73.25 112.498 -177.318 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.488 ' HA ' ' C ' ' A' ' 35' ' ' PRO . 45.6 m-70 -137.45 157.14 74.49 Favored Pre-proline 0 CA--C 1.544 0.724 0 C-N-CA 122.289 0.235 . . . . 74.34 111.473 -179.365 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.488 ' C ' ' HA ' ' A' ' 34' ' ' HIS . 24.5 Cg_endo -60.47 -47.98 0.18 OUTLIER 'Cis proline' 0 C--N 1.363 1.334 0 C-N-CA 124.906 -0.872 . . . . 55.22 113.85 2.387 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -112.85 150.12 42.31 Favored Pre-proline 0 CA--C 1.538 0.489 0 CA-C-O 120.466 0.174 . . . . 74.21 110.702 175.372 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -65.82 -22.85 56.04 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 122.091 1.86 . . . . 70.43 112.602 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -75.88 -9.32 58.51 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 116.434 -0.348 . . . . 64.43 111.159 178.593 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 98.5 p -53.91 116.68 2.67 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 121.407 0.622 . . . . 63.2 112.267 -176.176 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 57.8 tp -95.09 117.43 30.17 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.156 -0.474 . . . . 64.03 111.006 177.061 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 50.3 mm -78.73 -54.23 12.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-O 120.909 0.385 . . . . 74.53 110.944 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 36.9 t -168.94 162.14 11.03 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.024 0.44 . . . . 74.04 111.729 179.051 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.699 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 40.6 mt-10 -116.85 138.12 51.73 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 116.003 -0.544 . . . . 72.34 110.887 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 50.4 m80 -143.25 147.27 39.81 Favored Pre-proline 0 N--CA 1.472 0.647 0 CA-C-O 120.597 0.236 . . . . 71.31 111.102 178.074 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -77.38 -4.37 14.64 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.571 2.181 . . . . 61.31 113.268 -178.407 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 31.1 p -128.0 144.4 51.1 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 120.831 0.348 . . . . 74.04 111.185 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.409 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -66.37 -33.71 76.34 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 120.829 0.347 . . . . 52.13 111.104 177.43 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.67 -52.13 64.9 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 116.264 -0.425 . . . . 75.03 111.116 179.331 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -58.32 -41.0 83.57 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.063 0.459 . . . . 74.01 111.533 177.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.75 -38.65 88.76 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.938 0.399 . . . . 63.02 111.27 178.12 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.468 ' O ' ' HG3' ' A' ' 55' ' ' LYS . 66.2 mtt -68.48 -43.51 76.76 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 116.277 -0.42 . . . . 74.2 110.884 176.344 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -54.68 -44.11 73.07 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.274 0.559 . . . . 74.21 111.236 177.097 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.07 -39.16 75.79 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 116.155 -0.475 . . . . 71.14 111.56 176.42 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.537 ' HE2' ' O ' ' A' ' 11' ' ' ALA . 62.2 tttm -56.09 -50.09 72.0 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 121.081 0.467 . . . . 75.14 110.928 177.723 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 51' ' ' MET . 62.7 mttm -61.15 -47.65 85.26 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.983 -0.553 . . . . 72.21 111.241 179.479 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 41.9 ttp180 -65.69 -25.18 67.21 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 115.969 -0.559 . . . . 73.01 111.713 -177.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.741 ' HA ' ' HG2' ' A' ' 63' ' ' GLU . 77.6 t80 -79.0 -51.58 9.4 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 121.131 0.491 . . . . 71.02 111.339 176.728 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -67.4 -32.43 73.33 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 116.351 -0.386 . . . . 73.22 111.75 -177.171 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -95.84 108.91 43.45 Favored Pre-proline 0 CA--C 1.536 0.432 0 N-CA-C 110.134 -0.321 . . . . 61.33 110.134 171.252 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -46.08 98.55 0.03 OUTLIER 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 122.741 2.294 . . . . 63.23 113.234 -177.529 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -145.37 -53.13 0.28 Allowed 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.32 -0.4 . . . . 64.21 111.753 -177.502 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -164.15 96.76 0.8 Allowed 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 120.825 0.345 . . . . 64.54 110.767 -178.487 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.741 ' HG2' ' HA ' ' A' ' 57' ' ' TYR . 29.2 mt-10 -117.52 -179.43 3.73 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.274 0.472 . . . . 71.33 112.274 -173.49 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.42 ' N ' HD12 ' A' ' 64' ' ' LEU . 5.1 mp -124.45 110.1 14.1 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 116.506 -0.316 . . . . 74.45 111.087 179.698 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -115.7 -175.66 2.77 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.151 0.5 . . . . 74.53 111.39 177.518 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 34.5 p-80 -172.38 91.72 0.11 Allowed 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.645 -0.707 . . . . 62.25 110.605 171.569 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 8.3 p-80 -76.82 70.6 3.29 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 121.572 0.701 . . . . 53.31 111.691 -178.412 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -144.4 113.66 6.97 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.263 -0.88 . . . . 74.34 110.114 176.034 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 51.8 m170 -74.37 150.31 40.12 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 121.061 0.458 . . . . 60.41 111.643 -178.872 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -135.95 147.09 47.93 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.071 -0.513 . . . . 74.23 110.871 177.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 78.5 t60 . . . . . 0 C--O 1.251 1.133 0 CA-C-O 118.774 -0.631 . . . . 75.23 111.458 -177.933 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.589 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.8 OUTLIER . . . . . 0 N--CA 1.488 1.43 0 N-CA-C 111.665 0.246 . . . . 63.42 111.665 . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -59.63 115.99 2.98 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 122.3 2.0 . . . . 62.24 111.74 174.161 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 85.0 m -113.08 117.13 31.12 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.187 0.44 . . . . 72.1 112.187 -175.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -91.73 148.24 36.78 Favored Pre-proline 0 CA--C 1.54 0.563 0 CA-C-N 116.38 -0.373 . . . . 72.52 111.252 176.199 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -65.18 152.29 82.69 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 121.922 1.748 . . . . 51.5 110.843 166.725 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -71.84 -5.73 17.69 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 121.987 1.791 . . . . 54.3 113.649 -176.506 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 51.81 87.21 0.14 Allowed Pre-proline 0 CA--C 1.542 0.64 0 CA-C-O 120.922 0.391 . . . . 74.34 111.545 -175.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -51.36 112.72 0.87 Allowed 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 122.934 2.423 . . . . 75.51 112.95 -179.409 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.44 144.79 29.36 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 116.152 -0.476 . . . . 65.22 111.337 -176.795 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -124.53 157.17 35.99 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 121.123 0.487 . . . . 71.21 111.91 -179.533 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -138.7 -174.85 3.94 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 116.174 -0.466 . . . . 63.41 111.7 -179.303 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -159.56 169.66 23.34 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.92 0.39 . . . . 75.4 111.325 179.381 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.9 mt -112.12 139.15 38.11 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 CA-C-O 120.995 0.426 . . . . 74.11 111.7 179.411 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.515 HG21 ' HD2' ' A' ' 31' ' ' ARG . 89.3 t -115.62 136.31 52.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 CA-C-N 116.444 -0.344 . . . . 71.52 110.79 175.863 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 50.7 p -104.09 113.2 26.57 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 112.184 0.439 . . . . 71.24 112.184 -178.498 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 38.8 pt -114.06 168.09 6.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 CA-C-N 116.432 -0.349 . . . . 61.43 110.994 176.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -126.12 134.68 51.27 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 121.218 0.532 . . . . 74.15 111.611 -177.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -129.15 160.24 33.49 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 116.231 -0.441 . . . . 72.42 111.294 178.765 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.52 -137.22 13.13 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 121.132 -0.556 . . . . 61.13 113.91 177.393 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -87.66 144.28 35.05 Favored Pre-proline 0 N--CA 1.469 0.507 0 O-C-N 122.682 -0.305 . . . . 63.3 111.64 -176.172 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -50.81 -43.78 44.81 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 122.987 2.458 . . . . 75.22 113.685 -177.654 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.08 -61.23 3.31 Favored Glycine 0 CA--C 1.526 0.725 0 C-N-CA 121.117 -0.564 . . . . 44.51 112.747 179.62 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -100.06 84.09 2.8 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.111 0.481 . . . . 64.51 111.161 178.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 48.2 p -85.69 159.13 19.88 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.405 0.622 . . . . 64.33 111.936 178.44 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 57.4 t -109.3 124.11 65.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 CA-C-N 115.899 -0.591 . . . . 74.44 109.983 173.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 85.8 m -80.91 115.27 20.31 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.11 0.481 . . . . 74.42 111.643 -178.035 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 60.7 m95 -105.75 131.25 53.33 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.027 -0.533 . . . . 74.34 110.999 176.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 51.9 m-85 -97.09 114.18 25.82 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.138 -0.483 . . . . 62.14 111.087 -178.153 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.534 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 87.7 mt-30 -91.83 108.81 20.18 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.223 -0.444 . . . . 70.51 111.186 176.531 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.0 tp -71.1 109.54 5.23 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.026 0.441 . . . . 61.01 110.434 172.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.515 ' HD2' HG21 ' A' ' 14' ' ' VAL . 58.5 mtt180 -125.17 158.11 34.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.145 0.498 . . . . 74.2 111.406 -178.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -118.14 157.44 26.92 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.236 -0.438 . . . . 72.52 110.325 172.397 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.439 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 29.4 t70 -86.82 -20.12 28.01 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.441 0.638 . . . . 75.34 110.486 174.918 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 48.5 m80 -126.65 138.78 33.19 Favored Pre-proline 0 CA--C 1.542 0.644 0 CA-C-N 115.9 -0.591 . . . . 61.4 110.858 -179.084 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -82.69 -1.34 52.59 Favored 'Cis proline' 0 CA--C 1.542 0.882 0 C-N-CA 124.292 -1.128 . . . . 74.2 113.417 0.011 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -136.99 142.77 39.68 Favored Pre-proline 0 N--CA 1.469 0.515 0 CA-C-N 116.311 -0.404 . . . . 71.11 110.409 177.381 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.439 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 55.6 Cg_endo -71.15 -37.13 6.33 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 122.264 1.976 . . . . 71.31 112.817 -177.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -89.0 24.44 2.09 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.984 -0.448 . . . . 74.32 111.725 176.703 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.9 p -65.26 97.38 0.27 Allowed 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.223 0.535 . . . . 75.1 110.904 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 37.7 tp -78.85 102.83 8.41 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 120.99 0.424 . . . . 63.01 111.143 -178.53 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 39.3 mm -84.33 -47.86 17.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-O 120.983 0.42 . . . . 73.34 111.205 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 43.7 t -164.3 157.08 17.28 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 116.426 -0.352 . . . . 74.13 111.945 -178.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.534 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 45.2 mt-10 -130.36 125.03 33.61 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 122.453 0.301 . . . . 75.34 110.816 176.256 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 78.3 m-70 -139.6 146.17 46.71 Favored Pre-proline 0 N--CA 1.473 0.71 0 CA-C-O 120.693 0.283 . . . . 72.2 111.615 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -76.28 -12.14 19.12 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.573 2.182 . . . . 65.31 113.411 -176.053 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 32.2 p -118.54 142.89 47.16 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 120.897 0.38 . . . . 63.22 111.219 178.46 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.73 -33.21 75.34 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 120.612 0.244 . . . . 50.14 111.401 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 26.0 tp60 -53.85 -48.17 70.24 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.471 -0.331 . . . . 71.54 111.505 177.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -62.73 -42.67 99.77 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.889 0.376 . . . . 74.15 111.545 177.635 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.58 -43.94 92.27 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.333 -0.394 . . . . 65.41 111.575 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 90.8 mtp -67.08 -39.21 86.77 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.362 -0.381 . . . . 74.41 111.399 179.229 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.421 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 37.9 t70 -63.56 -40.35 96.77 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 120.961 0.41 . . . . 70.32 111.157 177.405 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -75.49 -32.8 60.68 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 116.132 -0.486 . . . . 52.22 111.433 177.453 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -59.55 -52.21 66.54 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.471 -0.331 . . . . 60.23 111.242 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' 52' ' ' ASP . 19.3 pttm -58.45 -25.97 62.82 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.383 0.611 . . . . 75.12 110.985 177.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -78.08 -44.78 25.29 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.8 -0.637 . . . . 74.34 111.397 -179.019 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -68.32 -37.03 80.16 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.915 0.388 . . . . 75.31 111.377 178.158 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -78.56 13.87 1.47 Allowed 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.436 -0.347 . . . . 63.14 111.915 -178.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -108.39 92.84 10.44 Favored Pre-proline 0 CA--C 1.544 0.742 0 N-CA-C 110.118 -0.327 . . . . 71.05 110.118 175.647 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -87.32 13.33 2.7 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 122.571 2.181 . . . . 53.53 113.02 -179.13 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -109.99 -44.41 3.79 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 112.26 0.467 . . . . 52.15 112.26 -173.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.585 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 0.6 OUTLIER -93.39 117.62 30.3 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.615 0.598 . . . . 53.31 112.615 -174.179 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -125.52 157.42 37.09 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 116.061 -0.518 . . . . 75.32 110.095 171.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.473 ' N ' HD23 ' A' ' 64' ' ' LEU . 1.8 pt? -146.66 145.9 30.19 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.257 0.551 . . . . 73.12 112.045 -176.177 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -81.91 80.38 8.2 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 112.66 0.615 . . . . 74.44 112.66 -173.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 28.7 m170 -132.96 -52.12 0.91 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 116.19 -0.459 . . . . 53.44 110.617 173.207 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -137.29 131.1 31.79 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 116.221 -0.445 . . . . 72.03 111.027 178.646 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 32.3 t-80 -67.43 104.24 1.5 Allowed 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 109.79 -0.448 . . . . 74.31 109.79 176.274 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 32.9 p-80 -76.69 30.2 0.13 Allowed 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.23 0.826 . . . . 73.24 113.23 -169.737 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 49.8 t-80 -158.79 141.02 13.97 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 122.19 -0.319 . . . . 75.3 110.988 177.009 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 71.7 m80 . . . . . 0 C--O 1.25 1.124 0 CA-C-O 118.652 -0.69 . . . . 75.41 111.131 177.017 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.2 mtm . . . . . 0 N--CA 1.487 1.402 0 CA-C-O 120.855 0.36 . . . . 64.41 110.658 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -79.04 151.05 23.6 Favored 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 122.785 2.324 . . . . 65.51 113.506 -175.403 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 5.0 t -82.98 81.41 8.67 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.66 0.743 . . . . 74.5 110.273 174.23 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -64.37 112.16 7.11 Favored Pre-proline 0 CA--C 1.545 0.785 0 N-CA-C 113.235 0.828 . . . . 74.05 113.235 -170.255 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -94.65 159.14 1.89 Allowed 'Trans proline' 0 CA--C 1.548 1.198 0 C-N-CA 123.347 2.698 . . . . 65.45 113.025 175.288 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -90.51 142.34 3.47 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 122.91 2.407 . . . . 71.25 112.879 175.454 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -90.42 121.43 68.47 Favored Pre-proline 0 CA--C 1.541 0.627 0 CA-C-O 120.659 0.266 . . . . 72.21 110.979 179.273 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.463 ' HB2' ' H ' ' A' ' 9' ' ' ARG . 72.8 Cg_endo -74.4 -146.09 0.03 OUTLIER 'Trans proline' 0 CA--C 1.549 1.246 0 C-N-CA 122.89 2.393 . . . . 71.34 113.504 -179.271 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.463 ' H ' ' HB2' ' A' ' 8' ' ' PRO . 0.3 OUTLIER -152.84 85.48 1.24 Allowed 'General case' 0 CA--C 1.547 0.852 0 CA-C-O 121.368 0.604 . . . . 64.31 111.603 -173.772 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -85.96 139.04 31.55 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.418 0.525 . . . . 62.23 112.418 -176.862 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.51 160.42 21.77 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.086 -0.506 . . . . 74.23 111.594 178.45 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 50.6 p90 -142.59 145.38 33.49 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.471 -0.331 . . . . 72.12 110.819 177.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 62.2 mt -104.01 131.32 53.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-O 121.074 0.464 . . . . 75.42 111.838 -178.728 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 63.0 t -116.03 125.49 73.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 CA-C-N 116.246 -0.434 . . . . 51.13 111.043 177.397 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 42.9 p -87.19 120.84 28.88 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 120.975 0.417 . . . . 73.45 111.39 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.452 HD13 ' NE2' ' A' ' 29' ' ' GLN . 35.1 pt -118.08 166.9 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-O 120.863 0.363 . . . . 73.4 111.348 178.387 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.436 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 44.0 mt-10 -125.1 114.82 19.56 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.494 -0.321 . . . . 62.23 110.865 178.486 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -122.45 174.16 7.21 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 116.608 -0.269 . . . . 64.32 111.661 -177.758 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.71 -136.89 12.94 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 121.013 -0.613 . . . . 73.13 112.808 -178.67 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -79.21 153.91 77.04 Favored Pre-proline 0 CA--C 1.539 0.545 0 O-C-N 122.469 -0.43 . . . . 70.34 111.22 178.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -57.78 -44.23 42.71 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.396 2.064 . . . . 74.31 112.474 176.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -82.89 -46.01 6.46 Favored Glycine 0 CA--C 1.528 0.853 0 C-N-CA 121.301 -0.476 . . . . 43.21 112.839 177.107 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -96.83 79.5 2.94 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.1 0.476 . . . . 74.43 111.286 178.171 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.436 ' HB ' ' HB3' ' A' ' 17' ' ' GLU . 69.3 p -88.23 146.18 25.49 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.969 -0.56 . . . . 74.01 111.54 178.194 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 54.8 t -109.47 128.6 65.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.917 -0.583 . . . . 73.44 110.33 174.689 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 94.6 m -79.21 114.22 17.97 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.135 0.493 . . . . 65.3 111.082 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -110.07 131.29 55.19 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 116.146 -0.479 . . . . 74.25 111.52 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -93.28 114.21 26.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.834 0.35 . . . . 74.35 110.538 176.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.816 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 72.9 mt-30 -98.01 113.65 25.56 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.412 -0.358 . . . . 70.15 111.668 -179.342 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 54.8 tp -79.53 116.72 19.91 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.352 -0.385 . . . . 74.41 110.513 174.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.426 HH11 ' HD3' ' A' ' 31' ' ' ARG . 51.7 mtt180 -129.26 170.5 13.53 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.869 0.366 . . . . 71.14 111.97 -177.231 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -136.01 167.09 21.88 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.981 0.42 . . . . 73.52 111.129 175.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -95.53 -9.74 31.57 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 112.271 0.471 . . . . 74.04 112.271 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 39.9 m80 -142.81 149.53 50.18 Favored Pre-proline 0 CA--C 1.541 0.606 0 O-C-N 122.357 -0.214 . . . . 54.42 110.95 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -70.54 -21.98 10.61 Favored 'Cis proline' 0 C--N 1.356 0.95 0 C-N-CA 124.392 -1.087 . . . . 70.43 113.244 -0.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -118.55 135.28 23.57 Favored Pre-proline 0 N--CA 1.47 0.557 0 CA-C-N 116.705 -0.225 . . . . 73.02 110.708 176.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.0 -27.21 84.37 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 122.219 1.946 . . . . 64.11 111.592 174.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -77.77 -2.39 36.09 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 115.2 -0.909 . . . . 74.23 112.504 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 90.2 p -58.44 110.46 0.98 Allowed 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.271 0.558 . . . . 73.31 112.327 -173.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 56.4 tp -104.03 114.45 28.71 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.918 -0.583 . . . . 71.41 110.463 176.082 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.3 mm -83.64 -53.6 10.91 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 116.288 -0.415 . . . . 74.34 111.935 -177.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.413 ' HG ' ' CD2' ' A' ' 44' ' ' HIS . 40.6 t -162.78 157.53 21.64 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.389 0.514 . . . . 64.24 112.389 -175.58 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.816 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 37.4 mt-10 -120.96 118.41 29.79 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 116.243 -0.435 . . . . 73.02 110.753 177.135 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' HIS . . . . . 0.413 ' CD2' ' HG ' ' A' ' 42' ' ' SER . 61.8 m170 -123.49 143.6 41.9 Favored Pre-proline 0 N--CA 1.475 0.791 0 O-C-N 122.375 -0.203 . . . . 74.0 111.278 -178.707 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -70.1 -22.93 29.85 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 122.632 2.221 . . . . 44.15 114.13 -176.627 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.461 ' OG1' ' HB2' ' A' ' 49' ' ' GLU . 59.6 p -120.74 153.78 36.52 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.11 0.481 . . . . 71.51 111.508 178.826 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.17 -45.32 70.31 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.262 -0.426 . . . . 65.12 111.811 -177.407 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -55.81 -50.58 70.14 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 120.954 0.407 . . . . 64.32 110.637 179.346 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.461 ' HB2' ' OG1' ' A' ' 46' ' ' THR . 0.7 OUTLIER -56.28 -39.59 72.92 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 121.357 0.599 . . . . 73.31 110.45 178.718 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.74 -41.29 75.47 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 116.292 -0.413 . . . . 45.34 111.857 177.395 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 85.1 mtp -67.59 -34.67 77.49 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 112.075 0.398 . . . . 65.54 112.075 -178.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.656 ' HA ' ' HE3' ' A' ' 55' ' ' LYS . 4.6 t70 -64.5 -30.86 71.89 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-O 121.128 0.489 . . . . 75.03 110.934 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -75.88 -40.3 54.78 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.343 0.592 . . . . 72.43 110.618 170.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 66.4 tttm -54.84 -47.51 74.06 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 115.563 -0.744 . . . . 75.32 111.691 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.656 ' HE3' ' HA ' ' A' ' 52' ' ' ASP . 18.6 ptpt -57.71 -38.86 75.98 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 116.558 -0.292 . . . . 74.53 111.521 179.347 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.475 ' HG2' ' HB2' ' A' ' 62' ' ' LYS . 80.1 ttt180 -73.79 -26.02 60.42 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 120.821 0.343 . . . . 74.42 111.798 -178.562 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -73.33 -51.27 18.08 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 120.854 0.359 . . . . 74.31 110.999 175.567 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -73.02 -34.51 66.4 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.241 -0.436 . . . . 64.1 112.096 -176.159 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -100.43 171.89 5.08 Favored Pre-proline 0 CA--C 1.549 0.906 0 CA-C-N 116.365 -0.38 . . . . 51.13 111.434 179.198 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -60.49 -171.45 0.07 OUTLIER 'Trans proline' 0 CA--C 1.547 1.136 0 C-N-CA 122.6 2.2 . . . . 73.21 113.56 174.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.9 t70 77.81 19.49 1.13 Allowed 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.701 0.801 . . . . 73.42 111.091 -175.679 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.475 ' HB2' ' HG2' ' A' ' 56' ' ' ARG . 64.4 tttp -140.05 145.56 37.86 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.806 -0.634 . . . . 65.41 110.712 175.837 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -70.94 158.18 36.91 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.308 0.575 . . . . 74.35 112.135 178.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.42 HD22 ' N ' ' A' ' 64' ' ' LEU . 3.2 mm? -70.19 129.03 38.29 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.966 -0.561 . . . . 51.41 111.249 178.597 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.42 ' H ' ' CD ' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -81.18 -30.22 34.41 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 120.95 0.405 . . . . 65.01 111.735 -177.654 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 35.2 t-80 -104.91 69.52 0.87 Allowed 'General case' 0 CA--C 1.547 0.854 0 CA-C-O 120.996 0.427 . . . . 72.11 110.87 -178.019 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 -87.94 10.99 16.95 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-O 121.085 0.469 . . . . 75.35 112.193 -174.129 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 27.3 m80 -138.64 135.45 34.89 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 122.437 0.295 . . . . 74.13 110.772 174.664 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 8.0 p80 -149.28 95.49 2.38 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 113.036 0.754 . . . . 71.52 113.036 -177.535 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 33.3 p80 -97.82 179.63 4.74 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 116.159 -0.473 . . . . 60.33 110.392 170.412 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 20.9 p80 . . . . . 0 C--O 1.251 1.161 0 CA-C-O 119.58 -0.247 . . . . 75.23 111.629 176.934 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.8 mtt . . . . . 0 N--CA 1.49 1.527 0 CA-C-O 120.608 0.242 . . . . 75.21 110.834 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -62.12 103.96 0.32 Allowed 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 122.675 2.25 . . . . 74.12 113.363 -178.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 68.5 p -87.58 140.32 29.65 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 116.57 -0.286 . . . . 74.2 111.38 178.328 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.524 ' N ' ' HD3' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -146.26 108.63 4.22 Favored Pre-proline 0 CA--C 1.545 0.772 0 CA-C-O 121.012 0.434 . . . . 73.44 111.74 -178.092 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.424 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 65.5 Cg_endo -87.5 150.45 7.67 Favored 'Trans proline' 0 CA--C 1.545 1.065 0 C-N-CA 122.889 2.393 . . . . 63.22 113.226 176.799 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 5' ' ' PRO . 51.3 Cg_exo -55.56 153.94 27.09 Favored 'Trans proline' 0 CA--C 1.544 0.99 0 C-N-CA 122.912 2.408 . . . . 43.24 113.308 178.384 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.4 p90 -62.47 132.27 94.24 Favored Pre-proline 0 CA--C 1.544 0.745 0 N-CA-C 112.285 0.476 . . . . 72.41 112.285 -178.404 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -74.94 116.03 4.47 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 122.565 2.177 . . . . 73.21 112.441 174.79 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.7 ptp85 -78.09 154.19 31.54 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.666 0.617 . . . . 65.44 112.666 -175.368 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.54 ' HA ' ' HG2' ' A' ' 58' ' ' GLU . 13.2 pt-20 -132.63 165.52 24.24 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.147 -0.479 . . . . 71.43 110.736 172.689 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.449 ' HB2' ' CD2' ' A' ' 57' ' ' TYR . . . -124.29 171.87 9.54 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 120.794 0.33 . . . . 70.32 111.534 179.259 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 36.9 p90 -147.36 157.62 43.65 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.139 0.495 . . . . 71.31 111.923 178.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 58.6 mt -100.4 137.26 28.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 CA-C-N 116.073 -0.512 . . . . 74.15 111.838 -177.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 61.1 t -117.07 127.44 74.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-N 116.163 -0.471 . . . . 64.24 110.571 177.256 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 65.1 p -95.06 114.41 26.21 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.017 0.437 . . . . 73.51 111.861 -178.562 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.4 pt -121.51 172.18 9.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 121.021 0.439 . . . . 51.12 111.259 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.405 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 1.6 mp0 -128.91 148.84 50.95 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 120.856 0.36 . . . . 61.15 111.057 177.806 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -134.15 166.68 22.21 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-O 120.844 0.354 . . . . 70.43 111.441 178.307 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.53 -143.17 16.17 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 121.234 -0.508 . . . . 71.43 113.734 178.145 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -81.26 142.93 51.43 Favored Pre-proline 0 N--CA 1.471 0.577 0 O-C-N 122.575 -0.368 . . . . 71.04 111.636 -178.716 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -53.44 116.93 3.3 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.371 2.048 . . . . 63.13 112.365 176.324 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 97.61 -67.41 0.8 Allowed Glycine 0 CA--C 1.526 0.751 0 C-N-CA 121.249 -0.501 . . . . 61.12 112.283 -174.37 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -80.95 75.56 7.91 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 121.361 0.6 . . . . 74.43 110.277 176.677 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.405 ' HB ' ' HB3' ' A' ' 17' ' ' GLU . 64.7 p -107.84 163.91 12.71 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.596 -0.729 . . . . 61.42 112.895 -173.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 59.0 t -110.14 127.65 66.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-N 115.489 -0.778 . . . . 74.43 110.201 171.271 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 51.4 m -82.26 118.86 23.44 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.402 0.519 . . . . 72.23 112.402 -175.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 67.7 m95 -110.37 149.42 30.27 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.191 -0.458 . . . . 75.5 111.512 178.217 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -110.2 114.63 28.27 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.878 0.371 . . . . 74.14 111.193 178.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.721 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 72.8 mt-30 -95.59 121.57 37.43 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.919 0.39 . . . . 75.14 111.542 178.23 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.6 tp -83.02 109.89 17.5 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.571 -0.286 . . . . 71.52 110.322 173.788 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 53.2 mtt180 -123.4 162.17 23.3 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.448 0.642 . . . . 71.24 112.184 -178.672 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -140.83 -179.35 6.01 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.516 -0.765 . . . . 65.53 110.72 175.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.511 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 20.4 m-20 -103.1 -0.98 29.87 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.203 0.525 . . . . 54.44 111.209 175.512 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -123.72 129.54 24.79 Favored Pre-proline 0 CA--C 1.544 0.725 0 CA-C-N 116.354 -0.384 . . . . 71.51 111.066 -178.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -78.76 -14.86 30.23 Favored 'Cis proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.757 -1.351 . . . . 60.42 113.206 -1.408 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -129.03 143.32 48.31 Favored Pre-proline 0 N--CA 1.472 0.663 0 C-N-CA 122.445 0.298 . . . . 61.24 111.101 -178.723 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.511 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 53.8 Cg_exo -54.54 -28.9 57.43 Favored 'Trans proline' 0 CA--C 1.545 1.073 0 C-N-CA 122.338 2.025 . . . . 42.32 113.023 174.26 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -88.98 16.64 6.7 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-O 121.03 0.443 . . . . 63.04 111.309 177.07 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 83.1 p -66.52 96.13 0.36 Allowed 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.45 0.643 . . . . 63.24 111.474 -179.458 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 56.7 tp -87.26 107.6 18.57 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.071 -0.513 . . . . 73.31 110.539 176.081 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 44.0 mm -73.47 -53.96 16.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 120.914 0.388 . . . . 75.24 111.054 178.775 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 70.1 m -163.55 149.94 11.87 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 120.953 0.406 . . . . 70.11 111.691 -178.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.721 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 42.4 mt-10 -108.2 119.22 38.85 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 116.181 -0.463 . . . . 74.5 110.511 174.883 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' HIS . . . . . 0.49 ' HB3' ' HB2' ' A' ' 49' ' ' GLU . 37.7 m170 -128.23 151.14 75.8 Favored Pre-proline 0 CA--C 1.543 0.696 0 N-CA-C 112.187 0.439 . . . . 55.33 112.187 -176.608 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.35 -31.89 8.71 Favored 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 122.857 2.371 . . . . 73.54 114.358 -176.669 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.449 ' OG1' ' HG2' ' A' ' 49' ' ' GLU . 43.9 p -115.06 152.05 33.18 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.192 0.52 . . . . 65.05 111.886 -177.266 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.48 -29.94 70.29 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.009 -0.541 . . . . 55.04 110.758 175.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 25.0 tp60 -59.09 -51.33 70.52 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.475 -0.33 . . . . 63.2 111.281 175.543 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.49 ' HB2' ' HB3' ' A' ' 44' ' ' HIS . 78.9 mm-40 -62.96 -30.93 71.96 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.086 0.469 . . . . 54.22 111.475 178.591 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.89 -47.93 34.49 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.392 -0.367 . . . . 62.44 111.35 177.634 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 90.1 mmm -64.59 -43.43 93.87 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 112.307 0.484 . . . . 74.32 112.307 -178.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.513 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 16.8 t70 -59.31 -51.14 71.24 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.821 0.343 . . . . 73.42 111.11 -179.343 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.39 -36.45 84.01 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.273 0.559 . . . . 64.11 111.296 176.434 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.521 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 43.7 tttp -53.94 -49.96 67.53 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.855 -0.612 . . . . 75.24 111.469 176.824 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -65.71 -27.02 68.03 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.231 0.456 . . . . 74.42 112.231 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.513 ' HG3' ' O ' ' A' ' 52' ' ' ASP . 44.9 mtt180 -72.94 -29.08 62.82 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 120.943 0.402 . . . . 75.04 111.073 177.259 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.449 ' CD2' ' HB2' ' A' ' 11' ' ' ALA . 89.5 t80 -77.35 -37.05 53.11 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.287 0.565 . . . . 75.44 110.849 174.125 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.54 ' HG2' ' HA ' ' A' ' 10' ' ' GLU . 56.6 mt-10 -76.97 -25.45 52.8 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.006 -0.543 . . . . 65.15 111.639 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -119.07 96.75 50.35 Favored Pre-proline 0 CA--C 1.54 0.571 0 CA-C-O 120.698 0.285 . . . . 62.4 110.345 175.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -64.83 76.66 0.2 Allowed 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 122.839 2.359 . . . . 71.31 112.828 -177.686 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -90.93 -58.91 2.31 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 116.137 -0.483 . . . . 75.41 111.287 179.399 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 40.5 ttpt -75.37 -73.09 0.27 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 120.737 0.303 . . . . 72.34 111.44 179.363 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -165.32 -173.47 2.84 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 116.592 -0.277 . . . . 75.42 110.583 179.535 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.498 ' N ' HD23 ' A' ' 64' ' ' LEU . 1.7 pt? -146.3 103.34 3.69 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 121.237 0.541 . . . . 64.42 111.605 178.819 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -64.86 102.49 0.6 Allowed 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 121.293 0.568 . . . . 72.24 110.884 179.479 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 31.5 p-80 -105.3 141.14 37.34 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 112.731 0.641 . . . . 71.14 112.731 -169.605 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 53.4 t-80 50.1 95.46 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 113.416 0.895 . . . . 70.31 113.416 176.719 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 28.5 p80 -161.67 166.69 26.38 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.192 0.52 . . . . 61.03 112.205 176.142 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -57.5 141.86 46.2 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 115.648 -0.706 . . . . 61.24 112.133 -179.51 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 9.8 m-70 -76.07 91.28 3.1 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 110.139 -0.319 . . . . 74.5 110.139 175.421 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 51.7 t-80 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 119.471 -0.299 . . . . 63.4 111.482 -178.803 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.697 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 121.124 0.488 . . . . 71.54 112.106 . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -105.84 52.3 0.02 OUTLIER 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 123.844 3.029 . . . . 71.24 113.113 175.535 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.563 ' O ' ' HB2' ' A' ' 4' ' ' LYS . 74.9 p -81.26 55.02 2.42 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.774 0.657 . . . . 64.4 112.774 -174.428 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.563 ' HB2' ' O ' ' A' ' 3' ' ' THR . 4.0 ttpm? 169.24 91.55 0.03 OUTLIER Pre-proline 0 N--CA 1.477 0.917 0 C-N-CA 123.931 0.892 . . . . 65.04 109.692 170.51 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.42 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 89.3 Cg_endo -77.01 157.73 34.32 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 122.744 2.296 . . . . 71.2 113.667 -174.887 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 5' ' ' PRO . 19.7 Cg_exo -67.03 -174.86 0.53 Allowed 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.75 2.3 . . . . 65.3 112.593 174.737 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.3 t80 68.95 95.06 0.05 OUTLIER Pre-proline 0 N--CA 1.474 0.757 0 CA-C-O 121.104 0.478 . . . . 65.01 111.477 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -82.47 167.78 15.05 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 122.537 2.158 . . . . 63.11 112.747 176.886 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.556 ' H ' ' HD3' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -130.9 132.85 45.38 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.813 0.339 . . . . 70.25 110.844 177.619 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -151.16 109.32 3.74 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.249 -0.432 . . . . 61.22 110.518 179.204 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -93.31 153.84 18.33 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.914 0.388 . . . . 74.13 110.838 178.788 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 45.2 p90 -141.09 159.34 42.41 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.188 0.518 . . . . 74.54 111.569 -179.29 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 67.2 mt -99.74 138.05 25.33 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-N 115.947 -0.569 . . . . 65.53 111.511 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 59.2 t -119.95 121.16 65.27 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 122.509 0.323 . . . . 75.43 110.766 176.592 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 32.5 p -86.77 112.59 21.84 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.463 0.542 . . . . 45.35 112.463 -178.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.5 pt -113.92 175.87 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-N 116.296 -0.411 . . . . 71.4 110.523 175.027 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -138.53 128.43 25.26 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.125 0.488 . . . . 74.31 111.44 179.778 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -115.67 159.9 20.75 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 116.531 -0.304 . . . . 63.43 111.561 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.56 -153.74 19.29 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 121.294 -0.479 . . . . 63.15 113.845 178.633 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -79.84 155.49 75.46 Favored Pre-proline 0 CA--C 1.54 0.566 0 O-C-N 122.668 -0.313 . . . . 73.44 111.294 -176.289 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -52.97 -37.68 78.66 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 122.487 2.125 . . . . 70.03 113.002 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -84.69 -48.08 5.11 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 121.106 -0.569 . . . . 74.14 112.619 175.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -99.46 83.38 2.8 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.224 0.535 . . . . 65.54 111.691 178.654 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 75.2 p -99.64 155.89 17.36 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.769 -0.65 . . . . 74.11 111.457 175.59 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 48.8 t -116.97 128.08 74.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 CA-C-N 116.089 -0.505 . . . . 63.34 110.246 174.572 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 36.1 m -74.44 115.35 13.87 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.762 0.315 . . . . 62.22 111.444 -179.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 67.3 m95 -113.53 131.08 56.21 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.086 0.469 . . . . 65.21 111.265 177.517 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -100.76 114.13 27.62 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.109 -0.496 . . . . 74.01 110.813 -179.365 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.457 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 78.0 mt-30 -96.29 120.58 36.85 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.885 0.374 . . . . 75.15 111.637 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 55.9 tp -83.3 107.48 15.86 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 120.737 0.304 . . . . 72.02 110.259 175.196 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 54.4 mtt180 -120.92 166.28 14.03 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.158 0.504 . . . . 72.31 111.787 -178.143 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -139.02 158.57 43.96 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.935 -0.575 . . . . 72.2 111.114 178.179 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -80.8 -21.72 40.67 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 116.521 -0.309 . . . . 71.32 111.686 -179.448 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -112.27 144.3 30.55 Favored Pre-proline 0 CA--C 1.542 0.65 0 N-CA-C 111.573 0.212 . . . . 73.01 111.573 -177.096 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -74.67 -28.47 7.44 Favored 'Cis proline' 0 CA--C 1.542 0.881 0 C-N-CA 123.794 -1.336 . . . . 63.32 112.98 -4.292 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.403 ' HB3' ' HD2' ' A' ' 37' ' ' PRO . 58.1 mttp -131.23 160.28 67.76 Favored Pre-proline 0 CA--C 1.541 0.603 0 C-N-CA 122.426 0.29 . . . . 51.44 110.941 176.028 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.403 ' HD2' ' HB3' ' A' ' 36' ' ' LYS . 28.8 Cg_endo -61.43 -7.03 7.84 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 C-N-CA 122.573 2.182 . . . . 62.43 113.173 177.451 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -77.79 -7.12 56.15 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.554 -0.294 . . . . 72.41 111.422 176.329 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 68.6 m -65.44 92.17 0.13 Allowed 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.523 0.564 . . . . 74.22 112.523 -175.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 48.7 tp -100.06 105.11 16.73 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.067 -0.515 . . . . 74.1 109.974 172.464 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.5 ' N ' HD12 ' A' ' 41' ' ' ILE . 2.3 mp -71.06 -53.87 19.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 CA-C-N 116.383 -0.371 . . . . 61.42 111.397 -175.885 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 71.1 p -169.58 149.8 3.98 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.178 0.513 . . . . 62.12 111.397 -179.712 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.457 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 45.2 mt-10 -100.56 140.66 34.5 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.274 -0.421 . . . . 75.43 110.795 177.843 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 83.0 m-70 -136.74 135.91 20.89 Favored Pre-proline 0 CA--C 1.538 0.516 0 O-C-N 122.219 -0.301 . . . . 72.2 111.183 -178.158 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.0 -5.57 16.47 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 122.594 2.196 . . . . 64.41 113.58 -179.472 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 35.8 p -136.14 155.08 50.7 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-O 120.933 0.397 . . . . 45.21 111.345 177.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.55 -41.14 89.13 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.287 -0.415 . . . . 74.22 111.725 178.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 20.1 tp60 -56.55 -51.68 67.67 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 111.396 0.147 . . . . 70.44 111.396 177.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -61.39 -29.09 69.71 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 120.93 0.395 . . . . 62.42 111.82 179.144 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.54 -47.45 40.76 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 120.889 0.376 . . . . 72.32 111.464 176.05 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 65.6 mtt -65.89 -35.9 81.92 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.008 0.432 . . . . 61.23 111.451 178.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -60.52 -49.93 75.58 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.34 0.59 . . . . 64.33 110.37 176.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.27 -39.32 94.25 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.803 -0.635 . . . . 60.43 111.758 176.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 44.1 tttp -54.76 -48.55 72.49 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.709 0.29 . . . . 72.14 111.76 178.088 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 47.4 mtmt -61.56 -48.75 79.57 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.179 0.514 . . . . 63.44 111.223 177.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 45.2 mtp180 -65.5 -26.07 67.75 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.944 -0.571 . . . . 65.2 111.97 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -71.21 -46.95 60.1 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.965 0.412 . . . . 75.14 111.214 176.245 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -81.49 -21.64 38.53 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 112.387 0.514 . . . . 63.25 112.387 -178.408 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 -122.28 78.65 44.35 Favored Pre-proline 0 CA--C 1.544 0.717 0 CA-C-O 120.768 0.318 . . . . 75.41 111.146 175.154 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -75.83 88.13 1.33 Allowed 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 122.579 2.186 . . . . 75.11 112.766 178.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -90.27 -23.68 21.14 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.832 0.349 . . . . 55.43 111.418 176.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.485 ' HA ' ' HE2' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -74.52 170.9 14.79 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 120.881 0.372 . . . . 73.24 111.675 -178.831 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -74.66 152.14 39.21 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 112.811 0.671 . . . . 71.45 112.811 -178.197 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.503 ' N ' HD12 ' A' ' 64' ' ' LEU . 5.2 mp -75.82 150.15 37.74 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.523 -0.762 . . . . 70.04 111.1 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -73.52 179.14 4.22 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.211 0.529 . . . . 73.23 111.751 178.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 52.0 m-70 -119.42 149.2 42.26 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.52 -0.309 . . . . 73.03 111.184 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 71.01 -40.09 0.47 Allowed 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.034 0.753 . . . . 75.03 113.034 178.778 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 52.3 m170 -60.34 103.0 0.2 Allowed 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.924 0.393 . . . . 73.3 110.622 176.229 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 19.8 p-80 -92.48 28.56 1.94 Allowed 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 121.079 0.466 . . . . 71.55 112.018 -174.497 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 78.9 t60 -65.34 139.23 58.56 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.338 -0.392 . . . . 72.52 111.442 176.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 19.4 p-80 . . . . . 0 C--O 1.25 1.117 0 CA-C-O 119.476 -0.297 . . . . 73.54 111.578 175.675 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.5 ptp . . . . . 0 N--CA 1.489 1.521 0 CA-C-O 120.477 0.179 . . . . 74.21 111.254 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -82.71 88.1 1.29 Allowed 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 122.45 2.1 . . . . 74.44 112.506 176.376 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 83.2 m -77.51 93.88 4.22 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.159 0.504 . . . . 62.43 111.53 -179.062 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -144.44 89.43 6.88 Favored Pre-proline 0 CA--C 1.539 0.551 0 CA-C-N 116.069 -0.514 . . . . 73.44 109.923 176.135 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -79.79 124.14 5.53 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 122.858 2.372 . . . . 31.45 112.836 179.141 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.405 ' O ' ' HD3' ' A' ' 8' ' ' PRO . 40.2 Cg_endo -66.06 170.81 11.1 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 122.366 2.044 . . . . 63.25 112.112 175.696 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -79.87 115.64 55.44 Favored Pre-proline 0 CA--C 1.543 0.71 0 N-CA-C 112.15 0.426 . . . . 65.22 112.15 -175.873 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.405 ' HD3' ' O ' ' A' ' 6' ' ' PRO . 72.9 Cg_endo -91.3 139.77 2.5 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.003 2.469 . . . . 65.41 111.891 172.152 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.451 ' HD3' ' CZ ' ' A' ' 57' ' ' TYR . 91.8 mtt-85 -93.23 144.24 25.49 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 112.578 0.585 . . . . 75.32 112.578 -176.101 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -130.72 128.26 40.49 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.682 -0.69 . . . . 45.52 110.849 178.372 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -131.61 154.66 48.66 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 116.161 -0.472 . . . . 64.05 110.706 178.295 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 13.1 p90 -135.11 146.13 48.54 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.272 0.558 . . . . 72.02 111.932 -177.701 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 62.9 mt -91.06 117.35 34.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 115.81 -0.632 . . . . 61.13 111.359 -177.356 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.54 HG21 ' HD2' ' A' ' 31' ' ' ARG . 61.9 t -105.61 126.63 60.86 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 CA-C-O 120.782 0.325 . . . . 41.11 111.277 -179.203 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 66.4 p -93.53 115.71 28.22 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 120.763 0.316 . . . . 74.45 111.228 178.319 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 42.3 pt -111.69 166.86 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 CA-C-O 121.004 0.431 . . . . 62.34 111.61 -179.304 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -115.34 114.98 25.85 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.257 -0.429 . . . . 64.4 111.787 -177.305 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -108.8 165.12 11.8 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 122.095 -0.378 . . . . 71.53 110.677 174.782 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.3 -137.09 13.06 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 121.024 -0.608 . . . . 55.45 113.652 -179.371 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -102.17 158.54 31.58 Favored Pre-proline 0 N--CA 1.473 0.684 0 N-CA-C 112.032 0.382 . . . . 75.14 112.032 -175.194 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -60.69 124.31 14.76 Favored 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 122.18 1.92 . . . . 71.15 111.714 173.617 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 89.27 -47.8 3.35 Favored Glycine 0 CA--C 1.525 0.692 0 C-N-CA 120.859 -0.686 . . . . 71.44 112.406 -176.158 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -99.08 79.15 2.31 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.347 0.594 . . . . 74.12 110.41 175.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 77.6 p -107.84 156.56 19.02 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.684 -0.689 . . . . 60.15 112.371 -175.661 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 63.6 t -113.27 132.31 62.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-N 115.639 -0.709 . . . . 71.44 110.359 175.223 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 95.0 m -79.73 117.28 20.49 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 120.912 0.387 . . . . 72.15 111.833 -179.427 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 76.9 m95 -114.87 131.62 56.79 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 116.377 -0.374 . . . . 74.55 111.163 175.48 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -92.81 114.73 27.36 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.946 0.403 . . . . 75.22 111.131 -178.305 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.64 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 86.0 mt-30 -102.08 130.13 48.58 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.472 -0.331 . . . . 73.11 111.393 177.447 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.8 tp -87.51 104.51 16.54 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.779 0.323 . . . . 65.43 110.441 174.521 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.54 ' HD2' HG21 ' A' ' 14' ' ' VAL . 86.5 mtt180 -111.48 154.72 24.3 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.555 -0.293 . . . . 63.43 110.953 179.079 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.29 140.25 51.49 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 120.574 0.226 . . . . 74.41 111.375 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -62.62 -24.54 67.64 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.157 0.429 . . . . 73.25 112.157 -179.148 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.482 ' HA ' ' C ' ' A' ' 35' ' ' PRO . 83.5 m-70 -122.18 134.22 24.69 Favored Pre-proline 0 CA--C 1.541 0.633 0 O-C-N 122.329 -0.232 . . . . 73.03 111.154 179.654 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.482 ' C ' ' HA ' ' A' ' 34' ' ' HIS . 22.2 Cg_exo -65.42 -42.12 0.66 Allowed 'Cis proline' 0 C--N 1.358 1.037 0 C-N-CA 124.643 -0.982 . . . . 70.14 113.709 3.393 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -137.0 145.85 52.27 Favored Pre-proline 0 N--CA 1.471 0.59 0 O-C-N 122.376 -0.202 . . . . 65.11 110.688 178.062 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -50.84 -22.0 9.28 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 C-N-CA 122.933 2.422 . . . . 73.42 113.914 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -84.23 10.89 9.23 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-O 121.052 0.453 . . . . 40.2 111.677 178.385 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 66.5 m -81.1 100.31 8.97 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.098 0.475 . . . . 55.42 111.109 178.006 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.401 HD13 ' HB3' ' A' ' 29' ' ' GLN . 56.3 tp -87.1 116.52 25.22 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.193 -0.458 . . . . 73.43 111.366 -179.721 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 47.8 mm -76.76 -54.87 12.31 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-O 120.663 0.268 . . . . 74.54 110.835 176.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 64.0 m -165.8 154.1 11.12 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.603 0.361 . . . . 73.32 111.404 179.009 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.64 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 50.8 mt-10 -100.31 150.11 22.92 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.03 0.443 . . . . 72.31 111.448 176.409 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' HIS . . . . . 0.466 ' ND1' ' HB3' ' A' ' 49' ' ' GLU . 89.7 m-70 -147.08 142.2 16.73 Favored Pre-proline 0 CA--C 1.542 0.649 0 CA-C-N 116.454 -0.339 . . . . 65.53 111.215 176.931 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -74.6 -25.09 13.08 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 122.31 2.006 . . . . 72.2 113.243 177.662 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 31.2 p -114.9 151.01 34.74 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-O 121.179 0.514 . . . . 75.41 111.737 -179.311 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.23 -44.25 92.44 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.062 -0.517 . . . . 73.21 112.303 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 24.0 tp60 -53.45 -42.56 67.27 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 111.744 0.275 . . . . 70.52 111.744 -179.086 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.466 ' HB3' ' ND1' ' A' ' 44' ' ' HIS . 47.1 mt-10 -61.31 -43.13 99.39 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.899 0.38 . . . . 73.31 111.342 176.087 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.08 -43.67 97.9 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.059 0.457 . . . . 74.13 111.385 178.416 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 58.6 mtt -63.76 -38.12 89.92 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.336 0.589 . . . . 71.14 110.958 176.152 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.453 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 34.0 t70 -62.95 -51.85 65.31 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.761 -0.654 . . . . 73.52 110.971 177.592 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.16 -42.72 86.56 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 116.091 -0.504 . . . . 71.32 111.443 177.285 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -55.65 -49.79 71.96 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.243 -0.435 . . . . 73.21 111.052 175.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 23.5 mtpp -60.06 -28.97 68.23 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.305 -0.407 . . . . 63.54 112.056 178.418 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.453 ' HG3' ' O ' ' A' ' 52' ' ' ASP . 72.7 mtt180 -73.58 -40.68 63.71 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 122.062 -0.399 . . . . 62.44 110.561 176.439 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.451 ' CZ ' ' HD3' ' A' ' 9' ' ' ARG . 79.3 t80 -63.5 -33.32 75.33 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.341 0.591 . . . . 73.33 110.523 176.408 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -80.53 -34.37 35.62 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.909 -0.587 . . . . 74.12 111.836 176.127 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -132.5 74.86 74.73 Favored Pre-proline 0 CA--C 1.544 0.717 0 CA-C-O 120.962 0.411 . . . . 65.32 111.177 -176.006 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -99.08 101.61 0.06 OUTLIER 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 123.211 2.607 . . . . 61.35 113.908 -179.113 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -82.57 1.12 39.62 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.273 0.559 . . . . 71.23 110.912 172.052 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 32.3 mmmt -85.41 150.7 24.54 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.975 -0.557 . . . . 73.15 111.309 178.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 67.55 11.06 8.19 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 113.168 0.803 . . . . 73.35 113.168 172.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 89.8 mt -65.06 159.53 23.03 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.738 0.304 . . . . 70.24 110.834 176.593 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -77.7 96.83 4.96 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 112.954 0.724 . . . . 72.34 112.954 -174.788 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 28.6 p-80 -84.9 132.8 34.33 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 109.29 -0.633 . . . . 71.22 109.29 170.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 17.1 p80 -146.57 79.41 1.53 Allowed 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.612 0.597 . . . . 71.44 112.612 -175.701 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 32.6 m80 65.8 -68.37 0.12 Allowed 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 113.203 0.816 . . . . 63.11 113.203 173.437 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 41.3 t60 -54.85 102.42 0.06 Allowed 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 112.192 0.442 . . . . 74.42 112.192 -177.295 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -82.54 -61.08 1.98 Allowed 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.249 0.547 . . . . 41.35 111.227 177.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 71.8 t60 . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.742 -0.647 . . . . 73.42 111.31 -178.943 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.3 mtt . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 120.533 0.206 . . . . 75.43 111.31 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -80.26 159.71 23.16 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.401 2.067 . . . . 61.24 112.116 172.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 73.5 p -71.78 131.17 42.7 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 111.931 0.345 . . . . 64.4 111.931 -179.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt 64.38 89.38 0.1 Allowed Pre-proline 0 N--CA 1.476 0.834 0 C-N-CA 123.064 0.546 . . . . 64.35 112.38 179.166 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.62 159.42 48.84 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.641 2.227 . . . . 53.31 112.757 179.215 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_exo -67.24 160.46 47.48 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 122.624 2.216 . . . . 52.12 113.053 177.808 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 52.4 p90 -65.17 147.97 98.21 Favored Pre-proline 0 CA--C 1.544 0.72 0 CA-C-O 120.83 0.347 . . . . 72.33 111.75 178.074 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -69.18 153.75 71.12 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 122.485 2.123 . . . . 74.44 112.94 178.479 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.2 tpp85 -80.41 143.72 33.24 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.135 0.493 . . . . 74.12 111.791 -178.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -127.7 146.72 50.47 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 116.286 -0.415 . . . . 75.5 111.282 178.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -145.54 155.05 42.83 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.395 -0.366 . . . . 72.12 111.012 176.309 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 40.5 p90 -149.36 161.54 41.87 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.14 0.495 . . . . 75.31 111.628 -178.153 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 65.4 mt -101.89 136.86 31.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-O 121.077 0.465 . . . . 74.13 112.106 -177.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.439 HG21 ' HD2' ' A' ' 31' ' ' ARG . 98.4 t -119.07 126.38 75.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 116.353 -0.385 . . . . 72.32 110.802 176.391 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 46.8 p -86.64 114.42 23.33 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.587 0.232 . . . . 74.13 111.615 -179.137 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.513 HD13 ' NE2' ' A' ' 29' ' ' GLN . 37.8 pt -112.83 168.91 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 CA-C-O 121.19 0.519 . . . . 75.34 111.872 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -114.59 124.84 52.87 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.756 -0.656 . . . . 54.13 111.416 -179.674 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -119.25 159.61 23.75 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.764 0.316 . . . . 73.4 110.932 172.19 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.26 -146.21 17.6 Favored Glycine 0 CA--C 1.528 0.868 0 C-N-CA 121.314 -0.469 . . . . 65.52 113.401 -179.44 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -95.22 148.96 35.5 Favored Pre-proline 0 N--CA 1.471 0.606 0 N-CA-C 112.088 0.403 . . . . 73.34 112.088 -175.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -56.49 124.35 16.04 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.201 1.934 . . . . 65.12 112.065 176.225 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 95.17 -52.79 1.86 Allowed Glycine 0 CA--C 1.527 0.786 0 C-N-CA 121.133 -0.556 . . . . 73.25 112.384 -174.922 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 31.4 mm-40 -99.8 64.8 1.28 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.148 0.499 . . . . 64.31 110.882 176.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 59.9 p -92.05 167.63 11.95 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.376 0.608 . . . . 73.32 112.43 -175.79 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 60.8 t -124.34 124.7 69.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 CA-C-N 115.707 -0.679 . . . . 74.44 109.95 175.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 94.4 m -77.46 114.86 16.73 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.123 0.487 . . . . 43.03 112.015 -177.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 72.6 m95 -110.58 140.47 44.87 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.926 -0.579 . . . . 74.11 110.784 175.336 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -97.74 113.76 25.6 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 120.884 0.373 . . . . 74.0 111.298 -177.387 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.661 ' HG2' ' HG3' ' A' ' 43' ' ' GLU . 79.4 mt-30 -91.5 125.85 36.39 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.815 0.341 . . . . 71.3 111.362 177.726 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 60.4 tp -83.25 116.92 22.62 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.664 0.268 . . . . 74.11 110.495 173.536 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.439 ' HD2' HG21 ' A' ' 14' ' ' VAL . 99.0 mtt180 -126.94 164.7 20.88 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 120.926 0.393 . . . . 73.31 111.217 178.214 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -139.82 140.15 36.53 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.504 -0.316 . . . . 71.11 111.094 176.738 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.468 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 29.0 t70 -61.05 -38.61 86.78 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.313 0.578 . . . . 42.45 110.869 177.337 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 -105.96 130.54 22.84 Favored Pre-proline 0 CA--C 1.541 0.611 0 CA-C-N 116.105 -0.498 . . . . 72.02 110.392 177.09 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -77.45 -34.49 3.27 Favored 'Cis proline' 0 CA--C 1.545 1.033 0 C-N-CA 123.885 -1.298 . . . . 72.52 114.156 3.505 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -130.76 130.96 22.99 Favored Pre-proline 0 N--CA 1.474 0.766 0 O-C-N 122.393 -0.192 . . . . 73.51 110.943 -178.54 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.468 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 91.2 Cg_exo -45.47 -51.34 8.1 Favored 'Trans proline' 0 CA--C 1.542 0.916 0 C-N-CA 123.419 2.746 . . . . 41.01 114.49 -174.814 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -79.34 24.67 0.34 Allowed 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 112.703 0.631 . . . . 64.3 112.703 -177.35 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 45.2 p -66.6 89.77 0.15 Allowed 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.161 0.505 . . . . 74.53 111.413 177.661 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 38.2 tp -72.7 104.1 3.83 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 120.887 0.375 . . . . 64.21 111.476 178.087 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.3 mm -74.88 -54.1 15.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 116.272 -0.422 . . . . 73.32 110.754 175.429 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 29.3 t -175.76 149.87 0.99 Allowed 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 116.351 -0.386 . . . . 53.13 111.904 -178.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.661 ' HG3' ' HG2' ' A' ' 29' ' ' GLN . 1.9 mp0 -89.39 125.99 35.37 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 116.534 -0.303 . . . . 70.01 110.381 173.525 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 11.9 m170 -116.52 146.93 38.61 Favored Pre-proline 0 CA--C 1.542 0.638 0 C-N-CA 122.574 0.349 . . . . 61.02 111.008 179.519 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -67.0 -40.37 11.94 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.827 2.352 . . . . 75.24 114.173 -173.797 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.517 ' OG1' ' HB2' ' A' ' 49' ' ' GLU . 29.9 p -120.37 153.51 36.4 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 122.064 -0.398 . . . . 61.15 111.243 -179.435 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.21 -41.71 79.95 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 120.896 0.379 . . . . 74.31 111.251 178.02 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -61.27 -43.75 98.37 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 116.288 -0.415 . . . . 74.02 110.752 176.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.517 ' HB2' ' OG1' ' A' ' 46' ' ' THR . 0.6 OUTLIER -61.44 -33.1 73.16 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.343 0.592 . . . . 53.4 110.727 178.524 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.96 -42.76 56.99 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 116.212 -0.449 . . . . 71.23 111.371 176.436 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.557 ' SD ' ' HD3' ' A' ' 54' ' ' LYS . 22.2 mmt -57.29 -35.74 70.18 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 116.313 -0.403 . . . . 63.22 111.753 176.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -54.47 -43.83 72.06 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 116.133 -0.485 . . . . 75.32 111.088 177.765 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.08 -40.08 53.94 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.158 0.504 . . . . 50.44 111.408 175.802 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.557 ' HD3' ' SD ' ' A' ' 51' ' ' MET . 42.3 tttp -53.89 -49.76 67.84 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 115.872 -0.603 . . . . 75.53 112.004 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 60.6 mttp -53.7 -57.97 8.9 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 111.844 0.312 . . . . 64.52 111.844 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 53.0 mtp180 -62.24 -26.4 68.36 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 112.003 0.371 . . . . 63.3 112.003 -178.33 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.534 ' HA ' ' HB2' ' A' ' 62' ' ' LYS . 60.6 t80 -71.45 -34.47 70.28 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.002 0.43 . . . . 75.41 110.936 176.847 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.44 ' HG3' ' O ' ' A' ' 54' ' ' LYS . 44.1 mt-10 -86.25 -20.19 28.83 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.086 -0.507 . . . . 70.21 111.48 179.549 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -76.25 163.96 63.02 Favored Pre-proline 0 CA--C 1.543 0.68 0 CA-C-N 116.398 -0.365 . . . . 73.02 110.855 172.793 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -68.33 4.93 1.38 Allowed 'Trans proline' 0 CA--C 1.544 1.012 0 C-N-CA 122.265 1.976 . . . . 74.22 112.278 172.035 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -69.03 -37.09 78.41 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.219 0.608 . . . . 74.11 111.179 177.669 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.534 ' HB2' ' HA ' ' A' ' 57' ' ' TYR . 14.7 tppt? -72.31 156.52 39.02 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.276 0.56 . . . . 74.42 112.306 -175.063 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -82.02 167.42 18.86 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.596 0.712 . . . . 74.34 111.981 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.511 ' N ' HD23 ' A' ' 64' ' ' LEU . 1.1 pt? -130.57 70.17 1.45 Allowed 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 121.653 0.74 . . . . 73.4 110.432 178.138 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -79.55 81.75 5.77 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.227 0.537 . . . . 71.32 111.447 -176.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 36.9 t-80 -92.87 14.58 17.01 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 116.083 -0.508 . . . . 72.23 111.91 -177.212 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 84.1 m-70 -123.98 104.23 8.78 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.844 -0.535 . . . . 74.51 111.605 178.551 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 39.9 m80 -146.69 164.84 31.43 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.028 0.442 . . . . 61.12 111.001 177.287 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 31.7 m80 -124.11 100.67 6.83 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 120.858 0.361 . . . . 64.04 110.401 175.097 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 17.8 m-70 -139.18 130.88 27.42 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.852 0.358 . . . . 73.21 111.881 -178.186 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 32.4 m80 . . . . . 0 C--O 1.252 1.23 0 CA-C-O 119.214 -0.422 . . . . 74.42 110.798 172.338 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.9 mtt . . . . . 0 N--CA 1.489 1.512 0 N-CA-C 110.728 -0.101 . . . . 54.23 110.728 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -70.87 131.37 19.53 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 C-N-CA 122.367 2.044 . . . . 74.41 112.979 -179.27 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 31.9 p -76.27 -22.06 55.54 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 116.493 -0.321 . . . . 75.22 111.483 177.429 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt 67.62 91.85 0.07 OUTLIER Pre-proline 0 N--CA 1.472 0.663 0 N-CA-C 112.586 0.587 . . . . 72.31 112.586 171.708 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_exo -72.98 148.64 45.55 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 122.675 2.25 . . . . 71.23 112.304 174.486 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.88 60.92 4.6 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 122.401 2.067 . . . . 71.13 113.07 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 34.4 t80 63.49 97.52 0.04 OUTLIER Pre-proline 0 CA--C 1.543 0.694 0 C-N-CA 123.182 0.593 . . . . 71.42 112.247 -177.409 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_exo -72.55 110.49 3.0 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 122.618 2.212 . . . . 72.34 112.126 176.093 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.2 mpt_? -64.35 137.64 58.01 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 120.917 0.389 . . . . 65.43 111.368 -178.592 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.47 ' HA ' ' HG2' ' A' ' 58' ' ' GLU . 42.1 tt0 -133.53 150.51 51.67 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.975 0.417 . . . . 73.03 111.698 -178.756 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.434 ' O ' ' NZ ' ' A' ' 54' ' ' LYS . . . -124.89 175.06 7.54 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.049 -0.523 . . . . 72.13 110.96 177.415 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 41.2 p90 -148.47 153.09 38.0 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.098 0.475 . . . . 74.24 111.693 177.162 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 63.5 mt -101.66 135.51 37.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 116.107 -0.497 . . . . 74.33 111.557 -176.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.404 HG21 ' HD2' ' A' ' 31' ' ' ARG . 61.6 t -119.28 138.71 49.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-N 116.585 -0.28 . . . . 74.13 111.23 178.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 80.3 p -101.24 117.33 34.77 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 120.522 0.201 . . . . 73.24 111.506 178.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.499 HD13 ' NE2' ' A' ' 29' ' ' GLN . 42.8 pt -120.11 168.47 12.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-O 120.871 0.367 . . . . 72.53 111.614 178.573 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.408 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 47.4 mt-10 -116.12 126.87 54.3 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 116.357 -0.383 . . . . 62.12 111.193 177.233 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.425 ' HE3' HD12 ' A' ' 16' ' ' ILE . 95.1 mttt -130.4 166.63 20.06 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.781 0.325 . . . . 74.54 111.329 176.039 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.08 -136.88 12.94 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 121.186 -0.531 . . . . 53.45 113.164 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.422 ' HB2' ' HB2' ' A' ' 23' ' ' GLN . 75.5 mmtt -75.27 147.01 82.39 Favored Pre-proline 0 CA--C 1.539 0.52 0 O-C-N 122.437 -0.449 . . . . 74.21 111.332 179.093 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_exo -53.06 -46.89 30.73 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 122.781 2.32 . . . . 74.03 113.076 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -84.33 -52.91 3.42 Favored Glycine 0 CA--C 1.526 0.745 0 C-N-CA 121.118 -0.563 . . . . 73.24 112.825 175.246 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.422 ' HB2' ' HB2' ' A' ' 20' ' ' LYS . 32.9 mm-40 -83.81 77.27 9.92 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.119 0.485 . . . . 62.21 111.032 177.131 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.408 ' HB ' ' HB3' ' A' ' 17' ' ' GLU . 53.0 p -88.4 152.12 22.12 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.182 0.515 . . . . 65.43 111.745 179.839 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 58.0 t -114.84 129.4 71.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.033 -0.531 . . . . 62.32 109.976 174.272 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 31.2 m -75.36 115.58 15.17 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 120.697 0.284 . . . . 72.54 111.498 -179.298 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 77.9 m95 -106.58 132.3 52.74 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.053 0.454 . . . . 64.42 110.877 175.501 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -97.17 114.5 26.21 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.298 0.57 . . . . 64.01 111.138 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.735 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 95.5 mt-30 -97.46 122.29 40.33 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.678 -0.692 . . . . 73.03 111.723 -178.698 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.9 tp -83.24 109.87 17.59 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 120.788 0.328 . . . . 71.42 110.299 171.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.404 ' HD2' HG21 ' A' ' 14' ' ' VAL . 87.5 mtt-85 -121.41 158.63 27.9 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.053 0.454 . . . . 71.3 111.728 -178.635 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -146.01 146.49 31.01 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.241 -0.436 . . . . 73.21 111.211 178.259 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.495 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 3.9 m-20 -62.67 -22.6 66.59 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.058 0.456 . . . . 72.05 111.847 177.801 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.555 ' HA ' ' C ' ' A' ' 35' ' ' PRO . 35.3 m80 -125.82 141.39 39.18 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-N 116.365 -0.379 . . . . 75.55 110.52 179.064 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.555 ' C ' ' HA ' ' A' ' 34' ' ' HIS . 31.7 Cg_exo -59.93 -56.62 0.13 OUTLIER 'Cis proline' 0 N--CA 1.49 1.293 0 CA-C-N 119.662 0.915 . . . . 64.53 114.368 4.135 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -109.68 147.4 36.05 Favored Pre-proline 0 N--CA 1.471 0.576 0 O-C-N 122.231 -0.293 . . . . 73.43 111.229 179.011 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.495 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 75.9 Cg_exo -50.6 -31.13 30.62 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 122.948 2.432 . . . . 74.15 113.809 -179.344 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -98.74 20.87 12.25 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 120.839 0.352 . . . . 73.23 111.682 -179.61 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.4 t -72.42 107.4 4.97 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.019 0.437 . . . . 62.43 111.665 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 36.1 tp -92.48 109.82 21.22 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 116.114 -0.493 . . . . 64.52 111.027 177.051 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.8 mm -73.71 -54.61 14.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 116.115 -0.493 . . . . 74.23 111.747 -177.045 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.0 t -164.13 149.46 10.52 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 112.3 0.482 . . . . 71.12 112.3 -176.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.735 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 88.3 mt-10 -108.93 139.34 43.92 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.277 -0.419 . . . . 71.43 110.856 175.915 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 89.6 m-70 -138.77 140.32 26.97 Favored Pre-proline 0 CA--C 1.538 0.503 0 O-C-N 122.3 -0.25 . . . . 75.24 111.531 178.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -71.86 -24.13 21.47 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 122.458 2.105 . . . . 52.42 113.517 -179.267 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 30.4 p -113.07 143.7 43.89 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 121.085 0.469 . . . . 64.12 111.713 179.504 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.95 -34.69 73.6 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.053 -0.521 . . . . 73.4 111.9 177.005 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -56.5 -48.96 76.07 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 120.577 0.227 . . . . 72.31 110.894 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -58.66 -42.5 88.56 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.092 0.472 . . . . 63.13 111.199 177.424 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.71 -41.25 98.13 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.939 -0.573 . . . . 71.03 111.726 -179.781 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 67.1 mtt -65.06 -49.31 70.6 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 120.934 0.397 . . . . 55.52 111.004 177.379 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.547 ' HA ' ' HE2' ' A' ' 55' ' ' LYS . 11.2 m-20 -57.67 -41.29 81.24 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 121.056 0.455 . . . . 73.05 111.767 176.161 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.79 -43.42 93.26 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.953 0.406 . . . . 71.41 111.026 177.339 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.434 ' NZ ' ' O ' ' A' ' 11' ' ' ALA . 59.5 tttp -60.48 -52.43 65.23 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 116.316 -0.402 . . . . 62.14 111.781 178.673 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.547 ' HE2' ' HA ' ' A' ' 52' ' ' ASP . 63.7 pttt -64.81 -33.92 77.14 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 120.938 0.399 . . . . 75.13 111.567 -179.147 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 51.6 ttt180 -77.89 -26.29 49.08 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.948 0.404 . . . . 65.13 111.001 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -72.27 -43.26 64.55 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.05 0.452 . . . . 75.2 110.855 175.558 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.47 ' HG2' ' HA ' ' A' ' 10' ' ' GLU . 81.0 mt-10 -75.6 -33.64 60.56 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.935 -0.575 . . . . 73.4 111.849 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.5 m-20 -112.38 80.3 3.4 Favored Pre-proline 0 CA--C 1.544 0.739 0 CA-C-O 120.859 0.362 . . . . 71.32 111.162 175.729 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -81.04 131.98 8.18 Favored 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 122.426 2.084 . . . . 65.43 113.349 -176.654 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -92.01 12.69 21.03 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.965 -0.561 . . . . 73.15 110.599 178.21 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.0 tptt -153.85 161.01 42.39 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.325 -0.398 . . . . 70.43 110.696 -174.352 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 64.18 30.6 13.62 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-O 121.058 0.456 . . . . 75.52 112.09 175.696 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 96.5 mt -80.52 85.44 5.95 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.439 -0.346 . . . . 63.43 111.522 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 50.9 tt0 -63.81 107.85 1.31 Allowed 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.89 0.376 . . . . 52.44 110.49 175.613 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -81.55 154.49 26.21 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.984 0.421 . . . . 75.52 111.599 -176.165 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 20.4 p-80 -60.7 125.96 25.65 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.128 0.49 . . . . 72.32 111.888 -179.712 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 51.9 t-80 -75.93 138.54 41.08 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.285 -0.416 . . . . 73.21 110.689 178.781 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 48.3 t-80 -46.62 117.42 1.62 Allowed 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 120.965 0.412 . . . . 70.55 111.777 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 28.5 t60 -55.08 128.79 35.35 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 115.87 -0.605 . . . . 60.51 112.13 -176.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 . . . . . 0 C--O 1.251 1.148 0 CA-C-O 118.603 -0.713 . . . . 51.04 111.876 -179.848 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.3 mtt . . . . . 0 N--CA 1.489 1.488 0 CA-C-O 120.298 0.094 . . . . 73.22 110.888 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_exo -62.72 129.61 26.86 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 122.391 2.061 . . . . 75.14 112.583 177.262 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 68.8 p -68.97 96.34 0.77 Allowed 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.127 0.489 . . . . 51.0 110.971 177.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt 69.65 138.55 0.06 OUTLIER Pre-proline 0 CA--C 1.546 0.795 0 CA-C-N 115.761 -0.654 . . . . 74.21 110.882 -172.67 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_exo -44.52 128.44 8.31 Favored 'Trans proline' 0 CA--C 1.545 1.026 0 C-N-CA 123.309 2.673 . . . . 73.23 114.517 -172.429 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -68.61 149.63 74.04 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 122.519 2.146 . . . . 51.2 111.983 175.366 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -88.35 115.71 64.07 Favored Pre-proline 0 CA--C 1.542 0.665 0 N-CA-C 112.247 0.462 . . . . 73.25 112.247 -176.186 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -80.4 131.68 8.68 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 122.584 2.19 . . . . 74.02 111.958 172.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.42 ' HB2' ' O ' ' A' ' 57' ' ' TYR . 86.8 mtm180 -95.04 157.88 15.7 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 120.762 0.315 . . . . 75.35 111.295 -178.175 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -132.04 140.9 49.04 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 120.674 0.273 . . . . 71.13 111.318 -179.192 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.489 ' O ' ' HE2' ' A' ' 54' ' ' LYS . . . -140.95 162.31 35.77 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 120.87 0.367 . . . . 61.13 111.889 -179.337 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -151.63 149.63 29.35 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.097 0.475 . . . . 63.15 111.63 178.757 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 60.2 mt -101.56 134.49 41.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-N 116.35 -0.386 . . . . 73.42 111.895 -176.299 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.4 t -129.18 122.85 57.12 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 116.289 -0.414 . . . . 64.25 110.49 176.062 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 45.9 p -86.91 129.45 34.88 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 120.817 0.341 . . . . 74.1 111.579 -178.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.51 HD13 ' NE2' ' A' ' 29' ' ' GLN . 43.3 pt -113.33 175.07 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-O 120.955 0.407 . . . . 72.15 111.423 178.039 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.453 ' HB2' ' HB ' ' A' ' 24' ' ' THR . 9.4 pt-20 -118.16 129.83 55.74 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 121.231 0.538 . . . . 71.11 111.754 178.905 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -124.97 178.51 5.47 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 116.384 -0.371 . . . . 53.3 110.933 175.198 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 84.29 -136.79 15.11 Favored Glycine 0 CA--C 1.526 0.733 0 C-N-CA 120.927 -0.654 . . . . 74.52 114.414 172.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -74.63 150.0 86.38 Favored Pre-proline 0 CA--C 1.542 0.635 0 N-CA-C 112.053 0.39 . . . . 60.35 112.053 -173.409 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -58.68 -38.07 91.06 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 122.701 2.267 . . . . 53.41 112.957 179.087 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -92.3 -52.14 2.25 Favored Glycine 0 CA--C 1.524 0.642 0 C-N-CA 121.173 -0.537 . . . . 71.01 112.492 177.57 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -93.35 80.87 4.41 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.493 0.663 . . . . 73.35 110.818 177.722 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.453 ' HB ' ' HB2' ' A' ' 17' ' ' GLU . 71.7 p -80.75 151.17 28.96 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.457 -0.792 . . . . 61.2 111.816 179.602 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 53.7 t -108.54 136.46 44.15 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 CA-C-N 116.176 -0.466 . . . . 72.33 110.852 -179.363 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 67.6 m -85.28 120.07 26.35 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.068 0.461 . . . . 71.12 112.125 -175.468 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 61.6 m95 -119.66 131.62 55.48 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.047 0.451 . . . . 70.41 111.28 175.286 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -91.57 114.71 27.31 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 116.358 -0.383 . . . . 62.3 111.187 -178.383 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.55 ' HG2' ' HG3' ' A' ' 43' ' ' GLU . 72.4 mt-30 -95.82 120.31 35.86 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.562 -0.29 . . . . 73.41 111.571 177.687 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 55.2 tp -85.67 103.47 14.51 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.872 0.368 . . . . 51.34 110.426 173.324 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 55.4 mtt180 -106.5 141.85 37.12 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.464 -0.334 . . . . 71.23 110.325 178.169 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.415 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . . . -109.6 167.9 9.8 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.808 0.67 . . . . 74.45 112.808 -173.275 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -77.36 -54.48 6.41 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 115.631 -0.713 . . . . 71.13 111.98 -176.762 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.537 ' HB3' ' HA ' ' A' ' 35' ' ' PRO . 32.2 m170 -123.43 164.05 30.59 Favored Pre-proline 0 CA--C 1.547 0.83 0 C-N-CA 122.597 0.359 . . . . 63.41 110.929 178.694 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.537 ' HA ' ' HB3' ' A' ' 34' ' ' HIS . 36.8 Cg_endo -64.76 -50.16 0.17 OUTLIER 'Cis proline' 0 C--N 1.362 1.278 0 C-N-CA 124.825 -0.906 . . . . 61.3 113.572 1.158 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -98.6 149.05 35.36 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 122.169 0.188 . . . . 75.03 110.548 173.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -67.87 -14.9 42.76 Favored 'Trans proline' 0 CA--C 1.537 0.64 0 C-N-CA 122.212 1.942 . . . . 73.03 112.502 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -88.61 1.05 55.72 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.98 -0.555 . . . . 71.15 111.874 -179.759 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 64.0 m -56.78 92.52 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 112.259 0.466 . . . . 72.23 112.259 -175.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 49.6 tp -83.88 107.23 16.14 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 116.265 -0.425 . . . . 72.52 110.508 176.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 45.0 mm -69.44 -53.7 23.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 116.312 -0.404 . . . . 64.13 111.641 -177.884 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.9 t -175.24 149.64 1.08 Allowed 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 121.038 0.447 . . . . 63.41 112.01 -179.555 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.55 ' HG3' ' HG2' ' A' ' 29' ' ' GLN . 2.2 mp0 -100.42 130.81 46.55 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 116.044 -0.525 . . . . 75.04 110.595 176.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -134.95 147.04 61.13 Favored Pre-proline 0 N--CA 1.473 0.69 0 CA-C-O 120.839 0.352 . . . . 62.14 111.584 -179.047 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.84 -18.59 19.04 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 122.825 2.35 . . . . 60.1 114.146 -174.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 30.6 p -116.88 151.67 36.1 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.093 0.473 . . . . 71.32 111.399 179.522 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.34 -36.46 74.24 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.302 -0.408 . . . . 74.2 111.824 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 24.6 tp60 -56.8 -42.02 78.79 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.529 -0.305 . . . . 61.02 111.767 -177.833 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -59.23 -51.07 71.55 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 121.094 0.473 . . . . 64.23 111.35 176.414 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.07 -37.74 88.52 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.982 -0.553 . . . . 73.32 111.689 -178.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 95.1 mmm -68.28 -44.83 74.68 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 116.511 -0.313 . . . . 62.44 111.642 178.441 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -61.74 -48.58 80.05 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.05 0.452 . . . . 55.15 110.701 178.022 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.37 -33.84 76.42 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 116.029 -0.532 . . . . 64.02 111.452 177.073 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.489 ' HE2' ' O ' ' A' ' 11' ' ' ALA . 65.7 tttm -61.82 -57.34 12.22 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.91 0.386 . . . . 73.22 110.503 175.793 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -55.77 -44.65 77.88 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.205 -0.452 . . . . 70.22 111.297 178.528 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -61.11 -44.49 97.27 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.092 -0.504 . . . . 74.21 111.526 178.333 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.42 ' O ' ' HB2' ' A' ' 9' ' ' ARG . 80.5 t80 -67.04 -38.9 86.67 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 116.373 -0.376 . . . . 75.12 111.375 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.464 ' HG3' ' O ' ' A' ' 54' ' ' LYS . 56.5 mt-10 -72.31 -5.41 35.95 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.371 0.508 . . . . 72.31 112.371 -176.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 68.4 m-20 -84.28 144.91 44.47 Favored Pre-proline 0 CA--C 1.544 0.733 0 O-C-N 122.375 -0.203 . . . . 54.32 110.891 169.213 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.77 84.45 1.03 Allowed 'Trans proline' 0 CA--C 1.542 0.897 0 C-N-CA 122.05 1.833 . . . . 64.23 111.517 172.732 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -65.44 -70.92 0.21 Allowed 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.967 0.729 . . . . 64.34 112.967 -174.182 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 15.5 tppt? -81.87 127.09 32.65 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.123 0.487 . . . . 73.11 111.995 -172.489 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -94.7 -177.61 4.26 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.081 -0.509 . . . . 71.13 110.991 174.197 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 8.7 mp 64.12 5.83 2.63 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.11 0.411 . . . . 73.4 112.11 -178.259 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 41.8 mm-40 -80.41 19.03 0.81 Allowed 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 112.518 0.562 . . . . 72.04 112.518 -179.309 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 58.7 m80 -77.04 -8.67 57.85 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.768 0.318 . . . . 60.03 111.106 176.256 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -75.32 34.83 0.11 Allowed 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 112.42 0.526 . . . . 72.33 112.42 177.056 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 -145.81 142.09 28.53 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 122.359 0.264 . . . . 74.5 110.553 -178.664 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -57.95 145.64 35.15 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 121.298 0.57 . . . . 73.34 112.157 -177.78 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 74.2 m80 -113.51 -165.61 1.01 Allowed 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 115.927 -0.579 . . . . 73.04 111.098 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 18.7 p80 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 119.199 -0.429 . . . . 72.44 111.34 175.713 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.7 mtm . . . . . 0 N--CA 1.492 1.626 0 N-CA-C 111.237 0.088 . . . . 75.14 111.237 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -63.03 116.38 3.54 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 122.537 2.158 . . . . 74.42 112.418 178.218 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 77.8 p -92.5 85.33 5.29 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.475 0.546 . . . . 71.42 112.475 -175.645 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.628 ' HA ' ' HE3' ' A' ' 4' ' ' LYS . 1.6 tpmt? -157.53 97.18 1.98 Allowed Pre-proline 0 CA--C 1.539 0.553 0 N-CA-C 111.979 0.362 . . . . 73.14 111.979 177.239 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -82.53 145.72 13.3 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 122.427 2.085 . . . . 64.53 112.149 172.558 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -72.25 160.54 46.89 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 122.205 1.937 . . . . 60.02 112.439 177.424 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 52.8 p90 -63.92 146.0 97.43 Favored Pre-proline 0 CA--C 1.544 0.744 0 CA-C-O 120.835 0.35 . . . . 73.13 111.9 -179.013 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -74.38 165.24 32.22 Favored 'Trans proline' 0 CA--C 1.541 0.835 0 C-N-CA 122.674 2.249 . . . . 71.11 113.238 178.883 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.486 ' HB2' ' HA ' ' A' ' 58' ' ' GLU . 0.1 OUTLIER -101.38 139.35 37.17 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 116.176 -0.466 . . . . 72.22 111.033 -179.24 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -151.66 117.53 5.48 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 116.525 -0.307 . . . . 74.14 110.439 176.611 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.465 ' HB2' ' CD2' ' A' ' 57' ' ' TYR . . . -117.96 167.03 11.81 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.626 0.602 . . . . 72.31 112.626 -174.808 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 28.5 p90 -147.88 150.47 34.17 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.533 -0.758 . . . . 63.53 110.883 178.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 55.1 mt -102.2 123.76 55.66 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-O 120.951 0.405 . . . . 73.15 111.339 -178.264 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.9 t -106.27 124.71 61.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-N 116.457 -0.338 . . . . 52.53 111.291 179.775 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 71.0 p -89.87 113.56 25.18 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.895 0.378 . . . . 54.02 111.285 178.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.447 HD12 ' HE3' ' A' ' 18' ' ' LYS . 30.0 pt -112.95 161.62 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-O 120.66 0.267 . . . . 62.23 111.337 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -124.14 130.07 51.92 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.165 0.507 . . . . 65.24 111.264 176.174 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.447 ' HE3' HD12 ' A' ' 16' ' ' ILE . 97.1 mttt -128.53 175.32 8.63 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 120.997 0.427 . . . . 72.34 111.131 177.898 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 90.52 -137.93 14.18 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 121.136 -0.554 . . . . 64.42 113.544 178.141 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -85.86 139.62 35.13 Favored Pre-proline 0 CA--C 1.541 0.599 0 C-N-CA 122.335 0.254 . . . . 75.03 111.503 -176.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -51.01 -45.33 37.12 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 C-N-CA 122.533 2.155 . . . . 73.4 112.833 178.008 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.03 -58.1 6.46 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 120.8 -0.714 . . . . 24.41 112.158 175.057 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -98.98 82.92 2.82 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 121.033 0.444 . . . . 72.41 110.702 179.078 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 46.0 p -86.12 150.22 24.57 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 116.003 -0.544 . . . . 70.41 112.202 179.154 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 47.2 t -111.79 116.33 52.25 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 115.965 -0.561 . . . . 71.12 110.458 174.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 94.5 m -81.75 117.95 22.47 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 111.888 0.329 . . . . 71.33 111.888 -178.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -110.92 131.63 54.89 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 120.88 0.371 . . . . 74.21 111.351 178.114 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -90.68 114.35 26.64 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.833 0.349 . . . . 72.34 110.907 177.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.404 ' HB3' HD13 ' A' ' 40' ' ' LEU . 80.5 mt-30 -103.92 120.51 41.17 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.304 -0.407 . . . . 75.04 111.588 -179.17 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.7 tp -83.32 110.97 18.56 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 120.62 0.248 . . . . 73.44 110.816 174.853 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 31' ' ' ARG . 60.3 mtt180 -123.29 166.44 15.27 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.805 0.336 . . . . 71.31 110.798 177.938 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.411 ' O ' ' HA ' ' A' ' 37' ' ' PRO . . . -137.79 171.99 13.62 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.529 -0.305 . . . . 73.25 111.096 178.839 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -90.2 -14.64 33.04 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.308 0.575 . . . . 71.42 110.594 175.282 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.409 ' HA ' ' C ' ' A' ' 35' ' ' PRO . 92.2 m-70 -122.03 130.98 24.5 Favored Pre-proline 0 CA--C 1.546 0.795 0 CA-C-N 116.005 -0.543 . . . . 73.22 110.261 173.923 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.409 ' C ' ' HA ' ' A' ' 34' ' ' HIS . 24.7 Cg_exo -64.85 -44.71 0.38 Allowed 'Cis proline' 0 C--N 1.357 0.992 0 C-N-CA 124.479 -1.05 . . . . 64.33 113.9 0.539 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -137.58 153.64 74.41 Favored Pre-proline 0 N--CA 1.474 0.754 0 C-N-CA 122.04 0.136 . . . . 74.14 111.058 179.144 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.411 ' HA ' ' O ' ' A' ' 32' ' ' ALA . 88.7 Cg_exo -50.49 -27.28 18.42 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 122.75 2.3 . . . . 75.1 113.372 175.405 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -74.67 -23.82 58.7 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 116.131 -0.486 . . . . 54.04 112.014 178.853 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 53.0 m -57.52 105.86 0.28 Allowed 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.146 0.498 . . . . 74.3 112.288 -175.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.404 HD13 ' HB3' ' A' ' 29' ' ' GLN . 49.7 tp -95.3 124.91 39.58 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 115.86 -0.609 . . . . 62.51 111.229 178.845 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.1 mm -86.01 -50.88 13.93 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 CA-C-O 120.981 0.419 . . . . 73.41 111.784 -179.625 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 29.1 t -168.77 149.02 4.43 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 120.991 0.424 . . . . 64.12 112.09 -178.556 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -106.91 140.22 40.08 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.216 -0.447 . . . . 73.41 110.334 174.384 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' HIS . . . . . 0.419 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 85.4 m-70 -139.81 151.26 65.33 Favored Pre-proline 0 N--CA 1.471 0.597 0 CA-C-O 120.795 0.331 . . . . 53.22 111.784 179.005 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 44' ' ' HIS . 9.9 Cg_exo -69.77 -37.22 9.45 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 122.853 2.369 . . . . 72.11 112.798 177.757 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 41.9 p -105.35 148.62 26.87 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 121.104 0.478 . . . . 74.54 111.718 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.444 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -65.79 -31.31 72.21 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.304 -0.407 . . . . 73.44 111.195 176.002 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 25.7 tp60 -57.16 -49.19 76.74 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 116.485 -0.325 . . . . 73.52 111.571 179.838 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -58.78 -43.55 90.44 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.34 0.591 . . . . 73.22 110.982 175.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.89 -35.21 79.27 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.767 -0.651 . . . . 50.34 111.497 177.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' MET . . . . . 0.497 ' O ' ' HG3' ' A' ' 55' ' ' LYS . 68.4 mtt -68.2 -42.61 79.61 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.477 -0.329 . . . . 44.04 111.226 176.458 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -56.99 -49.27 76.28 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.274 0.559 . . . . 70.33 110.507 176.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.02 -36.81 85.21 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 115.943 -0.572 . . . . 65.15 111.54 176.674 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.7 tttm -61.96 -42.88 99.62 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.078 0.466 . . . . 74.11 110.606 176.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.497 ' HG3' ' O ' ' A' ' 51' ' ' MET . 95.7 mttt -56.67 -55.1 38.3 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.426 0.632 . . . . 71.43 109.929 171.729 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.416 ' HG3' ' OD1' ' A' ' 61' ' ' ASP . 30.1 ttm-85 -60.23 -25.71 65.85 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 115.151 -0.931 . . . . 64.44 112.544 -174.197 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.465 ' CD2' ' HB2' ' A' ' 11' ' ' ALA . 90.1 t80 -76.68 -54.42 6.68 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 120.777 0.323 . . . . 61.14 111.505 176.454 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.486 ' HA ' ' HB2' ' A' ' 9' ' ' ARG . 39.2 mt-10 -74.59 -49.82 20.25 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.674 0.273 . . . . 65.43 111.246 -179.11 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -83.85 99.75 0.83 Allowed Pre-proline 0 CA--C 1.537 0.47 0 N-CA-C 109.227 -0.657 . . . . 73.42 109.227 168.035 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -78.9 107.79 2.3 Favored 'Trans proline' 0 CA--C 1.538 0.684 0 C-N-CA 122.306 2.004 . . . . 73.22 115.09 -165.638 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.416 ' OD1' ' HG3' ' A' ' 56' ' ' ARG . 1.8 m-20 -68.46 79.03 0.27 Allowed 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 108.383 -0.969 . . . . 75.42 108.383 161.366 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 49.1 pttt -48.7 -50.17 34.62 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.178 1.177 . . . . 73.12 114.178 -167.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -99.22 127.36 45.19 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.389 0.614 . . . . 61.31 112.398 -175.899 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 88.8 mt -77.74 -179.41 5.92 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.097 -0.501 . . . . 61.13 111.079 175.368 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -59.63 152.59 21.99 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.137 0.494 . . . . 73.55 112.066 -177.739 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 9.5 p80 -124.19 107.79 11.6 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.995 -0.548 . . . . 61.43 110.76 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -83.29 129.74 35.02 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 111.979 0.363 . . . . 75.42 111.979 -177.56 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 59.3 t-80 -137.56 125.26 22.36 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.52 -0.309 . . . . 73.31 110.919 179.647 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 64.4 m80 -59.65 139.73 56.98 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 116.34 -0.391 . . . . 73.13 111.68 -179.464 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 29.3 p-80 -115.45 151.83 34.04 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 120.784 0.326 . . . . 74.21 111.771 -178.52 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 53.3 p-80 . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.594 -0.717 . . . . 71.11 111.597 171.538 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 . . . . . 0 CA--C 1.539 0.551 0 CA-C-O 120.866 0.365 . . . . 65.21 111.798 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -129.05 175.81 8.39 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 116.138 -0.483 . . . . 32.54 111.655 179.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 41.1 p90 -153.52 179.78 8.49 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 121.095 0.474 . . . . 71.5 111.336 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 58.1 mt -117.96 146.05 23.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-N 116.48 -0.327 . . . . 73.35 111.497 -177.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 57.4 t -128.09 121.1 55.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 122.546 0.338 . . . . 71.14 110.947 176.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 77.2 p -87.93 115.32 25.31 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 111.85 0.315 . . . . 72.23 111.85 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.446 HD11 ' HE3' ' A' ' 18' ' ' LYS . 37.4 pt -121.07 175.59 4.67 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-O 121.204 0.526 . . . . 73.04 111.772 -179.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.434 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 45.4 mt-10 -125.21 141.55 52.03 Favored 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 116.05 -0.523 . . . . 74.14 110.801 176.369 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.446 ' HE3' HD11 ' A' ' 16' ' ' ILE . 93.7 mttt -131.81 175.85 8.85 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.035 0.445 . . . . 74.55 111.724 178.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.27 -136.72 12.85 Favored Glycine 0 CA--C 1.525 0.687 0 C-N-CA 121.086 -0.578 . . . . 65.33 113.455 176.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -87.71 146.87 40.08 Favored Pre-proline 0 CA--C 1.538 0.485 0 C-N-CA 122.424 0.29 . . . . 75.41 111.54 -176.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -53.09 -31.51 54.66 Favored 'Trans proline' 0 C--N 1.354 0.859 0 C-N-CA 122.927 2.418 . . . . 51.42 113.088 -178.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -96.41 -42.64 3.39 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 121.14 -0.552 . . . . 42.44 112.709 175.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -99.69 85.24 3.07 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.144 0.497 . . . . 72.43 111.234 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.434 ' HB ' ' HB3' ' A' ' 17' ' ' GLU . 75.1 p -91.95 152.77 19.87 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 121.178 0.513 . . . . 74.3 112.349 -179.65 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 61.9 t -121.16 145.67 27.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 CA-C-N 115.902 -0.59 . . . . 60.31 110.505 176.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 41.7 m -78.5 127.97 32.9 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.256 0.465 . . . . 45.32 112.256 -176.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 44.4 m95 -132.13 151.21 51.9 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.235 0.54 . . . . 72.25 111.916 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -118.8 119.12 33.44 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.976 -0.557 . . . . 61.44 111.498 -179.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -100.58 129.84 46.57 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 120.967 0.413 . . . . 72.24 111.689 177.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 65.4 tp -88.77 111.72 22.33 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.398 -0.365 . . . . 54.53 110.592 174.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 31' ' ' ARG . 71.7 mtt-85 -127.24 153.87 45.57 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.707 0.289 . . . . 74.5 110.595 178.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -134.14 145.18 49.04 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.809 0.3 . . . . 72.43 111.809 -176.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -62.64 -17.35 60.25 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 121.44 0.638 . . . . 62.13 111.156 176.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 29.6 m80 -120.29 128.81 25.64 Favored Pre-proline 0 CA--C 1.542 0.652 0 CA-C-N 115.736 -0.666 . . . . 70.23 110.777 -176.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -80.11 -17.6 26.39 Favored 'Cis proline' 0 CA--C 1.541 0.851 0 C-N-CA 123.815 -1.327 . . . . 74.42 113.276 0.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -143.35 143.34 23.85 Favored Pre-proline 0 N--CA 1.471 0.583 0 C-N-CA 122.439 0.296 . . . . 71.14 110.822 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -70.37 -8.61 24.02 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 122.513 2.142 . . . . 74.11 112.981 -174.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -97.1 -0.97 46.18 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 120.911 0.386 . . . . 75.41 111.229 175.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.6 t -72.64 103.87 3.72 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.103 0.477 . . . . 72.33 111.667 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 58.4 tp -82.99 122.62 28.54 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.989 -0.55 . . . . 74.14 110.295 176.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.4 mm -88.42 -54.16 8.36 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-O 120.987 0.423 . . . . 72.04 111.393 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 44.2 t -159.48 156.69 28.71 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 116.376 -0.375 . . . . 64.32 111.404 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -119.29 139.31 52.13 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.855 0.359 . . . . 65.42 111.036 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 48.2 m80 -143.32 143.07 22.88 Favored Pre-proline 0 N--CA 1.472 0.642 0 CA-C-N 116.643 -0.253 . . . . 75.52 111.377 -179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -75.35 -15.1 20.17 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 122.436 2.091 . . . . 70.14 113.355 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 44.6 p -116.91 148.69 41.12 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 121.118 0.485 . . . . 71.0 111.992 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.29 -42.71 99.11 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.075 -0.511 . . . . 51.22 112.165 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.2 tp60 -56.86 -46.42 81.8 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 111.89 0.33 . . . . 52.41 111.89 -178.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -59.75 -34.22 72.68 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 120.839 0.352 . . . . 75.43 111.462 177.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.97 -43.98 73.87 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 120.969 0.414 . . . . 73.15 111.458 178.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 66.2 mtt -65.33 -42.76 92.61 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.256 0.55 . . . . 72.32 111.311 177.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.423 ' O ' ' HD2' ' A' ' 56' ' ' ARG . 12.8 t70 -63.64 -47.99 79.09 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.919 -0.582 . . . . 73.1 110.563 178.408 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.57 -39.35 80.03 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.314 -0.403 . . . . 64.1 111.29 176.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 49.5 tttp -55.11 -44.32 74.87 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.326 -0.397 . . . . 72.13 110.718 174.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -63.1 -41.7 99.44 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 122.327 -0.233 . . . . 72.0 111.605 175.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.462 ' HA ' ' HE ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -56.27 -32.78 64.85 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 122.194 -0.317 . . . . 73.1 111.809 176.811 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -77.75 -37.59 48.84 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 111.878 0.325 . . . . 63.4 111.878 177.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -92.27 -22.8 19.56 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.084 0.772 . . . . 72.32 113.084 -172.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 . . . . . 0 CA--C 1.543 0.681 0 CA-C-O 120.935 0.398 . . . . 73.12 111.4 179.037 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 . . . . . 0 CA--C 1.539 0.555 0 CA-C-O 120.895 0.379 . . . . 74.15 110.958 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.484 ' O ' ' HE3' ' A' ' 54' ' ' LYS . . . -101.52 143.92 30.91 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 120.725 0.297 . . . . 45.44 111.339 176.2 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 49.7 p90 -139.65 144.3 37.57 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 121.181 0.515 . . . . 74.53 111.725 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 62.3 mt -95.34 140.49 16.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-N 116.153 -0.476 . . . . 63.25 111.333 -178.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.0 t -122.47 140.52 46.04 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 C-N-CA 122.586 0.354 . . . . 51.51 111.05 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.4 p -102.86 113.47 26.93 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.036 0.446 . . . . 74.04 111.942 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.443 HD13 ' NE2' ' A' ' 29' ' ' GLN . 37.4 pt -120.96 176.01 4.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-O 121.103 0.478 . . . . 55.22 111.702 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.413 ' HB2' ' HB ' ' A' ' 24' ' ' THR . 12.3 pt-20 -142.27 132.11 24.28 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.266 -0.425 . . . . 64.0 110.836 177.158 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -117.22 161.04 20.12 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-O 120.833 0.349 . . . . 71.34 111.876 -178.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.19 -147.16 17.19 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 121.471 -0.395 . . . . 64.33 113.583 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.453 ' O ' HG23 ' A' ' 24' ' ' THR . 94.9 mttt -89.1 151.95 47.5 Favored Pre-proline 0 N--CA 1.473 0.68 0 N-CA-C 112.187 0.44 . . . . 74.23 112.187 -173.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -53.59 123.09 12.5 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 122.345 2.03 . . . . 71.31 111.932 175.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.33 -50.84 3.89 Favored Glycine 0 CA--C 1.528 0.883 0 C-N-CA 121.05 -0.595 . . . . 55.01 112.48 -175.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.416 HE21 ' HA ' ' A' ' 23' ' ' GLN . 0.1 OUTLIER -95.33 76.75 3.4 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.259 0.552 . . . . 65.43 110.896 177.311 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.453 HG23 ' O ' ' A' ' 20' ' ' LYS . 33.0 p -118.09 161.42 19.87 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.718 0.636 . . . . 70.25 112.718 -177.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 62.0 t -108.76 130.33 61.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-N 115.793 -0.639 . . . . 74.32 110.617 178.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.7 m -76.07 115.29 15.63 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 120.774 0.321 . . . . 73.41 111.737 -178.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.404 ' HB2' HG13 ' A' ' 16' ' ' ILE . 88.7 m95 -117.36 144.3 45.07 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.173 0.511 . . . . 75.21 111.52 177.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -111.01 115.39 29.39 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.053 -0.521 . . . . 75.42 110.817 176.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.539 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 91.4 mt-30 -97.49 125.4 42.15 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 120.727 0.298 . . . . 72.14 111.647 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.7 tp -90.49 115.08 27.36 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 122.281 -0.262 . . . . 70.1 110.336 173.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 58.3 mtt-85 -122.95 151.61 41.65 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 116.771 -0.195 . . . . 73.21 110.925 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -122.43 167.74 12.94 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 120.885 0.374 . . . . 64.04 111.782 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.3 p-10 -85.59 -30.55 23.22 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-O 121.097 0.475 . . . . 74.23 111.352 178.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -117.29 145.64 36.45 Favored Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 122.89 0.476 . . . . 72.25 110.799 176.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -72.28 -13.99 17.07 Favored 'Cis proline' 0 CA--C 1.543 0.951 0 C-N-CA 124.365 -1.098 . . . . 71.12 113.516 2.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -151.42 150.73 27.52 Favored Pre-proline 0 CA--C 1.539 0.551 0 CA-C-N 116.558 -0.292 . . . . 74.43 110.691 177.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -58.98 -24.73 74.61 Favored 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 122.747 2.298 . . . . 71.23 112.918 -178.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -82.68 3.02 30.73 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.741 -0.663 . . . . 72.54 111.897 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 89.2 p -64.81 105.09 0.93 Allowed 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 121.196 0.522 . . . . 45.31 111.851 -176.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 54.5 tp -91.92 111.09 22.49 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.169 -0.469 . . . . 73.15 110.35 175.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 44.7 mm -77.49 -51.81 17.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 CA-C-N 116.356 -0.384 . . . . 55.32 111.386 -179.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 94.5 p -168.77 159.03 9.46 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.049 0.452 . . . . 62.15 111.954 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.539 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 45.8 mt-10 -114.79 121.42 43.24 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.961 -0.563 . . . . 72.21 110.465 175.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -126.59 141.95 41.71 Favored Pre-proline 0 N--CA 1.47 0.574 0 O-C-N 122.081 -0.387 . . . . 71.25 111.721 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -71.78 -27.08 18.48 Favored 'Trans proline' 0 CA--C 1.542 0.888 0 C-N-CA 122.573 2.182 . . . . 70.45 113.616 -177.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 28.1 p -106.07 148.14 28.11 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.066 0.46 . . . . 74.22 111.781 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.438 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -64.14 -31.75 73.06 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.308 -0.406 . . . . 74.53 111.335 175.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 27.9 tp60 -57.01 -54.49 46.14 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 116.465 -0.334 . . . . 54.23 111.319 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -56.18 -42.45 77.11 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 120.897 0.379 . . . . 55.42 111.33 177.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.53 -41.68 99.02 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.873 0.368 . . . . 62.11 111.678 179.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.438 ' HG3' ' O ' ' A' ' 47' ' ' ALA . 66.0 mtt -64.97 -49.11 71.6 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.368 -0.378 . . . . 64.11 110.944 177.183 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -62.22 -37.62 86.06 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 111.779 0.288 . . . . 73.42 111.779 178.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.68 -43.36 89.5 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.514 -0.312 . . . . 74.31 111.048 176.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.484 ' HE3' ' O ' ' A' ' 11' ' ' ALA . 87.6 tttt -61.58 -53.97 49.26 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.466 -0.334 . . . . 73.31 111.109 176.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -56.9 -45.88 82.32 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.358 -0.383 . . . . 71.32 111.266 178.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 55.1 ttm-85 -56.74 -44.73 81.99 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.055 0.455 . . . . 71.42 110.929 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -63.26 -48.38 78.43 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.966 -0.561 . . . . 75.04 110.577 175.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -76.98 15.41 0.68 Allowed 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.743 0.646 . . . . 72.35 112.743 -175.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 52.0 m-20 . . . . . 0 CA--C 1.537 0.464 0 O-C-N 122.178 -0.326 . . . . 75.01 110.818 170.103 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 . . . . . 0 CA--C 1.537 0.456 0 CA-C-O 120.984 0.421 . . . . 73.23 111.767 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.43 ' HB2' ' CD2' ' A' ' 57' ' ' TYR . . . -128.78 152.47 48.42 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.981 -0.554 . . . . 72.12 111.511 179.188 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 33.9 p90 -142.27 168.79 18.91 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 120.856 0.36 . . . . 73.24 111.745 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 59.6 mt -109.81 136.87 44.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 N-CA-C 112.053 0.39 . . . . 63.12 112.053 -174.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 78.4 t -127.0 131.87 70.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 CA-C-N 116.46 -0.336 . . . . 70.53 110.731 175.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 68.2 p -89.91 123.05 33.51 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.312 0.486 . . . . 63.4 112.312 -177.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.483 HD13 ' NE2' ' A' ' 29' ' ' GLN . 37.1 pt -123.0 175.26 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 CA-C-N 116.326 -0.397 . . . . 72.4 110.495 173.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -134.61 137.89 44.08 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-O 120.935 0.398 . . . . 74.42 111.959 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 53.1 mttp -124.11 176.76 6.18 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 116.179 -0.464 . . . . 55.22 110.248 174.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.47 -142.48 15.87 Favored Glycine 0 CA--C 1.529 0.949 0 C-N-CA 121.214 -0.517 . . . . 50.32 113.635 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 9.4 mtpm? -104.01 146.37 32.41 Favored Pre-proline 0 N--CA 1.473 0.722 0 C-N-CA 122.574 0.35 . . . . 74.05 111.571 -178.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_exo -45.51 125.48 7.62 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 122.98 2.453 . . . . 35.14 113.039 178.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.94 -65.93 3.65 Favored Glycine 0 CA--C 1.525 0.682 0 C-N-CA 120.904 -0.665 . . . . 62.4 112.237 -175.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -83.05 68.55 9.57 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.284 0.564 . . . . 74.33 110.652 177.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 71.5 p -103.8 159.62 15.48 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 121.264 0.554 . . . . 74.4 112.288 -176.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 86.8 t -109.73 127.07 66.83 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-N 115.931 -0.577 . . . . 75.21 110.178 174.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 59.0 m -79.68 115.59 19.38 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.095 0.474 . . . . 64.42 111.719 -178.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 73.6 m95 -102.71 132.31 48.93 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.104 -0.498 . . . . 74.11 110.953 177.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -97.1 114.4 26.06 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.001 0.429 . . . . 73.01 110.907 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.737 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 92.0 mt-30 -95.3 120.75 36.07 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.123 -0.489 . . . . 73.2 111.696 -178.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 58.2 tp -85.09 105.3 15.72 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.309 -0.405 . . . . 62.04 110.418 175.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.455 ' NH2' ' HA ' ' A' ' 38' ' ' ASP . 15.2 mtp-105 -111.49 139.97 46.48 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.336 -0.393 . . . . 70.13 110.945 -177.307 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -109.86 149.17 30.26 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 120.932 0.396 . . . . 73.54 111.324 177.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -77.36 -22.76 51.26 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 112.422 0.527 . . . . 75.2 112.422 -175.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -128.22 148.26 66.97 Favored Pre-proline 0 N--CA 1.472 0.659 0 O-C-N 122.113 -0.367 . . . . 64.34 111.13 179.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -70.31 -42.28 0.79 Allowed 'Cis proline' 0 C--N 1.359 1.116 0 C-N-CA 124.215 -1.161 . . . . 73.41 113.32 0.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -103.65 145.8 31.3 Favored Pre-proline 0 N--CA 1.469 0.482 0 N-CA-C 110.293 -0.262 . . . . 74.44 110.293 175.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -62.85 -6.41 9.22 Favored 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 122.288 1.992 . . . . 74.42 113.124 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.455 ' HA ' ' NH2' ' A' ' 31' ' ' ARG . 5.5 m-20 -103.9 14.93 29.79 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.098 0.407 . . . . 63.14 112.098 178.665 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.7 m -65.52 87.27 0.08 Allowed 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.893 0.378 . . . . 71.23 111.093 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 59.0 tp -72.55 103.06 3.41 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 121.108 0.48 . . . . 64.1 111.081 178.05 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.2 mm -71.62 -43.36 71.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 CA-C-N 116.202 -0.453 . . . . 63.44 111.174 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.6 t -174.12 149.54 1.45 Allowed 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 112.069 0.396 . . . . 74.05 112.069 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.737 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 45.1 mt-10 -108.13 134.22 51.31 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 116.209 -0.451 . . . . 54.52 110.521 173.052 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 37.9 m80 -136.33 145.07 50.31 Favored Pre-proline 0 CA--C 1.538 0.504 0 O-C-N 122.236 -0.29 . . . . 75.23 111.311 178.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -73.66 -15.81 24.13 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 122.479 2.119 . . . . 50.24 112.851 179.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 34.8 p -115.97 142.33 46.93 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 120.936 0.398 . . . . 74.34 111.372 178.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.462 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -64.15 -35.6 81.3 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 120.967 0.413 . . . . 53.13 110.855 176.779 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.408 HE21 ' N ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -55.26 -49.34 72.29 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.282 -0.417 . . . . 73.35 111.529 178.92 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.408 ' N ' HE21 ' A' ' 48' ' ' GLN . 52.4 mt-10 -62.49 -38.53 90.25 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 120.881 0.372 . . . . 73.53 111.126 177.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.32 -40.91 98.62 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 120.93 0.395 . . . . 72.32 111.221 178.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.462 ' HG3' ' O ' ' A' ' 47' ' ' ALA . 86.8 mtp -69.49 -44.42 71.14 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.018 0.437 . . . . 64.22 111.329 178.288 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.601 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 12.4 t70 -65.79 -41.68 91.68 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 120.967 0.413 . . . . 70.45 111.122 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.24 -36.58 84.57 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.019 0.437 . . . . 61.53 110.773 175.141 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 43.7 tttp -56.9 -49.14 76.46 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 115.986 -0.552 . . . . 71.22 111.345 175.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.601 ' HG2' ' O ' ' A' ' 52' ' ' ASP . 17.0 pttm -61.59 -43.97 97.88 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 121.084 -0.246 . . . . 53.42 110.854 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -65.2 -35.36 80.83 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 120.601 0.239 . . . . 72.41 111.497 -178.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.43 ' CD2' ' HB2' ' A' ' 11' ' ' ALA . 66.6 t80 -64.15 -47.56 79.4 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.867 0.365 . . . . 73.32 110.895 175.13 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -71.97 -21.57 61.57 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 116.288 -0.415 . . . . 50.31 111.512 -177.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 . . . . . 0 CA--C 1.543 0.69 0 N-CA-C 110.371 -0.233 . . . . 71.33 110.371 167.641 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 . . . . . 0 N--CA 1.471 0.623 0 N-CA-C 112.05 0.389 . . . . 74.32 112.05 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -138.03 162.07 35.08 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 120.801 0.334 . . . . 72.02 111.704 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 33.3 p90 -141.68 141.21 33.34 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 121.187 0.517 . . . . 71.41 111.952 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 62.4 mt -92.81 137.07 23.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-N 116.182 -0.463 . . . . 74.32 111.836 -177.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 48.2 t -123.65 137.62 56.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 C-N-CA 122.724 0.409 . . . . 74.15 110.854 177.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 77.8 p -98.07 129.74 44.89 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 112.376 0.51 . . . . 75.15 112.376 -177.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.415 HD13 ' NE2' ' A' ' 29' ' ' GLN . 41.3 pt -124.5 171.72 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-N 116.293 -0.412 . . . . 74.44 110.823 177.216 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -129.66 128.35 42.39 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.011 0.434 . . . . 72.43 111.909 -178.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -120.44 169.24 10.5 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 116.418 -0.356 . . . . 73.25 110.821 177.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.71 -141.76 15.52 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 120.957 -0.64 . . . . 31.43 114.049 177.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -94.49 141.3 23.28 Favored Pre-proline 0 CA--C 1.541 0.626 0 N-CA-C 111.997 0.369 . . . . 60.3 111.997 -173.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -55.63 99.6 0.07 OUTLIER 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.583 2.188 . . . . 72.41 111.935 175.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 116.21 -52.64 0.66 Allowed Glycine 0 CA--C 1.525 0.674 0 N-CA-C 111.537 -0.625 . . . . 43.24 111.537 -173.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.7 mm-40 -99.41 78.14 2.17 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.124 0.488 . . . . 53.02 110.67 173.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 81.6 p -105.89 164.73 11.72 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.342 0.592 . . . . 70.32 112.094 -177.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 61.7 t -121.49 118.43 55.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 115.797 -0.638 . . . . 72.45 109.633 173.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 87.9 m -76.07 115.33 15.67 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 120.945 0.402 . . . . 71.52 111.665 -177.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 36.9 m95 -97.37 151.08 20.29 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.079 -0.51 . . . . 74.23 111.271 177.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -109.67 115.0 29.06 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 116.204 -0.453 . . . . 73.01 111.34 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.615 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 92.6 mt-30 -98.26 130.21 44.97 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.002 -0.545 . . . . 74.14 111.041 178.083 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.5 tp -92.95 107.92 19.59 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 120.86 0.362 . . . . 65.33 111.121 175.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -102.95 163.97 11.89 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 120.917 0.389 . . . . 71.41 110.48 175.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -144.11 140.63 29.54 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.46 -0.336 . . . . 53.5 111.466 177.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -63.89 -17.79 63.55 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.014 0.435 . . . . 73.53 111.737 176.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 48.4 m80 -127.82 133.88 25.6 Favored Pre-proline 0 CA--C 1.544 0.745 0 CA-C-N 116.313 -0.403 . . . . 74.05 111.339 -174.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -77.96 -53.04 0.16 OUTLIER 'Cis proline' 0 CA--C 1.544 1.018 0 C-N-CA 123.853 -1.311 . . . . 72.55 113.334 -2.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.438 ' HE2' ' HD2' ' A' ' 37' ' ' PRO . 14.1 mmmm -77.92 141.49 63.63 Favored Pre-proline 0 CA--C 1.54 0.584 0 O-C-N 122.008 -0.433 . . . . 74.13 110.43 177.067 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.438 ' HD2' ' HE2' ' A' ' 36' ' ' LYS . 14.9 Cg_endo -56.22 -28.11 69.53 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 122.382 2.055 . . . . 34.1 112.871 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -99.05 22.73 9.92 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 116.558 -0.292 . . . . 72.4 111.7 177.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.0 t -57.85 94.99 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 121.014 0.435 . . . . 70.21 111.548 -178.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 58.8 tp -85.41 113.89 22.04 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.175 -0.466 . . . . 71.34 110.641 178.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.7 mm -81.27 -55.41 8.17 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 CA-C-N 116.61 -0.268 . . . . 72.23 111.624 -179.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 45.4 m -164.67 155.13 14.36 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-O 120.923 0.392 . . . . 71.42 111.631 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.615 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 45.2 mt-10 -105.45 139.45 40.06 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.189 -0.46 . . . . 75.53 110.296 174.271 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . 0.423 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 34.7 m80 -137.06 148.07 61.29 Favored Pre-proline 0 N--CA 1.473 0.702 0 N-CA-C 112.115 0.413 . . . . 74.22 112.115 179.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 44' ' ' HIS . 22.4 Cg_exo -63.65 -49.41 4.32 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 123.056 2.504 . . . . 73.24 113.499 178.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 34.0 p -101.64 158.97 15.71 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.352 0.596 . . . . 73.31 112.095 -178.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.425 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -64.68 -40.11 94.82 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.812 -0.631 . . . . 75.42 111.561 179.008 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.3 tp60 -58.94 -46.04 88.96 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.541 -0.3 . . . . 73.22 111.407 -178.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -56.36 -42.76 78.32 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 121.401 0.619 . . . . 62.13 111.001 175.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.88 -38.91 90.02 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.016 -0.538 . . . . 50.22 111.612 179.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.425 ' HG3' ' O ' ' A' ' 47' ' ' ALA . 73.6 mtp -70.98 -39.63 72.36 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.6 -0.273 . . . . 64.41 111.556 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.536 ' HA ' ' HD3' ' A' ' 55' ' ' LYS . 13.2 m-20 -59.92 -40.81 90.13 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 120.917 0.389 . . . . 53.23 111.343 174.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.8 -44.92 91.87 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.976 0.417 . . . . 63.53 110.942 174.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -56.88 -46.49 81.82 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.083 0.468 . . . . 73.12 110.896 176.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.536 ' HD3' ' HA ' ' A' ' 52' ' ' ASP . 47.3 mtpt -55.12 -53.94 49.51 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.77 -0.65 . . . . 74.14 111.174 175.187 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 56' ' ' ARG . 13.8 mtp180 -56.69 -26.56 56.89 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 111.992 0.367 . . . . 64.23 111.992 178.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -80.03 -47.15 15.34 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 111.645 0.239 . . . . 75.11 111.645 176.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -84.17 -16.13 44.58 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.687 0.625 . . . . 64.02 112.687 -173.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 . . . . . 0 CA--C 1.541 0.628 0 O-C-N 122.311 -0.243 . . . . 74.21 110.97 176.429 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 . . . . . 0 N--CA 1.47 0.554 0 CA-C-O 120.89 0.376 . . . . 74.2 111.62 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.581 ' HA ' ' HA ' ' A' ' 32' ' ' ALA . . . -131.72 156.87 45.16 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 116.156 -0.474 . . . . 52.25 111.663 176.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 55.5 p90 -149.22 169.56 20.48 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 121.04 0.448 . . . . 74.14 111.63 178.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 69.2 mt -113.04 130.12 67.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 N-CA-C 112.238 0.458 . . . . 72.32 112.238 -175.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.49 HG21 ' HD2' ' A' ' 31' ' ' ARG . 60.1 t -111.5 124.59 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-N 116.395 -0.366 . . . . 75.42 111.083 177.376 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 68.2 p -90.2 113.0 24.71 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 122.029 -0.419 . . . . 72.04 111.986 -178.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.438 HD13 ' NE2' ' A' ' 29' ' ' GLN . 32.4 pt -115.87 160.06 15.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 120.64 0.257 . . . . 75.53 111.101 176.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -124.39 121.61 35.4 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.131 0.491 . . . . 75.5 111.266 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 5.3 mtpm? -118.0 175.28 5.75 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 116.011 -0.541 . . . . 55.52 110.678 -178.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.29 -136.88 12.94 Favored Glycine 0 CA--C 1.526 0.733 0 C-N-CA 120.564 -0.827 . . . . 62.43 113.62 177.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.583 ' HD2' ' N ' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -96.28 156.45 36.92 Favored Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 122.526 0.33 . . . . 65.22 111.47 -175.16 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -56.38 123.28 13.47 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.686 2.257 . . . . 52.1 112.424 174.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 80.38 -60.73 4.5 Favored Glycine 0 CA--C 1.526 0.746 0 C-N-CA 120.88 -0.676 . . . . 74.13 112.494 -176.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -80.15 73.5 6.97 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.514 0.673 . . . . 64.42 110.628 176.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 78.2 p -100.01 167.96 10.16 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.558 -0.746 . . . . 75.42 112.638 -175.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 59.2 t -118.36 126.06 74.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.241 -0.89 . . . . 62.04 109.455 170.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 35.5 m -81.13 114.67 20.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.917 0.389 . . . . 70.44 110.866 -179.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -108.88 131.0 55.44 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.094 0.473 . . . . 75.45 110.847 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -98.1 114.27 26.41 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 116.361 -0.381 . . . . 74.21 110.953 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.474 ' HB2' ' HB ' ' A' ' 14' ' ' VAL . 68.8 mt-30 -88.6 117.78 27.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.369 -0.378 . . . . 75.31 111.645 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.6 tp -81.16 103.94 11.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.914 0.388 . . . . 72.31 110.195 173.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.49 ' HD2' HG21 ' A' ' 14' ' ' VAL . 58.8 mtt180 -114.27 171.41 7.63 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.518 -0.31 . . . . 73.34 110.752 178.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.581 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . . . -126.77 150.59 49.04 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.117 0.484 . . . . 61.14 111.865 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -72.17 -25.31 61.64 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.168 0.509 . . . . 72.42 111.43 175.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -132.45 141.83 42.7 Favored Pre-proline 0 CA--C 1.544 0.745 0 CA-C-N 116.2 -0.454 . . . . 64.41 111.105 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -77.17 -30.36 6.04 Favored 'Cis proline' 0 C--N 1.355 0.872 0 C-N-CA 124.068 -1.221 . . . . 73.13 113.31 0.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -124.53 143.73 44.11 Favored Pre-proline 0 CA--C 1.54 0.584 0 CA-C-O 120.568 0.223 . . . . 74.23 111.532 -176.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -55.26 -27.78 58.84 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.718 2.278 . . . . 62.25 113.22 177.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -92.9 13.44 20.49 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.098 0.407 . . . . 75.31 112.098 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.7 m -68.4 83.84 0.26 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.159 0.504 . . . . 75.22 110.336 174.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 58.1 tp -82.94 122.32 28.12 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 116.015 -0.539 . . . . 72.11 111.772 -177.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 45.9 mm -87.67 -49.98 14.11 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-N 116.284 -0.416 . . . . 61.14 111.495 179.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.7 t -172.74 148.79 1.93 Allowed 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 111.851 0.315 . . . . 75.3 111.851 -177.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -103.61 133.55 48.44 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.027 0.441 . . . . 73.14 110.856 175.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . 0.559 ' HB3' ' HB3' ' A' ' 49' ' ' GLU . 45.0 m-70 -128.63 143.53 48.76 Favored Pre-proline 0 N--CA 1.47 0.542 0 O-C-N 122.287 -0.258 . . . . 75.54 111.473 -178.011 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -71.87 -26.93 18.33 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 C-N-CA 122.827 2.351 . . . . 74.21 114.492 -174.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 25.6 p -114.47 151.18 33.65 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.85 -0.531 . . . . 73.0 111.964 -178.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.04 -39.71 86.87 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.196 -0.456 . . . . 63.42 111.62 177.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.9 tp60 -61.77 -42.58 99.17 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 120.665 0.269 . . . . 75.14 110.942 178.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.559 ' HB3' ' HB3' ' A' ' 44' ' ' HIS . 12.0 mm-40 -56.24 -47.06 79.25 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.993 0.425 . . . . 61.23 111.355 174.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.82 -50.91 69.1 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.136 -0.484 . . . . 64.13 111.959 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 93.5 mmm -63.15 -39.38 94.49 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 111.894 0.331 . . . . 73.43 111.894 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.445 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 32.8 t70 -64.06 -49.69 71.33 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.952 0.406 . . . . 74.3 110.844 179.51 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.23 -37.71 86.43 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.1 0.476 . . . . 73.53 111.306 175.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.7 tttm -56.01 -47.47 77.73 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.027 -0.533 . . . . 63.43 111.264 177.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -58.98 -43.76 91.46 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.025 0.441 . . . . 64.31 111.482 176.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.445 ' HG3' ' O ' ' A' ' 52' ' ' ASP . 51.5 mtt-85 -62.27 -32.97 73.75 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.167 -0.47 . . . . 74.32 111.359 -179.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.445 ' CD2' ' HB2' ' A' ' 11' ' ' ALA . 57.2 t80 -76.89 -44.08 33.27 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.442 -0.345 . . . . 72.51 111.775 177.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -80.18 5.75 13.63 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.517 0.562 . . . . 75.13 112.517 -175.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.8 t70 . . . . . 0 CA--C 1.547 0.83 0 N-CA-C 109.532 -0.544 . . . . 63.42 109.532 174.925 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 . . . . . 0 CA--C 1.542 0.668 0 CA-C-O 121.487 0.661 . . . . 75.31 112.489 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.417 ' HB1' ' O ' ' A' ' 31' ' ' ARG . . . -139.31 -174.8 3.97 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.53 -0.759 . . . . 71.41 111.048 -177.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -152.33 145.72 24.8 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.066 0.46 . . . . 55.35 111.605 178.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 70.2 mt -101.56 131.09 50.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-N 116.348 -0.387 . . . . 71.21 111.417 -179.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 59.9 t -105.84 127.31 60.96 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-N 116.394 -0.366 . . . . 72.4 111.05 177.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.6 p -91.29 112.68 24.69 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.741 0.305 . . . . 71.51 111.712 -178.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.516 HD11 ' HE3' ' A' ' 18' ' ' LYS . 29.3 pt -115.77 170.53 5.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 116.476 -0.329 . . . . 70.55 110.97 177.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.437 ' HB2' ' HB ' ' A' ' 24' ' ' THR . 9.9 pt-20 -133.17 126.47 31.72 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.442 0.639 . . . . 74.44 111.58 176.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.516 ' HE3' HD11 ' A' ' 16' ' ' ILE . 98.5 mttt -114.61 178.15 4.39 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.848 -0.614 . . . . 63.41 111.203 -178.171 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.32 -136.93 12.96 Favored Glycine 0 CA--C 1.527 0.811 0 C-N-CA 121.107 -0.568 . . . . 70.14 113.309 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 48.7 mmtm -119.18 154.23 53.54 Favored Pre-proline 0 CA--C 1.539 0.537 0 O-C-N 122.663 -0.316 . . . . 72.43 111.337 -178.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -49.09 127.5 17.47 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 122.609 2.206 . . . . 65.45 112.76 176.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.51 -51.91 3.35 Favored Glycine 0 CA--C 1.526 0.758 0 C-N-CA 120.942 -0.647 . . . . 74.32 112.369 -175.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -99.66 74.32 1.86 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.871 0.367 . . . . 70.31 111.08 177.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.437 ' HB ' ' HB2' ' A' ' 17' ' ' GLU . 76.9 p -103.08 145.64 29.6 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.384 0.611 . . . . 74.53 112.156 -178.452 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 54.0 t -108.93 124.88 65.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 CA-C-N 115.801 -0.636 . . . . 64.22 110.176 174.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.2 m -75.31 115.55 15.07 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.629 0.252 . . . . 73.3 111.238 -178.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 82.0 m95 -108.51 132.8 53.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.267 0.556 . . . . 71.02 111.235 177.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -99.28 115.03 28.22 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.976 -0.556 . . . . 75.2 110.858 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.481 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 83.9 mt-30 -98.44 114.65 27.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.086 -0.506 . . . . 63.32 111.552 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 60.6 tp -79.22 111.3 15.31 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.858 0.361 . . . . 71.54 110.572 176.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.417 ' O ' ' HB1' ' A' ' 11' ' ' ALA . 66.8 mtt180 -118.76 169.25 10.0 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.675 0.274 . . . . 71.45 110.885 178.185 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -140.66 143.91 35.39 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.93 0.395 . . . . 51.33 111.711 -178.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -68.75 -20.17 64.36 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 116.189 -0.46 . . . . 64.31 111.975 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 70.8 m80 -119.49 133.64 23.8 Favored Pre-proline 0 CA--C 1.543 0.681 0 CA-C-N 116.245 -0.434 . . . . 70.51 111.24 -176.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -80.18 -24.13 12.91 Favored 'Cis proline' 0 CA--C 1.539 0.766 0 C-N-CA 123.877 -1.301 . . . . 72.03 113.103 -0.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -131.68 129.5 22.07 Favored Pre-proline 0 N--CA 1.47 0.546 0 CA-C-N 116.615 -0.266 . . . . 54.4 110.995 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -67.72 7.74 0.53 Allowed 'Trans proline' 0 CA--C 1.544 0.993 0 C-N-CA 122.643 2.229 . . . . 73.42 113.445 -179.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.9 m-20 -101.17 -3.75 28.52 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 122.153 -0.342 . . . . 63.43 111.082 175.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.6 t -77.06 142.14 39.96 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.014 0.435 . . . . 74.21 112.064 -176.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 56.1 tp -115.73 123.59 48.67 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.128 -0.487 . . . . 72.41 111.051 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 44.4 mm -88.02 -53.95 8.85 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 N-CA-C 111.739 0.274 . . . . 72.34 111.739 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.8 t -163.43 154.15 16.22 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 112.319 0.488 . . . . 72.11 112.319 -178.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.481 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 46.4 mt-10 -113.91 132.57 55.88 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 116.333 -0.394 . . . . 74.24 110.757 177.43 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -141.16 139.73 19.74 Favored Pre-proline 0 N--CA 1.473 0.711 0 O-C-N 122.221 -0.3 . . . . 73.43 111.539 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo -72.64 -15.68 27.13 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 122.642 2.228 . . . . 73.43 113.641 -177.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 44.2 p -116.82 148.78 40.91 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 120.914 0.388 . . . . 44.22 111.534 177.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.71 -31.2 72.06 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.867 0.365 . . . . 75.05 111.439 177.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.423 ' O ' ' HB2' ' A' ' 52' ' ' ASP . 0.1 OUTLIER -60.62 -52.33 65.63 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.271 -0.422 . . . . 71.42 110.571 179.43 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -55.97 -45.85 78.8 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 120.897 0.379 . . . . 74.31 111.803 178.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.81 -49.24 78.49 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 120.99 0.424 . . . . 71.12 111.447 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.441 ' O ' ' HG3' ' A' ' 55' ' ' LYS . 24.2 mmt -64.23 -33.84 76.72 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.195 0.522 . . . . 53.24 111.101 175.167 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.825 ' HA ' ' HE2' ' A' ' 55' ' ' LYS . 3.6 t70 -61.97 -46.29 89.9 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.93 -0.577 . . . . 65.4 110.846 -177.469 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.95 -33.39 72.05 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 116.016 -0.538 . . . . 70.45 111.231 175.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 65.7 tttm -61.49 -37.22 82.88 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.193 -0.458 . . . . 54.54 111.346 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.825 ' HE2' ' HA ' ' A' ' 52' ' ' ASP . 51.1 mtmt -51.97 -55.37 20.78 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.742 0.306 . . . . 71.31 111.242 177.041 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 15.8 mtp180 -67.05 -26.71 66.89 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.002 0.371 . . . . 64.33 112.002 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -66.19 -32.45 73.89 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.035 0.445 . . . . 73.21 110.535 173.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -77.92 -45.37 24.23 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.952 0.406 . . . . 61.53 110.845 175.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 . . . . . 0 CA--C 1.549 0.908 0 N-CA-C 112.256 0.465 . . . . 64.3 112.256 177.917 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 . . . . . 0 CA--C 1.538 0.485 0 CA-C-O 121.096 0.474 . . . . 73.1 110.932 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.41 ' O ' ' HE3' ' A' ' 54' ' ' LYS . . . -134.5 178.65 6.82 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 121.062 0.458 . . . . 70.3 111.824 -175.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 33.0 p90 -144.41 141.46 29.66 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.338 0.589 . . . . 75.53 111.383 178.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 57.3 mt -91.58 125.53 44.27 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 CA-C-N 116.075 -0.511 . . . . 73.41 111.786 -177.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.452 HG21 ' HD2' ' A' ' 31' ' ' ARG . 83.8 t -106.1 132.4 53.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 CA-C-O 120.862 0.363 . . . . 74.1 111.047 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 67.8 p -93.19 120.86 33.94 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.306 0.484 . . . . 71.01 112.306 -178.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 37.8 pt -123.89 171.83 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 CA-C-O 120.763 0.316 . . . . 73.01 110.877 176.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.557 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 45.6 mt-10 -136.0 127.68 28.99 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.22 0.533 . . . . 73.02 111.623 178.047 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -104.99 174.69 5.77 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.266 -0.424 . . . . 73.01 110.83 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.41 -140.27 14.83 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 120.789 -0.719 . . . . 64.34 113.864 177.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.55 ' HB2' ' HB2' ' A' ' 23' ' ' GLN . 1.9 mptp? -102.29 154.43 37.41 Favored Pre-proline 0 N--CA 1.471 0.618 0 C-N-CA 122.43 0.292 . . . . 63.33 111.328 -176.135 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -54.91 112.81 1.14 Allowed 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 122.346 2.031 . . . . 74.35 111.885 172.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 94.72 -45.51 2.16 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 121.265 -0.493 . . . . 74.2 112.323 -175.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.55 ' HB2' ' HB2' ' A' ' 20' ' ' LYS . 27.8 mm-40 -96.52 71.63 2.69 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.322 0.582 . . . . 74.05 110.521 175.54 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.557 ' HB ' ' HB3' ' A' ' 17' ' ' GLU . 40.1 p -101.84 168.63 9.31 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.964 0.727 . . . . 71.33 112.964 -174.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 57.7 t -127.31 125.37 65.84 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 CA-C-N 115.217 -0.901 . . . . 71.4 110.159 176.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 90.6 m -68.86 124.74 24.51 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.384 0.513 . . . . 75.52 112.384 -177.284 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -130.29 150.71 51.41 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.109 0.48 . . . . 75.14 111.292 176.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -117.34 115.26 24.9 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.222 -0.445 . . . . 63.4 111.436 -179.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.626 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 70.9 mt-30 -94.48 107.33 19.31 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.914 0.388 . . . . 64.33 111.087 175.253 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.6 tp -74.81 111.66 10.23 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.634 -0.257 . . . . 72.4 110.594 175.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.452 ' HD2' HG21 ' A' ' 14' ' ' VAL . 74.4 mtt180 -116.43 142.61 46.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.781 0.324 . . . . 65.24 111.004 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -109.6 140.23 43.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.836 0.35 . . . . 73.31 111.662 -178.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.524 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 26.6 t70 -68.74 -21.58 64.36 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.136 0.494 . . . . 65.54 111.482 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.415 ' HA ' ' C ' ' A' ' 35' ' ' PRO . 78.9 m-70 -123.58 136.43 27.24 Favored Pre-proline 0 CA--C 1.543 0.7 0 CA-C-N 116.461 -0.336 . . . . 60.32 111.483 -176.107 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.415 ' C ' ' HA ' ' A' ' 34' ' ' HIS . 21.1 Cg_exo -67.36 -51.57 0.16 OUTLIER 'Cis proline' 0 C--N 1.359 1.1 0 C-N-CA 124.287 -1.13 . . . . 73.11 113.363 -0.383 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 31.5 mtmm -109.23 139.25 20.85 Favored Pre-proline 0 N--CA 1.472 0.629 0 O-C-N 122.298 -0.251 . . . . 71.4 110.897 176.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.524 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 77.2 Cg_exo -52.05 -29.78 37.74 Favored 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 123.182 2.588 . . . . 54.14 114.45 -177.222 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -78.34 6.78 7.59 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 112.222 0.453 . . . . 61.24 112.222 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 43.8 t -70.41 93.35 0.87 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.001 0.429 . . . . 60.44 111.511 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 59.8 tp -71.71 114.17 9.52 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 116.4 -0.364 . . . . 43.43 110.848 176.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.0 mm -79.02 -45.8 24.06 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-N 116.227 -0.442 . . . . 72.15 111.459 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 86.2 p -176.1 149.19 0.86 Allowed 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 112.473 0.546 . . . . 64.45 112.473 178.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.626 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 49.1 mt-10 -95.95 136.65 36.11 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 116.182 -0.463 . . . . 73.13 110.884 173.344 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 52.1 m80 -142.66 143.19 25.1 Favored Pre-proline 0 N--CA 1.471 0.623 0 C-N-CA 122.18 0.192 . . . . 73.15 111.393 177.222 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -71.75 -18.99 28.1 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.387 2.058 . . . . 71.0 112.921 -178.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 66.4 p -119.19 150.08 40.65 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.128 0.49 . . . . 73.21 111.524 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.442 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -67.77 -33.37 74.71 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.224 -0.444 . . . . 52.35 111.144 177.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -59.46 -48.34 82.04 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.28 -0.418 . . . . 72.41 111.629 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -63.34 -34.43 77.7 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.801 0.334 . . . . 71.33 111.862 177.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.51 -40.3 92.86 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 120.904 0.383 . . . . 74.23 110.786 174.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.442 ' HG3' ' O ' ' A' ' 47' ' ' ALA . 64.7 mtt -67.08 -34.41 77.59 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.285 -0.416 . . . . 75.13 111.42 176.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.493 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 12.7 t70 -57.27 -53.19 60.97 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.05 0.452 . . . . 73.35 110.823 176.137 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.07 -31.56 72.15 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 116.239 -0.437 . . . . 54.34 111.331 178.369 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.435 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 87.8 tttt -62.59 -49.01 76.95 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 116.241 -0.436 . . . . 71.42 110.95 175.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -59.43 -43.64 93.06 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 116.277 -0.419 . . . . 64.32 111.217 176.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.493 ' HG3' ' O ' ' A' ' 52' ' ' ASP . 78.5 mtp180 -59.03 -38.71 79.92 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.81 0.338 . . . . 72.3 111.174 176.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -64.93 -39.55 93.68 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-O 121.062 0.458 . . . . 71.02 110.979 175.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 54' ' ' LYS . 42.3 mt-10 -69.52 -36.25 76.25 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.168 -0.469 . . . . 73.33 111.569 179.372 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 . . . . . 0 CA--C 1.543 0.69 0 C-N-CA 122.42 0.288 . . . . 73.34 111.129 174.61 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 . . . . . 0 N--CA 1.473 0.699 0 N-CA-C 112.016 0.376 . . . . 54.02 112.016 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.435 ' O ' ' HE2' ' A' ' 54' ' ' LYS . . . -120.85 155.58 33.8 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.837 0.351 . . . . 33.52 111.335 175.368 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 26.2 p90 -139.04 142.24 38.24 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.168 0.508 . . . . 73.11 111.588 178.469 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 64.8 mt -94.02 131.13 41.79 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 116.12 -0.491 . . . . 74.14 111.51 -178.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 67.3 t -117.91 127.79 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-O 120.817 0.342 . . . . 71.21 111.18 178.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 75.3 p -86.79 112.81 22.07 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.136 0.493 . . . . 74.21 111.95 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.5 pt -114.85 176.83 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 116.084 -0.507 . . . . 62.1 110.57 174.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.551 ' HB2' ' HB ' ' A' ' 24' ' ' THR . 10.2 pt-20 -140.83 126.91 19.51 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.266 0.555 . . . . 72.31 111.879 177.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -104.94 170.25 7.98 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.115 -0.493 . . . . 74.22 110.745 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 98.88 -168.33 22.36 Favored Glycine 0 CA--C 1.527 0.84 0 C-N-CA 120.846 -0.692 . . . . 32.22 113.562 177.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -70.04 143.12 91.14 Favored Pre-proline 0 N--CA 1.472 0.65 0 N-CA-C 112.064 0.394 . . . . 62.32 112.064 -178.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -54.32 119.45 6.38 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.465 2.11 . . . . 62.2 111.815 176.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.2 -47.71 1.34 Allowed Glycine 0 CA--C 1.526 0.74 0 C-N-CA 121.322 -0.466 . . . . 35.25 112.373 -174.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -99.33 60.43 1.17 Allowed 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.047 0.451 . . . . 73.12 110.65 176.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.551 ' HB ' ' HB2' ' A' ' 17' ' ' GLU . 38.6 p -98.52 154.46 17.88 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 113.029 0.751 . . . . 51.32 113.029 -174.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 56.9 t -110.8 127.12 68.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-N 115.618 -0.719 . . . . 62.42 110.458 175.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 88.2 m -72.96 115.33 12.14 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 112.25 0.463 . . . . 75.5 112.25 -178.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 56.7 m95 -110.07 141.37 43.01 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.227 -0.442 . . . . 64.13 111.104 176.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -103.29 115.27 30.24 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.529 -0.305 . . . . 71.23 110.876 178.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.588 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 90.0 mt-30 -94.33 119.22 32.77 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 120.959 0.409 . . . . 53.43 111.572 176.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.2 tp -84.51 110.97 19.08 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 120.863 0.363 . . . . 75.3 110.122 174.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 47.0 mtp180 -118.92 166.64 12.58 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.473 -0.33 . . . . 73.21 110.673 -176.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -133.04 144.03 49.78 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 111.68 0.252 . . . . 54.42 111.68 178.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -79.41 -28.52 41.79 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 111.963 0.357 . . . . 73.43 111.963 178.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 85.7 m-70 -107.01 128.34 26.27 Favored Pre-proline 0 CA--C 1.542 0.67 0 CA-C-N 116.605 -0.27 . . . . 71.03 111.385 -175.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -85.84 -22.36 13.32 Favored 'Cis proline' 0 C--N 1.354 0.864 0 C-N-CA 123.969 -1.263 . . . . 70.11 113.249 -2.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -117.7 141.94 29.82 Favored Pre-proline 0 N--CA 1.469 0.51 0 CA-C-N 116.32 -0.4 . . . . 74.45 111.114 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_exo -61.19 -24.44 79.07 Favored 'Trans proline' 0 N--CA 1.479 0.631 0 C-N-CA 122.594 2.196 . . . . 70.12 112.088 177.123 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -82.13 10.84 5.98 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.504 -0.771 . . . . 54.51 111.982 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 51.7 m -73.56 89.31 1.7 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.065 0.459 . . . . 61.44 111.007 177.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 60.8 tp -85.57 125.1 32.84 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.19 -0.459 . . . . 65.41 110.861 178.198 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.6 mm -92.25 -53.92 8.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-O 120.741 0.305 . . . . 72.1 111.561 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 84.0 p -168.71 152.37 5.51 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 112.194 0.442 . . . . 73.21 112.194 -178.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.588 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 49.2 mt-10 -105.15 135.65 46.11 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 116.215 -0.448 . . . . 74.12 110.587 174.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 37.9 m80 -138.41 136.79 19.46 Favored Pre-proline 0 CA--C 1.539 0.534 0 O-C-N 122.394 -0.191 . . . . 64.42 111.497 179.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -76.57 -4.31 14.85 Favored 'Trans proline' 0 CA--C 1.54 0.824 0 C-N-CA 122.622 2.214 . . . . 73.24 113.569 -177.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 71.1 p -129.73 144.08 51.12 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.095 0.474 . . . . 74.44 111.24 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.76 -38.73 86.24 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.239 -0.437 . . . . 60.41 111.531 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.605 HE21 ' N ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -55.2 -49.32 72.21 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.642 0.258 . . . . 73.11 111.11 178.335 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.605 ' N ' HE21 ' A' ' 48' ' ' GLN . 10.7 mm-40 -63.28 -35.92 81.96 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 120.936 0.398 . . . . 74.13 111.664 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.37 -52.91 50.46 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.048 0.452 . . . . 61.33 111.203 176.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 87.8 mtp -62.09 -37.7 86.07 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 116.012 -0.54 . . . . 74.25 111.347 177.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.478 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 20.2 t70 -61.09 -52.23 65.78 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.874 -0.603 . . . . 64.14 110.924 178.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.56 -39.94 92.93 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.241 -0.436 . . . . 60.11 111.398 176.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.435 ' HE2' ' O ' ' A' ' 11' ' ' ALA . 61.0 tttm -56.27 -54.92 39.6 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 120.93 0.395 . . . . 74.15 111.448 179.35 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.478 ' HG2' ' O ' ' A' ' 52' ' ' ASP . 22.4 pttm -58.28 -40.81 82.88 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.563 -0.29 . . . . 73.41 110.328 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 69.5 mtp180 -67.21 -25.69 66.24 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 111.985 0.365 . . . . 64.43 111.985 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 75.4 t80 -77.02 -29.67 55.45 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 120.909 0.385 . . . . 64.3 111.509 174.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -102.54 -15.71 16.34 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.445 0.905 . . . . 74.01 113.445 -177.14 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 . . . . . 0 N--CA 1.475 0.792 0 O-C-N 121.993 -0.442 . . . . 64.32 112.039 179.225 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.62 0 N-CA-C 110.197 -0.297 . . . . 63.11 110.197 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.481 ' HB3' ' HG3' ' A' ' 54' ' ' LYS . . . -113.06 166.28 11.57 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.674 0.273 . . . . 74.5 111.009 176.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 22.6 p90 -155.78 143.56 19.67 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.248 0.547 . . . . 63.45 111.907 177.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 57.1 mt -96.85 111.32 26.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 CA-C-N 115.949 -0.568 . . . . 64.32 112.277 -175.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 72.4 t -106.26 126.89 61.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 122.518 0.327 . . . . 72.44 111.188 178.025 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 61.7 p -87.23 124.12 32.98 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 122.201 -0.312 . . . . 74.02 111.544 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.521 HD13 ' NE2' ' A' ' 29' ' ' GLN . 43.3 pt -114.63 154.37 16.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 CA-C-O 121.005 0.431 . . . . 75.43 111.705 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -100.74 109.68 21.72 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.19 -0.459 . . . . 71.42 111.733 -179.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.509 ' HE2' HD11 ' A' ' 16' ' ' ILE . 67.6 mttm -104.47 177.7 4.77 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 120.756 0.312 . . . . 75.4 110.285 175.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 88.32 -136.58 13.83 Favored Glycine 0 CA--C 1.527 0.793 0 C-N-CA 120.682 -0.77 . . . . 73.4 113.721 176.013 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -102.4 160.59 25.89 Favored Pre-proline 0 CA--C 1.54 0.578 0 CA-C-O 120.739 0.305 . . . . 62.42 111.669 -177.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -60.42 132.44 43.58 Favored 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 122.034 1.823 . . . . 74.33 111.685 169.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 80.37 -61.49 4.42 Favored Glycine 0 CA--C 1.528 0.864 0 C-N-CA 120.794 -0.717 . . . . 44.41 112.426 -175.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -87.39 75.8 9.17 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 121.449 0.642 . . . . 72.44 110.426 174.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 65.4 p -94.46 165.04 12.75 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.608 0.718 . . . . 64.12 112.632 -177.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 40.4 t -122.2 110.44 27.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-N 115.33 -0.85 . . . . 73.14 109.58 172.319 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 59.0 m -78.03 115.57 17.86 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.986 0.422 . . . . 72.11 111.963 -177.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 40.4 m95 -108.44 140.03 42.33 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.084 0.469 . . . . 73.52 111.561 178.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -92.35 114.31 26.82 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.228 -0.442 . . . . 70.51 110.931 178.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.692 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 76.6 mt-30 -97.84 116.99 31.16 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.341 -0.39 . . . . 74.43 111.553 178.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 49.8 tp -85.61 103.75 14.72 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 120.768 0.318 . . . . 73.2 110.183 173.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -103.71 148.24 26.29 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 110.319 -0.252 . . . . 70.33 110.319 178.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -124.02 149.11 46.44 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 112.139 0.422 . . . . 62.31 112.139 -178.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.635 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 34.4 t70 -66.38 -25.07 66.61 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 113.344 0.868 . . . . 72.32 113.344 -173.357 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 43.8 m-70 -122.06 142.5 36.68 Favored Pre-proline 0 N--CA 1.475 0.809 0 O-C-N 121.739 -0.601 . . . . 72.33 111.729 -178.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -74.42 -28.92 7.04 Favored 'Cis proline' 0 C--N 1.359 1.087 0 C-N-CA 124.182 -1.174 . . . . 62.12 113.385 0.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm -121.21 143.79 38.14 Favored Pre-proline 0 N--CA 1.467 0.408 0 N-CA-C 110.152 -0.314 . . . . 75.0 110.152 174.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.635 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 11.0 Cg_endo -52.36 -31.88 49.3 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.025 2.483 . . . . 72.35 114.62 -171.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -99.79 20.83 13.45 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 112.618 0.599 . . . . 72.22 112.618 -177.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 26.7 m -62.18 101.15 0.2 Allowed 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 121.266 0.555 . . . . 31.22 110.975 174.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.414 HD13 ' HB3' ' A' ' 29' ' ' GLN . 50.9 tp -72.41 106.51 4.56 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.764 -0.653 . . . . 65.41 112.259 -177.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 47.3 mm -65.31 -54.29 30.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-N 116.274 -0.421 . . . . 72.52 111.099 176.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 42.1 t -169.22 149.77 4.22 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 112.043 0.386 . . . . 74.35 112.043 -178.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.692 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 46.1 mt-10 -103.03 125.12 49.64 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 116.251 -0.431 . . . . 73.34 110.802 176.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 84.7 m-70 -128.2 148.62 68.46 Favored Pre-proline 0 N--CA 1.477 0.905 0 N-CA-C 111.797 0.295 . . . . 75.02 111.797 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -73.61 -21.25 19.47 Favored 'Trans proline' 0 CA--C 1.544 1.018 0 C-N-CA 122.547 2.165 . . . . 72.55 113.451 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 33.4 p -118.73 152.36 36.29 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 120.927 0.394 . . . . 45.35 111.654 179.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.41 -35.21 77.32 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.313 -0.403 . . . . 60.22 111.394 176.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -53.6 -49.12 68.46 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 120.767 0.318 . . . . 64.52 111.834 -179.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -58.76 -44.07 90.48 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 120.991 0.424 . . . . 74.14 111.743 178.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.38 -40.72 85.71 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 116.273 -0.421 . . . . 64.45 111.77 179.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 65.7 mtt -64.47 -43.22 94.86 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.856 0.36 . . . . 73.1 110.964 177.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -55.09 -51.1 67.46 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.076 0.465 . . . . 73.11 110.602 175.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.62 -35.58 78.3 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.011 -0.54 . . . . 71.3 111.487 179.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.481 ' HG3' ' HB3' ' A' ' 11' ' ' ALA . 63.2 tttm -63.6 -56.02 19.14 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 116.487 -0.324 . . . . 64.11 111.315 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 11.9 mptt -59.14 -43.72 92.02 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.102 0.477 . . . . 72.13 111.103 176.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 51.2 ttm-85 -65.85 -30.67 71.32 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.087 -0.506 . . . . 64.51 111.478 -178.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -67.88 -41.87 82.14 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 116.224 -0.443 . . . . 71.32 110.96 175.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -77.78 -8.58 58.2 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 112.696 0.628 . . . . 73.44 112.696 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 38.0 t70 . . . . . 0 CA--C 1.546 0.799 0 CA-C-O 121.014 0.435 . . . . 75.21 111.189 179.035 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 . . . . . 0 CA--C 1.537 0.464 0 CA-C-O 120.89 0.376 . . . . 75.04 111.678 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -129.49 158.04 40.33 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.114 -0.494 . . . . 54.22 111.119 177.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 39.5 p90 -151.37 155.24 38.26 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.099 0.476 . . . . 62.14 112.004 -177.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 60.1 mt -98.12 128.39 49.6 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 N-CA-C 112.401 0.519 . . . . 73.44 112.401 -176.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 48.7 t -115.67 141.7 31.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 122.604 0.362 . . . . 73.53 110.944 176.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 60.8 p -102.1 128.47 48.55 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 121.166 0.508 . . . . 74.44 112.005 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.545 HD13 ' NE2' ' A' ' 29' ' ' GLN . 41.9 pt -132.72 176.35 9.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-O 121.005 0.431 . . . . 73.04 111.094 176.674 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.54 ' HB2' ' HB ' ' A' ' 24' ' ' THR . 9.1 pt-20 -137.23 137.96 39.63 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.097 0.475 . . . . 73.44 111.674 177.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.401 ' HE3' HD11 ' A' ' 16' ' ' ILE . 95.4 mttt -127.53 164.91 20.92 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.113 -0.494 . . . . 73.25 111.016 179.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.74 -140.16 14.76 Favored Glycine 0 CA--C 1.533 1.18 0 N-CA-C 114.698 0.639 . . . . 71.13 114.698 175.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -86.1 157.11 57.18 Favored Pre-proline 0 N--CA 1.473 0.687 0 N-CA-C 112.279 0.474 . . . . 70.52 112.279 -173.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.35 141.4 68.1 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 122.092 1.861 . . . . 73.44 111.82 174.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.2 -61.75 3.79 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 120.949 -0.643 . . . . 74.25 112.477 -176.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -92.23 71.78 5.34 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 121.277 0.56 . . . . 74.13 111.099 176.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.54 ' HB ' ' HB2' ' A' ' 17' ' ' GLU . 63.1 p -93.88 159.2 15.29 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.737 -0.665 . . . . 61.24 111.236 178.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 61.0 t -108.98 127.78 65.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-N 116.521 -0.309 . . . . 64.3 111.028 178.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 37.8 m -76.78 116.11 17.15 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.773 0.32 . . . . 72.44 111.849 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -112.31 131.08 55.71 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.051 0.453 . . . . 75.2 111.281 176.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -96.9 114.13 25.72 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.034 0.445 . . . . 74.04 110.637 177.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.545 ' NE2' HD13 ' A' ' 16' ' ' ILE . 92.5 mt-30 -94.37 119.28 32.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.053 -0.521 . . . . 54.41 111.546 179.429 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.8 tp -83.45 107.36 15.89 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.197 -0.297 . . . . 74.5 110.197 172.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 31' ' ' ARG . 50.9 mtt180 -111.86 161.31 16.5 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 120.918 0.389 . . . . 71.12 111.231 179.435 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -123.25 166.88 14.51 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 120.988 0.423 . . . . 53.42 111.343 178.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -86.79 -37.71 17.55 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 116.381 -0.372 . . . . 62.15 111.841 -178.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 43.6 m80 -115.22 147.79 39.29 Favored Pre-proline 0 N--CA 1.475 0.777 0 C-N-CA 122.439 0.296 . . . . 74.2 111.555 178.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -82.7 -2.19 52.3 Favored 'Cis proline' 0 C--N 1.355 0.918 0 C-N-CA 124.147 -1.189 . . . . 74.54 112.851 -2.244 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -140.66 135.54 15.77 Favored Pre-proline 0 N--CA 1.466 0.372 0 CA-C-N 115.742 -0.663 . . . . 64.41 110.246 177.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -61.73 -20.95 70.98 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 121.939 1.759 . . . . 74.53 111.687 175.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -80.38 -3.03 48.08 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 115.632 -0.713 . . . . 73.12 111.629 177.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 42.5 t -60.79 96.61 0.05 OUTLIER 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 121.05 0.452 . . . . 75.13 112.176 -175.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 64.9 tp -81.39 106.47 13.38 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.067 0.46 . . . . 65.21 111.062 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.2 mm -71.6 -51.73 30.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 116.386 -0.37 . . . . 54.1 111.135 179.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 43.2 t -171.53 149.55 2.67 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 116.382 -0.372 . . . . 72.32 111.747 178.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.483 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 52.0 mt-10 -102.1 141.26 35.22 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 116.452 -0.34 . . . . 71.35 110.885 177.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 64.2 m80 -144.07 141.22 18.0 Favored Pre-proline 0 CA--C 1.539 0.53 0 O-C-N 122.304 -0.247 . . . . 73.3 111.269 178.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.49 -12.64 24.95 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 122.431 2.087 . . . . 71.51 113.156 -178.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 80.3 p -122.58 141.88 51.23 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-O 121.051 0.453 . . . . 73.43 111.212 177.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.28 -31.84 72.44 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.356 -0.384 . . . . 63.51 111.696 -179.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.412 HE21 ' C ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -54.51 -46.98 73.62 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 120.704 0.288 . . . . 45.11 110.755 177.614 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -60.92 -39.48 89.58 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.996 0.427 . . . . 74.32 111.575 175.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.68 -37.89 89.13 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 116.331 -0.395 . . . . 72.14 111.023 176.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 67.3 mtt -68.44 -51.97 37.81 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.594 -0.276 . . . . 74.31 111.515 177.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -57.36 -41.35 79.97 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 120.773 0.32 . . . . 70.15 111.854 178.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.07 -40.19 87.0 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 120.85 0.357 . . . . 61.5 111.132 175.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 52.5 tttp -62.77 -58.64 6.73 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 122.669 0.387 . . . . 71.2 112.024 178.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -56.45 -36.39 68.97 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 121.207 0.527 . . . . 71.21 111.655 -179.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 32.5 ttp180 -80.44 -26.5 38.35 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 116.007 -0.542 . . . . 74.33 111.798 -178.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -81.6 -42.72 19.65 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.752 0.31 . . . . 73.34 111.537 178.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -64.42 -9.71 20.1 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 121.491 0.662 . . . . 72.42 111.155 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.8 t70 . . . . . 0 CA--C 1.548 0.897 0 CA-C-N 115.406 -0.815 . . . . 61.33 109.657 171.502 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 . . . . . 0 CA--C 1.537 0.46 0 CA-C-O 120.595 0.236 . . . . 74.11 111.264 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.537 ' O ' ' HE2' ' A' ' 54' ' ' LYS . . . -106.73 146.31 30.97 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 120.614 0.245 . . . . 73.44 111.427 179.345 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 40.2 p90 -144.98 153.24 41.29 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.162 0.506 . . . . 73.41 112.132 179.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.2 mt -96.18 135.21 31.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-N 116.095 -0.502 . . . . 71.03 111.951 -178.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 95.4 t -123.9 134.56 66.15 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-N 116.143 -0.48 . . . . 75.5 110.897 177.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 65.3 p -96.45 124.96 40.62 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 120.899 0.38 . . . . 71.2 111.807 -178.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.419 HD13 ' NE2' ' A' ' 29' ' ' GLN . 35.2 pt -126.14 170.79 15.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-N 116.317 -0.401 . . . . 75.4 111.462 179.22 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -128.49 135.11 49.0 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 116.351 -0.386 . . . . 74.41 110.858 178.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -122.43 158.11 30.45 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 120.896 0.379 . . . . 75.03 111.844 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.62 -138.79 14.08 Favored Glycine 0 CA--C 1.529 0.931 0 CA-C-N 116.268 -0.424 . . . . 63.51 113.966 177.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 54.2 mttp -94.64 155.46 39.43 Favored Pre-proline 0 CA--C 1.541 0.609 0 N-CA-C 111.926 0.343 . . . . 74.14 111.926 -174.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -52.96 130.3 37.22 Favored 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 122.879 2.386 . . . . 72.54 113.185 -178.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 77.46 -64.47 3.22 Favored Glycine 0 CA--C 1.523 0.55 0 C-N-CA 121.123 -0.561 . . . . 72.3 112.822 -178.208 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -80.93 71.53 7.89 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.272 0.558 . . . . 63.31 110.942 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 45.6 p -106.6 172.24 6.92 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.429 0.633 . . . . 75.31 112.201 -176.389 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 91.1 t -111.25 128.66 67.58 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-N 115.745 -0.662 . . . . 75.13 109.981 169.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 87.2 m -83.94 115.37 22.27 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.122 0.487 . . . . 71.23 111.762 -176.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 65.1 m95 -109.07 149.76 28.81 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 116.132 -0.485 . . . . 73.11 111.612 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -112.94 116.06 29.39 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.237 -0.438 . . . . 72.11 111.078 -179.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.699 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 85.4 mt-30 -101.02 133.33 45.67 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.297 -0.411 . . . . 62.24 111.882 -179.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.472 HD11 ' HB1' ' A' ' 11' ' ' ALA . 56.7 tp -91.66 111.35 22.82 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 110.145 -0.317 . . . . 73.15 110.145 172.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 37.5 mtp180 -115.12 148.67 38.68 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 110.17 -0.307 . . . . 73.54 110.17 -178.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -115.06 160.81 19.19 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.923 0.712 . . . . 73.52 112.923 -175.057 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -71.16 -36.0 71.86 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 115.461 -0.79 . . . . 73.25 112.498 -177.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.488 ' HA ' ' C ' ' A' ' 35' ' ' PRO . 45.6 m-70 -137.45 157.14 74.49 Favored Pre-proline 0 CA--C 1.544 0.724 0 C-N-CA 122.289 0.235 . . . . 74.34 111.473 -179.365 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.488 ' C ' ' HA ' ' A' ' 34' ' ' HIS . 24.5 Cg_endo -60.47 -47.98 0.18 OUTLIER 'Cis proline' 0 C--N 1.363 1.334 0 C-N-CA 124.906 -0.872 . . . . 55.22 113.85 2.387 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -112.85 150.12 42.31 Favored Pre-proline 0 CA--C 1.538 0.489 0 CA-C-O 120.466 0.174 . . . . 74.21 110.702 175.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -65.82 -22.85 56.04 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 122.091 1.86 . . . . 70.43 112.602 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -75.88 -9.32 58.51 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 116.434 -0.348 . . . . 64.43 111.159 178.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 98.5 p -53.91 116.68 2.67 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 121.407 0.622 . . . . 63.2 112.267 -176.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 57.8 tp -95.09 117.43 30.17 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.156 -0.474 . . . . 64.03 111.006 177.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 50.3 mm -78.73 -54.23 12.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-O 120.909 0.385 . . . . 74.53 110.944 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 36.9 t -168.94 162.14 11.03 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.024 0.44 . . . . 74.04 111.729 179.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.699 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 40.6 mt-10 -116.85 138.12 51.73 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 116.003 -0.544 . . . . 72.34 110.887 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 50.4 m80 -143.25 147.27 39.81 Favored Pre-proline 0 N--CA 1.472 0.647 0 CA-C-O 120.597 0.236 . . . . 71.31 111.102 178.074 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -77.38 -4.37 14.64 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.571 2.181 . . . . 61.31 113.268 -178.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 31.1 p -128.0 144.4 51.1 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 120.831 0.348 . . . . 74.04 111.185 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.409 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -66.37 -33.71 76.34 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 120.829 0.347 . . . . 52.13 111.104 177.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -55.67 -52.13 64.9 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 116.264 -0.425 . . . . 75.03 111.116 179.331 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -58.32 -41.0 83.57 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.063 0.459 . . . . 74.01 111.533 177.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.75 -38.65 88.76 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.938 0.399 . . . . 63.02 111.27 178.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.468 ' O ' ' HG3' ' A' ' 55' ' ' LYS . 66.2 mtt -68.48 -43.51 76.76 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 116.277 -0.42 . . . . 74.2 110.884 176.344 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -54.68 -44.11 73.07 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.274 0.559 . . . . 74.21 111.236 177.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.07 -39.16 75.79 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 116.155 -0.475 . . . . 71.14 111.56 176.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.537 ' HE2' ' O ' ' A' ' 11' ' ' ALA . 62.2 tttm -56.09 -50.09 72.0 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 121.081 0.467 . . . . 75.14 110.928 177.723 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 51' ' ' MET . 62.7 mttm -61.15 -47.65 85.26 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.983 -0.553 . . . . 72.21 111.241 179.479 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 41.9 ttp180 -65.69 -25.18 67.21 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 115.969 -0.559 . . . . 73.01 111.713 -177.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -79.0 -51.58 9.4 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 121.131 0.491 . . . . 71.02 111.339 176.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -67.4 -32.43 73.33 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 116.351 -0.386 . . . . 73.22 111.75 -177.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 . . . . . 0 CA--C 1.536 0.432 0 N-CA-C 110.134 -0.321 . . . . 61.33 110.134 171.252 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.724 0 CA-C-O 121.123 0.487 . . . . 71.21 111.91 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -138.7 -174.85 3.94 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 116.174 -0.466 . . . . 63.41 111.7 -179.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -159.56 169.66 23.34 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.92 0.39 . . . . 75.4 111.325 179.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.9 mt -112.12 139.15 38.11 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 CA-C-O 120.995 0.426 . . . . 74.11 111.7 179.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.515 HG21 ' HD2' ' A' ' 31' ' ' ARG . 89.3 t -115.62 136.31 52.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 CA-C-N 116.444 -0.344 . . . . 71.52 110.79 175.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 50.7 p -104.09 113.2 26.57 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 112.184 0.439 . . . . 71.24 112.184 -178.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 38.8 pt -114.06 168.09 6.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 CA-C-N 116.432 -0.349 . . . . 61.43 110.994 176.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -126.12 134.68 51.27 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 121.218 0.532 . . . . 74.15 111.611 -177.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -129.15 160.24 33.49 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 116.231 -0.441 . . . . 72.42 111.294 178.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.52 -137.22 13.13 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 121.132 -0.556 . . . . 61.13 113.91 177.393 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -87.66 144.28 35.05 Favored Pre-proline 0 N--CA 1.469 0.507 0 O-C-N 122.682 -0.305 . . . . 63.3 111.64 -176.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -50.81 -43.78 44.81 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 122.987 2.458 . . . . 75.22 113.685 -177.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.08 -61.23 3.31 Favored Glycine 0 CA--C 1.526 0.725 0 C-N-CA 121.117 -0.564 . . . . 44.51 112.747 179.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -100.06 84.09 2.8 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.111 0.481 . . . . 64.51 111.161 178.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 48.2 p -85.69 159.13 19.88 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.405 0.622 . . . . 64.33 111.936 178.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 57.4 t -109.3 124.11 65.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 CA-C-N 115.899 -0.591 . . . . 74.44 109.983 173.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 85.8 m -80.91 115.27 20.31 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.11 0.481 . . . . 74.42 111.643 -178.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 60.7 m95 -105.75 131.25 53.33 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.027 -0.533 . . . . 74.34 110.999 176.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 51.9 m-85 -97.09 114.18 25.82 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.138 -0.483 . . . . 62.14 111.087 -178.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.534 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 87.7 mt-30 -91.83 108.81 20.18 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.223 -0.444 . . . . 70.51 111.186 176.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.0 tp -71.1 109.54 5.23 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.026 0.441 . . . . 61.01 110.434 172.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.515 ' HD2' HG21 ' A' ' 14' ' ' VAL . 58.5 mtt180 -125.17 158.11 34.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.145 0.498 . . . . 74.2 111.406 -178.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -118.14 157.44 26.92 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.236 -0.438 . . . . 72.52 110.325 172.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.439 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 29.4 t70 -86.82 -20.12 28.01 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.441 0.638 . . . . 75.34 110.486 174.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 48.5 m80 -126.65 138.78 33.19 Favored Pre-proline 0 CA--C 1.542 0.644 0 CA-C-N 115.9 -0.591 . . . . 61.4 110.858 -179.084 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -82.69 -1.34 52.59 Favored 'Cis proline' 0 CA--C 1.542 0.882 0 C-N-CA 124.292 -1.128 . . . . 74.2 113.417 0.011 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -136.99 142.77 39.68 Favored Pre-proline 0 N--CA 1.469 0.515 0 CA-C-N 116.311 -0.404 . . . . 71.11 110.409 177.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.439 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 55.6 Cg_endo -71.15 -37.13 6.33 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 122.264 1.976 . . . . 71.31 112.817 -177.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -89.0 24.44 2.09 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.984 -0.448 . . . . 74.32 111.725 176.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.9 p -65.26 97.38 0.27 Allowed 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.223 0.535 . . . . 75.1 110.904 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 37.7 tp -78.85 102.83 8.41 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 120.99 0.424 . . . . 63.01 111.143 -178.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 39.3 mm -84.33 -47.86 17.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-O 120.983 0.42 . . . . 73.34 111.205 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 43.7 t -164.3 157.08 17.28 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 116.426 -0.352 . . . . 74.13 111.945 -178.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.534 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 45.2 mt-10 -130.36 125.03 33.61 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 122.453 0.301 . . . . 75.34 110.816 176.256 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 33.4 m80 -139.6 146.17 46.71 Favored Pre-proline 0 N--CA 1.473 0.71 0 CA-C-O 120.693 0.283 . . . . 72.2 111.615 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -76.28 -12.14 19.12 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.573 2.182 . . . . 65.31 113.411 -176.053 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 32.2 p -118.54 142.89 47.16 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 120.897 0.38 . . . . 63.22 111.219 178.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.73 -33.21 75.34 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 120.612 0.244 . . . . 50.14 111.401 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 26.0 tp60 -53.85 -48.17 70.24 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.471 -0.331 . . . . 71.54 111.505 177.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -62.73 -42.67 99.77 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.889 0.376 . . . . 74.15 111.545 177.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.58 -43.94 92.27 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.333 -0.394 . . . . 65.41 111.575 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 90.8 mtp -67.08 -39.21 86.77 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.362 -0.381 . . . . 74.41 111.399 179.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.421 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 37.9 t70 -63.56 -40.35 96.77 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 120.961 0.41 . . . . 70.32 111.157 177.405 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -75.49 -32.8 60.68 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 116.132 -0.486 . . . . 52.22 111.433 177.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -59.55 -52.21 66.54 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.471 -0.331 . . . . 60.23 111.242 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' 52' ' ' ASP . 19.3 pttm -58.45 -25.97 62.82 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.383 0.611 . . . . 75.12 110.985 177.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -78.08 -44.78 25.29 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.8 -0.637 . . . . 74.34 111.397 -179.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -68.32 -37.03 80.16 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.915 0.388 . . . . 75.31 111.377 178.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -78.56 13.87 1.47 Allowed 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.436 -0.347 . . . . 63.14 111.915 -178.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 16.8 t0 . . . . . 0 CA--C 1.544 0.742 0 N-CA-C 110.118 -0.327 . . . . 71.05 110.118 175.647 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 . . . . . 0 N--CA 1.472 0.645 0 N-CA-C 112.418 0.525 . . . . 62.23 112.418 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.51 160.42 21.77 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.086 -0.506 . . . . 74.23 111.594 178.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 50.6 p90 -142.59 145.38 33.49 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.471 -0.331 . . . . 72.12 110.819 177.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 62.2 mt -104.01 131.32 53.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-O 121.074 0.464 . . . . 75.42 111.838 -178.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 63.0 t -116.03 125.49 73.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 CA-C-N 116.246 -0.434 . . . . 51.13 111.043 177.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 42.9 p -87.19 120.84 28.88 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 120.975 0.417 . . . . 73.45 111.39 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.452 HD13 ' NE2' ' A' ' 29' ' ' GLN . 35.1 pt -118.08 166.9 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-O 120.863 0.363 . . . . 73.4 111.348 178.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.436 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 44.0 mt-10 -125.1 114.82 19.56 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.494 -0.321 . . . . 62.23 110.865 178.486 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -122.45 174.16 7.21 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 116.608 -0.269 . . . . 64.32 111.661 -177.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.71 -136.89 12.94 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 121.013 -0.613 . . . . 73.13 112.808 -178.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -79.21 153.91 77.04 Favored Pre-proline 0 CA--C 1.539 0.545 0 O-C-N 122.469 -0.43 . . . . 70.34 111.22 178.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -57.78 -44.23 42.71 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.396 2.064 . . . . 74.31 112.474 176.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -82.89 -46.01 6.46 Favored Glycine 0 CA--C 1.528 0.853 0 C-N-CA 121.301 -0.476 . . . . 43.21 112.839 177.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -96.83 79.5 2.94 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.1 0.476 . . . . 74.43 111.286 178.171 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.436 ' HB ' ' HB3' ' A' ' 17' ' ' GLU . 69.3 p -88.23 146.18 25.49 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.969 -0.56 . . . . 74.01 111.54 178.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 54.8 t -109.47 128.6 65.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.917 -0.583 . . . . 73.44 110.33 174.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 94.6 m -79.21 114.22 17.97 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.135 0.493 . . . . 65.3 111.082 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -110.07 131.29 55.19 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 116.146 -0.479 . . . . 74.25 111.52 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -93.28 114.21 26.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.834 0.35 . . . . 74.35 110.538 176.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.816 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 72.9 mt-30 -98.01 113.65 25.56 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.412 -0.358 . . . . 70.15 111.668 -179.342 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 54.8 tp -79.53 116.72 19.91 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.352 -0.385 . . . . 74.41 110.513 174.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.426 HH11 ' HD3' ' A' ' 31' ' ' ARG . 51.7 mtt180 -129.26 170.5 13.53 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.869 0.366 . . . . 71.14 111.97 -177.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -136.01 167.09 21.88 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.981 0.42 . . . . 73.52 111.129 175.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -95.53 -9.74 31.57 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 112.271 0.471 . . . . 74.04 112.271 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 39.9 m80 -142.81 149.53 50.18 Favored Pre-proline 0 CA--C 1.541 0.606 0 O-C-N 122.357 -0.214 . . . . 54.42 110.95 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -70.54 -21.98 10.61 Favored 'Cis proline' 0 C--N 1.356 0.95 0 C-N-CA 124.392 -1.087 . . . . 70.43 113.244 -0.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -118.55 135.28 23.57 Favored Pre-proline 0 N--CA 1.47 0.557 0 CA-C-N 116.705 -0.225 . . . . 73.02 110.708 176.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.0 -27.21 84.37 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 122.219 1.946 . . . . 64.11 111.592 174.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -77.77 -2.39 36.09 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 115.2 -0.909 . . . . 74.23 112.504 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 90.2 p -58.44 110.46 0.98 Allowed 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.271 0.558 . . . . 73.31 112.327 -173.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 56.4 tp -104.03 114.45 28.71 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.918 -0.583 . . . . 71.41 110.463 176.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.3 mm -83.64 -53.6 10.91 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 116.288 -0.415 . . . . 74.34 111.935 -177.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.413 ' HG ' ' CD2' ' A' ' 44' ' ' HIS . 40.6 t -162.78 157.53 21.64 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.389 0.514 . . . . 64.24 112.389 -175.58 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.816 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 37.4 mt-10 -120.96 118.41 29.79 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 116.243 -0.435 . . . . 73.02 110.753 177.135 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . 0.413 ' CD2' ' HG ' ' A' ' 42' ' ' SER . 61.8 m170 -123.49 143.6 41.9 Favored Pre-proline 0 N--CA 1.475 0.791 0 O-C-N 122.375 -0.203 . . . . 74.0 111.278 -178.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -70.1 -22.93 29.85 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 122.632 2.221 . . . . 44.15 114.13 -176.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.461 ' OG1' ' HB2' ' A' ' 49' ' ' GLU . 59.6 p -120.74 153.78 36.52 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.11 0.481 . . . . 71.51 111.508 178.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.17 -45.32 70.31 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.262 -0.426 . . . . 65.12 111.811 -177.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.81 -50.58 70.14 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 120.954 0.407 . . . . 64.32 110.637 179.346 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.461 ' HB2' ' OG1' ' A' ' 46' ' ' THR . 0.7 OUTLIER -56.28 -39.59 72.92 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 121.357 0.599 . . . . 73.31 110.45 178.718 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.74 -41.29 75.47 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 116.292 -0.413 . . . . 45.34 111.857 177.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 85.1 mtp -67.59 -34.67 77.49 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 112.075 0.398 . . . . 65.54 112.075 -178.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.656 ' HA ' ' HE3' ' A' ' 55' ' ' LYS . 4.6 t70 -64.5 -30.86 71.89 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-O 121.128 0.489 . . . . 75.03 110.934 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -75.88 -40.3 54.78 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.343 0.592 . . . . 72.43 110.618 170.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 66.4 tttm -54.84 -47.51 74.06 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 115.563 -0.744 . . . . 75.32 111.691 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.656 ' HE3' ' HA ' ' A' ' 52' ' ' ASP . 18.6 ptpt -57.71 -38.86 75.98 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 116.558 -0.292 . . . . 74.53 111.521 179.347 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 80.1 ttt180 -73.79 -26.02 60.42 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 120.821 0.343 . . . . 74.42 111.798 -178.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -73.33 -51.27 18.08 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 120.854 0.359 . . . . 74.31 110.999 175.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -73.02 -34.51 66.4 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.241 -0.436 . . . . 64.1 112.096 -176.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 . . . . . 0 CA--C 1.549 0.906 0 CA-C-N 116.365 -0.38 . . . . 51.13 111.434 179.198 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.54 ' HA ' ' HG2' ' A' ' 58' ' ' GLU . 13.2 pt-20 . . . . . 0 CA--C 1.539 0.538 0 CA-C-O 120.884 0.374 . . . . 71.43 110.736 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.449 ' HB2' ' CD2' ' A' ' 57' ' ' TYR . . . -124.29 171.87 9.54 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 120.794 0.33 . . . . 70.32 111.534 179.259 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 36.9 p90 -147.36 157.62 43.65 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.139 0.495 . . . . 71.31 111.923 178.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 58.6 mt -100.4 137.26 28.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 CA-C-N 116.073 -0.512 . . . . 74.15 111.838 -177.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 61.1 t -117.07 127.44 74.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-N 116.163 -0.471 . . . . 64.24 110.571 177.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 65.1 p -95.06 114.41 26.21 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.017 0.437 . . . . 73.51 111.861 -178.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.4 pt -121.51 172.18 9.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 121.021 0.439 . . . . 51.12 111.259 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.405 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 1.6 mp0 -128.91 148.84 50.95 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 120.856 0.36 . . . . 61.15 111.057 177.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -134.15 166.68 22.21 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-O 120.844 0.354 . . . . 70.43 111.441 178.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.53 -143.17 16.17 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 121.234 -0.508 . . . . 71.43 113.734 178.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -81.26 142.93 51.43 Favored Pre-proline 0 N--CA 1.471 0.577 0 O-C-N 122.575 -0.368 . . . . 71.04 111.636 -178.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -53.44 116.93 3.3 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.371 2.048 . . . . 63.13 112.365 176.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 97.61 -67.41 0.8 Allowed Glycine 0 CA--C 1.526 0.751 0 C-N-CA 121.249 -0.501 . . . . 61.12 112.283 -174.37 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -80.95 75.56 7.91 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 121.361 0.6 . . . . 74.43 110.277 176.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.405 ' HB ' ' HB3' ' A' ' 17' ' ' GLU . 64.7 p -107.84 163.91 12.71 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.596 -0.729 . . . . 61.42 112.895 -173.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 59.0 t -110.14 127.65 66.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-N 115.489 -0.778 . . . . 74.43 110.201 171.271 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 51.4 m -82.26 118.86 23.44 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.402 0.519 . . . . 72.23 112.402 -175.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 67.7 m95 -110.37 149.42 30.27 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.191 -0.458 . . . . 75.5 111.512 178.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -110.2 114.63 28.27 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.878 0.371 . . . . 74.14 111.193 178.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.721 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 72.8 mt-30 -95.59 121.57 37.43 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.919 0.39 . . . . 75.14 111.542 178.23 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.6 tp -83.02 109.89 17.5 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.571 -0.286 . . . . 71.52 110.322 173.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 53.2 mtt180 -123.4 162.17 23.3 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.448 0.642 . . . . 71.24 112.184 -178.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -140.83 -179.35 6.01 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.516 -0.765 . . . . 65.53 110.72 175.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.511 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 20.4 m-20 -103.1 -0.98 29.87 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.203 0.525 . . . . 54.44 111.209 175.512 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -123.72 129.54 24.79 Favored Pre-proline 0 CA--C 1.544 0.725 0 CA-C-N 116.354 -0.384 . . . . 71.51 111.066 -178.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -78.76 -14.86 30.23 Favored 'Cis proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.757 -1.351 . . . . 60.42 113.206 -1.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -129.03 143.32 48.31 Favored Pre-proline 0 N--CA 1.472 0.663 0 C-N-CA 122.445 0.298 . . . . 61.24 111.101 -178.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.511 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 53.8 Cg_exo -54.54 -28.9 57.43 Favored 'Trans proline' 0 CA--C 1.545 1.073 0 C-N-CA 122.338 2.025 . . . . 42.32 113.023 174.26 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -88.98 16.64 6.7 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-O 121.03 0.443 . . . . 63.04 111.309 177.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 83.1 p -66.52 96.13 0.36 Allowed 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.45 0.643 . . . . 63.24 111.474 -179.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 56.7 tp -87.26 107.6 18.57 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.071 -0.513 . . . . 73.31 110.539 176.081 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 44.0 mm -73.47 -53.96 16.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 120.914 0.388 . . . . 75.24 111.054 178.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 70.1 m -163.55 149.94 11.87 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 120.953 0.406 . . . . 70.11 111.691 -178.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.721 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 42.4 mt-10 -108.2 119.22 38.85 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 116.181 -0.463 . . . . 74.5 110.511 174.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . 0.49 ' HB3' ' HB2' ' A' ' 49' ' ' GLU . 37.7 m170 -128.23 151.14 75.8 Favored Pre-proline 0 CA--C 1.543 0.696 0 N-CA-C 112.187 0.439 . . . . 55.33 112.187 -176.608 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.35 -31.89 8.71 Favored 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 122.857 2.371 . . . . 73.54 114.358 -176.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.449 ' OG1' ' HG2' ' A' ' 49' ' ' GLU . 43.9 p -115.06 152.05 33.18 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.192 0.52 . . . . 65.05 111.886 -177.266 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.48 -29.94 70.29 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.009 -0.541 . . . . 55.04 110.758 175.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 25.0 tp60 -59.09 -51.33 70.52 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.475 -0.33 . . . . 63.2 111.281 175.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.49 ' HB2' ' HB3' ' A' ' 44' ' ' HIS . 78.9 mm-40 -62.96 -30.93 71.96 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.086 0.469 . . . . 54.22 111.475 178.591 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.89 -47.93 34.49 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.392 -0.367 . . . . 62.44 111.35 177.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 90.1 mmm -64.59 -43.43 93.87 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 112.307 0.484 . . . . 74.32 112.307 -178.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.513 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 16.8 t70 -59.31 -51.14 71.24 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.821 0.343 . . . . 73.42 111.11 -179.343 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.39 -36.45 84.01 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.273 0.559 . . . . 64.11 111.296 176.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.521 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 43.7 tttp -53.94 -49.96 67.53 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.855 -0.612 . . . . 75.24 111.469 176.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -65.71 -27.02 68.03 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.231 0.456 . . . . 74.42 112.231 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.513 ' HG3' ' O ' ' A' ' 52' ' ' ASP . 44.9 mtt180 -72.94 -29.08 62.82 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 120.943 0.402 . . . . 75.04 111.073 177.259 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.449 ' CD2' ' HB2' ' A' ' 11' ' ' ALA . 89.5 t80 -77.35 -37.05 53.11 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.287 0.565 . . . . 75.44 110.849 174.125 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.54 ' HG2' ' HA ' ' A' ' 10' ' ' GLU . 56.6 mt-10 -76.97 -25.45 52.8 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.006 -0.543 . . . . 65.15 111.639 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.1 t70 . . . . . 0 CA--C 1.54 0.571 0 CA-C-O 120.698 0.285 . . . . 62.4 110.345 175.856 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 . . . . . 0 CA--C 1.537 0.46 0 CA-C-O 120.882 0.372 . . . . 61.22 110.518 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -93.31 153.84 18.33 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.914 0.388 . . . . 74.13 110.838 178.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 45.2 p90 -141.09 159.34 42.41 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.188 0.518 . . . . 74.54 111.569 -179.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 67.2 mt -99.74 138.05 25.33 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-N 115.947 -0.569 . . . . 65.53 111.511 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 59.2 t -119.95 121.16 65.27 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 122.509 0.323 . . . . 75.43 110.766 176.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 32.5 p -86.77 112.59 21.84 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.463 0.542 . . . . 45.35 112.463 -178.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.5 pt -113.92 175.87 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-N 116.296 -0.411 . . . . 71.4 110.523 175.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -138.53 128.43 25.26 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.125 0.488 . . . . 74.31 111.44 179.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -115.67 159.9 20.75 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 116.531 -0.304 . . . . 63.43 111.561 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.56 -153.74 19.29 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 121.294 -0.479 . . . . 63.15 113.845 178.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -79.84 155.49 75.46 Favored Pre-proline 0 CA--C 1.54 0.566 0 O-C-N 122.668 -0.313 . . . . 73.44 111.294 -176.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -52.97 -37.68 78.66 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 122.487 2.125 . . . . 70.03 113.002 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -84.69 -48.08 5.11 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 121.106 -0.569 . . . . 74.14 112.619 175.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -99.46 83.38 2.8 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.224 0.535 . . . . 65.54 111.691 178.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 75.2 p -99.64 155.89 17.36 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.769 -0.65 . . . . 74.11 111.457 175.59 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 48.8 t -116.97 128.08 74.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 CA-C-N 116.089 -0.505 . . . . 63.34 110.246 174.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 36.1 m -74.44 115.35 13.87 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.762 0.315 . . . . 62.22 111.444 -179.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 67.3 m95 -113.53 131.08 56.21 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.086 0.469 . . . . 65.21 111.265 177.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -100.76 114.13 27.62 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.109 -0.496 . . . . 74.01 110.813 -179.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.457 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 78.0 mt-30 -96.29 120.58 36.85 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.885 0.374 . . . . 75.15 111.637 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 55.9 tp -83.3 107.48 15.86 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 120.737 0.304 . . . . 72.02 110.259 175.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 54.4 mtt180 -120.92 166.28 14.03 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.158 0.504 . . . . 72.31 111.787 -178.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -139.02 158.57 43.96 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.935 -0.575 . . . . 72.2 111.114 178.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -80.8 -21.72 40.67 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 116.521 -0.309 . . . . 71.32 111.686 -179.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -112.27 144.3 30.55 Favored Pre-proline 0 CA--C 1.542 0.65 0 N-CA-C 111.573 0.212 . . . . 73.01 111.573 -177.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -74.67 -28.47 7.44 Favored 'Cis proline' 0 CA--C 1.542 0.881 0 C-N-CA 123.794 -1.336 . . . . 63.32 112.98 -4.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.403 ' HB3' ' HD2' ' A' ' 37' ' ' PRO . 58.1 mttp -131.23 160.28 67.76 Favored Pre-proline 0 CA--C 1.541 0.603 0 C-N-CA 122.426 0.29 . . . . 51.44 110.941 176.028 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.403 ' HD2' ' HB3' ' A' ' 36' ' ' LYS . 28.8 Cg_endo -61.43 -7.03 7.84 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 C-N-CA 122.573 2.182 . . . . 62.43 113.173 177.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -77.79 -7.12 56.15 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.554 -0.294 . . . . 72.41 111.422 176.329 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 68.6 m -65.44 92.17 0.13 Allowed 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.523 0.564 . . . . 74.22 112.523 -175.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 48.7 tp -100.06 105.11 16.73 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.067 -0.515 . . . . 74.1 109.974 172.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.5 ' N ' HD12 ' A' ' 41' ' ' ILE . 2.3 mp -71.06 -53.87 19.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 CA-C-N 116.383 -0.371 . . . . 61.42 111.397 -175.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 71.1 p -169.58 149.8 3.98 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.178 0.513 . . . . 62.12 111.397 -179.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.457 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 45.2 mt-10 -100.56 140.66 34.5 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.274 -0.421 . . . . 75.43 110.795 177.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 83.0 m-70 -136.74 135.91 20.89 Favored Pre-proline 0 CA--C 1.538 0.516 0 O-C-N 122.219 -0.301 . . . . 72.2 111.183 -178.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.0 -5.57 16.47 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 122.594 2.196 . . . . 64.41 113.58 -179.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 35.8 p -136.14 155.08 50.7 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-O 120.933 0.397 . . . . 45.21 111.345 177.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.55 -41.14 89.13 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.287 -0.415 . . . . 74.22 111.725 178.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 20.1 tp60 -56.55 -51.68 67.67 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 111.396 0.147 . . . . 70.44 111.396 177.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -61.39 -29.09 69.71 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 120.93 0.395 . . . . 62.42 111.82 179.144 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.54 -47.45 40.76 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 120.889 0.376 . . . . 72.32 111.464 176.05 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 65.6 mtt -65.89 -35.9 81.92 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.008 0.432 . . . . 61.23 111.451 178.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -60.52 -49.93 75.58 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.34 0.59 . . . . 64.33 110.37 176.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.27 -39.32 94.25 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.803 -0.635 . . . . 60.43 111.758 176.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 44.1 tttp -54.76 -48.55 72.49 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.709 0.29 . . . . 72.14 111.76 178.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 47.4 mtmt -61.56 -48.75 79.57 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.179 0.514 . . . . 63.44 111.223 177.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 45.2 mtp180 -65.5 -26.07 67.75 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.944 -0.571 . . . . 65.2 111.97 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -71.21 -46.95 60.1 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.965 0.412 . . . . 75.14 111.214 176.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -81.49 -21.64 38.53 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 112.387 0.514 . . . . 63.25 112.387 -178.408 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 . . . . . 0 CA--C 1.544 0.717 0 CA-C-O 120.768 0.318 . . . . 75.41 111.146 175.154 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 . . . . . 0 N--CA 1.469 0.488 0 CA-C-O 120.886 0.374 . . . . 45.52 110.849 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -131.61 154.66 48.66 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 116.161 -0.472 . . . . 64.05 110.706 178.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 13.1 p90 -135.11 146.13 48.54 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.272 0.558 . . . . 72.02 111.932 -177.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 62.9 mt -91.06 117.35 34.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 115.81 -0.632 . . . . 61.13 111.359 -177.356 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.54 HG21 ' HD2' ' A' ' 31' ' ' ARG . 61.9 t -105.61 126.63 60.86 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 CA-C-O 120.782 0.325 . . . . 41.11 111.277 -179.203 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 66.4 p -93.53 115.71 28.22 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 120.763 0.316 . . . . 74.45 111.228 178.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 42.3 pt -111.69 166.86 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 CA-C-O 121.004 0.431 . . . . 62.34 111.61 -179.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -115.34 114.98 25.85 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.257 -0.429 . . . . 64.4 111.787 -177.305 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -108.8 165.12 11.8 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 122.095 -0.378 . . . . 71.53 110.677 174.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.3 -137.09 13.06 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 121.024 -0.608 . . . . 55.45 113.652 -179.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -102.17 158.54 31.58 Favored Pre-proline 0 N--CA 1.473 0.684 0 N-CA-C 112.032 0.382 . . . . 75.14 112.032 -175.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -60.69 124.31 14.76 Favored 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 122.18 1.92 . . . . 71.15 111.714 173.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 89.27 -47.8 3.35 Favored Glycine 0 CA--C 1.525 0.692 0 C-N-CA 120.859 -0.686 . . . . 71.44 112.406 -176.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -99.08 79.15 2.31 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.347 0.594 . . . . 74.12 110.41 175.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 77.6 p -107.84 156.56 19.02 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.684 -0.689 . . . . 60.15 112.371 -175.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 63.6 t -113.27 132.31 62.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-N 115.639 -0.709 . . . . 71.44 110.359 175.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 95.0 m -79.73 117.28 20.49 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 120.912 0.387 . . . . 72.15 111.833 -179.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 76.9 m95 -114.87 131.62 56.79 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 116.377 -0.374 . . . . 74.55 111.163 175.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -92.81 114.73 27.36 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.946 0.403 . . . . 75.22 111.131 -178.305 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.64 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 86.0 mt-30 -102.08 130.13 48.58 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.472 -0.331 . . . . 73.11 111.393 177.447 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.8 tp -87.51 104.51 16.54 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.779 0.323 . . . . 65.43 110.441 174.521 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.54 ' HD2' HG21 ' A' ' 14' ' ' VAL . 86.5 mtt180 -111.48 154.72 24.3 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.555 -0.293 . . . . 63.43 110.953 179.079 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.29 140.25 51.49 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 120.574 0.226 . . . . 74.41 111.375 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -62.62 -24.54 67.64 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.157 0.429 . . . . 73.25 112.157 -179.148 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.482 ' HA ' ' C ' ' A' ' 35' ' ' PRO . 83.5 m-70 -122.18 134.22 24.69 Favored Pre-proline 0 CA--C 1.541 0.633 0 O-C-N 122.329 -0.232 . . . . 73.03 111.154 179.654 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.482 ' C ' ' HA ' ' A' ' 34' ' ' HIS . 22.2 Cg_exo -65.42 -42.12 0.66 Allowed 'Cis proline' 0 C--N 1.358 1.037 0 C-N-CA 124.643 -0.982 . . . . 70.14 113.709 3.393 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -137.0 145.85 52.27 Favored Pre-proline 0 N--CA 1.471 0.59 0 O-C-N 122.376 -0.202 . . . . 65.11 110.688 178.062 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -50.84 -22.0 9.28 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 C-N-CA 122.933 2.422 . . . . 73.42 113.914 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -84.23 10.89 9.23 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-O 121.052 0.453 . . . . 40.2 111.677 178.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 66.5 m -81.1 100.31 8.97 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.098 0.475 . . . . 55.42 111.109 178.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.401 HD13 ' HB3' ' A' ' 29' ' ' GLN . 56.3 tp -87.1 116.52 25.22 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.193 -0.458 . . . . 73.43 111.366 -179.721 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 47.8 mm -76.76 -54.87 12.31 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-O 120.663 0.268 . . . . 74.54 110.835 176.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 64.0 m -165.8 154.1 11.12 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.603 0.361 . . . . 73.32 111.404 179.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.64 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 50.8 mt-10 -100.31 150.11 22.92 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.03 0.443 . . . . 72.31 111.448 176.409 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . 0.466 ' ND1' ' HB3' ' A' ' 49' ' ' GLU . 89.7 m-70 -147.08 142.2 16.73 Favored Pre-proline 0 CA--C 1.542 0.649 0 CA-C-N 116.454 -0.339 . . . . 65.53 111.215 176.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -74.6 -25.09 13.08 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 122.31 2.006 . . . . 72.2 113.243 177.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 31.2 p -114.9 151.01 34.74 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-O 121.179 0.514 . . . . 75.41 111.737 -179.311 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.23 -44.25 92.44 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.062 -0.517 . . . . 73.21 112.303 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 24.0 tp60 -53.45 -42.56 67.27 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 111.744 0.275 . . . . 70.52 111.744 -179.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.466 ' HB3' ' ND1' ' A' ' 44' ' ' HIS . 47.1 mt-10 -61.31 -43.13 99.39 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.899 0.38 . . . . 73.31 111.342 176.087 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.08 -43.67 97.9 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.059 0.457 . . . . 74.13 111.385 178.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 58.6 mtt -63.76 -38.12 89.92 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.336 0.589 . . . . 71.14 110.958 176.152 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.453 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 34.0 t70 -62.95 -51.85 65.31 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.761 -0.654 . . . . 73.52 110.971 177.592 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.16 -42.72 86.56 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 116.091 -0.504 . . . . 71.32 111.443 177.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -55.65 -49.79 71.96 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.243 -0.435 . . . . 73.21 111.052 175.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 23.5 mtpp -60.06 -28.97 68.23 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.305 -0.407 . . . . 63.54 112.056 178.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.453 ' HG3' ' O ' ' A' ' 52' ' ' ASP . 72.7 mtt180 -73.58 -40.68 63.71 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 122.062 -0.399 . . . . 62.44 110.561 176.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -63.5 -33.32 75.33 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.341 0.591 . . . . 73.33 110.523 176.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -80.53 -34.37 35.62 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.909 -0.587 . . . . 74.12 111.836 176.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 28.3 t70 . . . . . 0 CA--C 1.544 0.717 0 CA-C-O 120.962 0.411 . . . . 65.32 111.177 -176.006 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 . . . . . 0 N--CA 1.468 0.469 0 CA-C-O 120.89 0.376 . . . . 75.5 111.282 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -145.54 155.05 42.83 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.395 -0.366 . . . . 72.12 111.012 176.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 40.5 p90 -149.36 161.54 41.87 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.14 0.495 . . . . 75.31 111.628 -178.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 65.4 mt -101.89 136.86 31.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-O 121.077 0.465 . . . . 74.13 112.106 -177.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.439 HG21 ' HD2' ' A' ' 31' ' ' ARG . 98.4 t -119.07 126.38 75.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 116.353 -0.385 . . . . 72.32 110.802 176.391 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 46.8 p -86.64 114.42 23.33 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.587 0.232 . . . . 74.13 111.615 -179.137 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.513 HD13 ' NE2' ' A' ' 29' ' ' GLN . 37.8 pt -112.83 168.91 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 CA-C-O 121.19 0.519 . . . . 75.34 111.872 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -114.59 124.84 52.87 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.756 -0.656 . . . . 54.13 111.416 -179.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -119.25 159.61 23.75 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.764 0.316 . . . . 73.4 110.932 172.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.26 -146.21 17.6 Favored Glycine 0 CA--C 1.528 0.868 0 C-N-CA 121.314 -0.469 . . . . 65.52 113.401 -179.44 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -95.22 148.96 35.5 Favored Pre-proline 0 N--CA 1.471 0.606 0 N-CA-C 112.088 0.403 . . . . 73.34 112.088 -175.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -56.49 124.35 16.04 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.201 1.934 . . . . 65.12 112.065 176.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 95.17 -52.79 1.86 Allowed Glycine 0 CA--C 1.527 0.786 0 C-N-CA 121.133 -0.556 . . . . 73.25 112.384 -174.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 31.4 mm-40 -99.8 64.8 1.28 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.148 0.499 . . . . 64.31 110.882 176.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 59.9 p -92.05 167.63 11.95 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.376 0.608 . . . . 73.32 112.43 -175.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 60.8 t -124.34 124.7 69.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 CA-C-N 115.707 -0.679 . . . . 74.44 109.95 175.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 94.4 m -77.46 114.86 16.73 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.123 0.487 . . . . 43.03 112.015 -177.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 72.6 m95 -110.58 140.47 44.87 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.926 -0.579 . . . . 74.11 110.784 175.336 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -97.74 113.76 25.6 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 120.884 0.373 . . . . 74.0 111.298 -177.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.661 ' HG2' ' HG3' ' A' ' 43' ' ' GLU . 79.4 mt-30 -91.5 125.85 36.39 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.815 0.341 . . . . 71.3 111.362 177.726 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 60.4 tp -83.25 116.92 22.62 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.664 0.268 . . . . 74.11 110.495 173.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.439 ' HD2' HG21 ' A' ' 14' ' ' VAL . 99.0 mtt180 -126.94 164.7 20.88 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 120.926 0.393 . . . . 73.31 111.217 178.214 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -139.82 140.15 36.53 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.504 -0.316 . . . . 71.11 111.094 176.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.468 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 29.0 t70 -61.05 -38.61 86.78 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.313 0.578 . . . . 42.45 110.869 177.337 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 -105.96 130.54 22.84 Favored Pre-proline 0 CA--C 1.541 0.611 0 CA-C-N 116.105 -0.498 . . . . 72.02 110.392 177.09 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -77.45 -34.49 3.27 Favored 'Cis proline' 0 CA--C 1.545 1.033 0 C-N-CA 123.885 -1.298 . . . . 72.52 114.156 3.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -130.76 130.96 22.99 Favored Pre-proline 0 N--CA 1.474 0.766 0 O-C-N 122.393 -0.192 . . . . 73.51 110.943 -178.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.468 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 91.2 Cg_exo -45.47 -51.34 8.1 Favored 'Trans proline' 0 CA--C 1.542 0.916 0 C-N-CA 123.419 2.746 . . . . 41.01 114.49 -174.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -79.34 24.67 0.34 Allowed 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 112.703 0.631 . . . . 64.3 112.703 -177.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 45.2 p -66.6 89.77 0.15 Allowed 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.161 0.505 . . . . 74.53 111.413 177.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 38.2 tp -72.7 104.1 3.83 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 120.887 0.375 . . . . 64.21 111.476 178.087 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.3 mm -74.88 -54.1 15.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 116.272 -0.422 . . . . 73.32 110.754 175.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 29.3 t -175.76 149.87 0.99 Allowed 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 116.351 -0.386 . . . . 53.13 111.904 -178.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.661 ' HG3' ' HG2' ' A' ' 29' ' ' GLN . 1.9 mp0 -89.39 125.99 35.37 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 116.534 -0.303 . . . . 70.01 110.381 173.525 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 11.9 m170 -116.52 146.93 38.61 Favored Pre-proline 0 CA--C 1.542 0.638 0 C-N-CA 122.574 0.349 . . . . 61.02 111.008 179.519 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -67.0 -40.37 11.94 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.827 2.352 . . . . 75.24 114.173 -173.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.517 ' OG1' ' HB2' ' A' ' 49' ' ' GLU . 29.9 p -120.37 153.51 36.4 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 122.064 -0.398 . . . . 61.15 111.243 -179.435 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.21 -41.71 79.95 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 120.896 0.379 . . . . 74.31 111.251 178.02 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.27 -43.75 98.37 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 116.288 -0.415 . . . . 74.02 110.752 176.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.517 ' HB2' ' OG1' ' A' ' 46' ' ' THR . 0.6 OUTLIER -61.44 -33.1 73.16 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.343 0.592 . . . . 53.4 110.727 178.524 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.96 -42.76 56.99 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 116.212 -0.449 . . . . 71.23 111.371 176.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.557 ' SD ' ' HD3' ' A' ' 54' ' ' LYS . 22.2 mmt -57.29 -35.74 70.18 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 116.313 -0.403 . . . . 63.22 111.753 176.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -54.47 -43.83 72.06 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 116.133 -0.485 . . . . 75.32 111.088 177.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.08 -40.08 53.94 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.158 0.504 . . . . 50.44 111.408 175.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.557 ' HD3' ' SD ' ' A' ' 51' ' ' MET . 42.3 tttp -53.89 -49.76 67.84 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 115.872 -0.603 . . . . 75.53 112.004 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 60.6 mttp -53.7 -57.97 8.9 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 111.844 0.312 . . . . 64.52 111.844 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 53.0 mtp180 -62.24 -26.4 68.36 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 112.003 0.371 . . . . 63.3 112.003 -178.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -71.45 -34.47 70.28 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.002 0.43 . . . . 75.41 110.936 176.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.44 ' HG3' ' O ' ' A' ' 54' ' ' LYS . 44.1 mt-10 -86.25 -20.19 28.83 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.086 -0.507 . . . . 70.21 111.48 179.549 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 . . . . . 0 CA--C 1.543 0.68 0 CA-C-N 116.398 -0.365 . . . . 73.02 110.855 172.793 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.47 ' HA ' ' HG2' ' A' ' 58' ' ' GLU . 42.1 tt0 . . . . . 0 CA--C 1.539 0.542 0 CA-C-O 120.975 0.417 . . . . 73.03 111.698 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.434 ' O ' ' NZ ' ' A' ' 54' ' ' LYS . . . -124.89 175.06 7.54 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.049 -0.523 . . . . 72.13 110.96 177.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 41.2 p90 -148.47 153.09 38.0 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.098 0.475 . . . . 74.24 111.693 177.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 63.5 mt -101.66 135.51 37.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 116.107 -0.497 . . . . 74.33 111.557 -176.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.404 HG21 ' HD2' ' A' ' 31' ' ' ARG . 61.6 t -119.28 138.71 49.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-N 116.585 -0.28 . . . . 74.13 111.23 178.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 80.3 p -101.24 117.33 34.77 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 120.522 0.201 . . . . 73.24 111.506 178.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.499 HD13 ' NE2' ' A' ' 29' ' ' GLN . 42.8 pt -120.11 168.47 12.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-O 120.871 0.367 . . . . 72.53 111.614 178.573 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.408 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 47.4 mt-10 -116.12 126.87 54.3 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 116.357 -0.383 . . . . 62.12 111.193 177.233 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.425 ' HE3' HD12 ' A' ' 16' ' ' ILE . 95.1 mttt -130.4 166.63 20.06 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.781 0.325 . . . . 74.54 111.329 176.039 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.08 -136.88 12.94 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 121.186 -0.531 . . . . 53.45 113.164 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.422 ' HB2' ' HB2' ' A' ' 23' ' ' GLN . 75.5 mmtt -75.27 147.01 82.39 Favored Pre-proline 0 CA--C 1.539 0.52 0 O-C-N 122.437 -0.449 . . . . 74.21 111.332 179.093 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_exo -53.06 -46.89 30.73 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 122.781 2.32 . . . . 74.03 113.076 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -84.33 -52.91 3.42 Favored Glycine 0 CA--C 1.526 0.745 0 C-N-CA 121.118 -0.563 . . . . 73.24 112.825 175.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.422 ' HB2' ' HB2' ' A' ' 20' ' ' LYS . 32.9 mm-40 -83.81 77.27 9.92 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.119 0.485 . . . . 62.21 111.032 177.131 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.408 ' HB ' ' HB3' ' A' ' 17' ' ' GLU . 53.0 p -88.4 152.12 22.12 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.182 0.515 . . . . 65.43 111.745 179.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 58.0 t -114.84 129.4 71.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.033 -0.531 . . . . 62.32 109.976 174.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 31.2 m -75.36 115.58 15.17 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 120.697 0.284 . . . . 72.54 111.498 -179.298 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 77.9 m95 -106.58 132.3 52.74 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.053 0.454 . . . . 64.42 110.877 175.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -97.17 114.5 26.21 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.298 0.57 . . . . 64.01 111.138 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.735 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 95.5 mt-30 -97.46 122.29 40.33 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.678 -0.692 . . . . 73.03 111.723 -178.698 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.9 tp -83.24 109.87 17.59 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 120.788 0.328 . . . . 71.42 110.299 171.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.404 ' HD2' HG21 ' A' ' 14' ' ' VAL . 87.5 mtt-85 -121.41 158.63 27.9 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.053 0.454 . . . . 71.3 111.728 -178.635 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -146.01 146.49 31.01 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.241 -0.436 . . . . 73.21 111.211 178.259 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.495 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 3.9 m-20 -62.67 -22.6 66.59 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.058 0.456 . . . . 72.05 111.847 177.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.555 ' HA ' ' C ' ' A' ' 35' ' ' PRO . 35.3 m80 -125.82 141.39 39.18 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-N 116.365 -0.379 . . . . 75.55 110.52 179.064 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.555 ' C ' ' HA ' ' A' ' 34' ' ' HIS . 31.7 Cg_exo -59.93 -56.62 0.13 OUTLIER 'Cis proline' 0 N--CA 1.49 1.293 0 CA-C-N 119.662 0.915 . . . . 64.53 114.368 4.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -109.68 147.4 36.05 Favored Pre-proline 0 N--CA 1.471 0.576 0 O-C-N 122.231 -0.293 . . . . 73.43 111.229 179.011 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.495 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 75.9 Cg_exo -50.6 -31.13 30.62 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 122.948 2.432 . . . . 74.15 113.809 -179.344 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -98.74 20.87 12.25 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 120.839 0.352 . . . . 73.23 111.682 -179.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.4 t -72.42 107.4 4.97 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.019 0.437 . . . . 62.43 111.665 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 36.1 tp -92.48 109.82 21.22 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 116.114 -0.493 . . . . 64.52 111.027 177.051 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.8 mm -73.71 -54.61 14.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 116.115 -0.493 . . . . 74.23 111.747 -177.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.0 t -164.13 149.46 10.52 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 112.3 0.482 . . . . 71.12 112.3 -176.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.735 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 88.3 mt-10 -108.93 139.34 43.92 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.277 -0.419 . . . . 71.43 110.856 175.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 89.6 m-70 -138.77 140.32 26.97 Favored Pre-proline 0 CA--C 1.538 0.503 0 O-C-N 122.3 -0.25 . . . . 75.24 111.531 178.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -71.86 -24.13 21.47 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 122.458 2.105 . . . . 52.42 113.517 -179.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 30.4 p -113.07 143.7 43.89 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 121.085 0.469 . . . . 64.12 111.713 179.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.95 -34.69 73.6 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.053 -0.521 . . . . 73.4 111.9 177.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.424 HE21 ' C ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -56.5 -48.96 76.07 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 120.577 0.227 . . . . 72.31 110.894 179.829 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -58.66 -42.5 88.56 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.092 0.472 . . . . 63.13 111.199 177.424 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.71 -41.25 98.13 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.939 -0.573 . . . . 71.03 111.726 -179.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 67.1 mtt -65.06 -49.31 70.6 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 120.934 0.397 . . . . 55.52 111.004 177.379 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.547 ' HA ' ' HE2' ' A' ' 55' ' ' LYS . 11.2 m-20 -57.67 -41.29 81.24 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 121.056 0.455 . . . . 73.05 111.767 176.161 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.79 -43.42 93.26 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.953 0.406 . . . . 71.41 111.026 177.339 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.434 ' NZ ' ' O ' ' A' ' 11' ' ' ALA . 59.5 tttp -60.48 -52.43 65.23 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 116.316 -0.402 . . . . 62.14 111.781 178.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.547 ' HE2' ' HA ' ' A' ' 52' ' ' ASP . 63.7 pttt -64.81 -33.92 77.14 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 120.938 0.399 . . . . 75.13 111.567 -179.147 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 51.6 ttt180 -77.89 -26.29 49.08 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.948 0.404 . . . . 65.13 111.001 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -72.27 -43.26 64.55 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.05 0.452 . . . . 75.2 110.855 175.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.47 ' HG2' ' HA ' ' A' ' 10' ' ' GLU . 81.0 mt-10 -75.6 -33.64 60.56 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.935 -0.575 . . . . 73.4 111.849 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.5 m-20 . . . . . 0 CA--C 1.544 0.739 0 CA-C-O 120.859 0.362 . . . . 71.32 111.162 175.729 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 . . . . . 0 N--CA 1.474 0.739 0 CA-C-O 120.674 0.273 . . . . 71.13 111.318 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.489 ' O ' ' HE2' ' A' ' 54' ' ' LYS . . . -140.95 162.31 35.77 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 120.87 0.367 . . . . 61.13 111.889 -179.337 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -151.63 149.63 29.35 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.097 0.475 . . . . 63.15 111.63 178.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 60.2 mt -101.56 134.49 41.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-N 116.35 -0.386 . . . . 73.42 111.895 -176.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.4 t -129.18 122.85 57.12 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 116.289 -0.414 . . . . 64.25 110.49 176.062 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 45.9 p -86.91 129.45 34.88 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 120.817 0.341 . . . . 74.1 111.579 -178.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.51 HD13 ' NE2' ' A' ' 29' ' ' GLN . 43.3 pt -113.33 175.07 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-O 120.955 0.407 . . . . 72.15 111.423 178.039 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.453 ' HB2' ' HB ' ' A' ' 24' ' ' THR . 9.4 pt-20 -118.16 129.83 55.74 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 121.231 0.538 . . . . 71.11 111.754 178.905 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -124.97 178.51 5.47 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 116.384 -0.371 . . . . 53.3 110.933 175.198 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 84.29 -136.79 15.11 Favored Glycine 0 CA--C 1.526 0.733 0 C-N-CA 120.927 -0.654 . . . . 74.52 114.414 172.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -74.63 150.0 86.38 Favored Pre-proline 0 CA--C 1.542 0.635 0 N-CA-C 112.053 0.39 . . . . 60.35 112.053 -173.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -58.68 -38.07 91.06 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 122.701 2.267 . . . . 53.41 112.957 179.087 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -92.3 -52.14 2.25 Favored Glycine 0 CA--C 1.524 0.642 0 C-N-CA 121.173 -0.537 . . . . 71.01 112.492 177.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -93.35 80.87 4.41 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.493 0.663 . . . . 73.35 110.818 177.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.453 ' HB ' ' HB2' ' A' ' 17' ' ' GLU . 71.7 p -80.75 151.17 28.96 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.457 -0.792 . . . . 61.2 111.816 179.602 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 53.7 t -108.54 136.46 44.15 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 CA-C-N 116.176 -0.466 . . . . 72.33 110.852 -179.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 67.6 m -85.28 120.07 26.35 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.068 0.461 . . . . 71.12 112.125 -175.468 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 61.6 m95 -119.66 131.62 55.48 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.047 0.451 . . . . 70.41 111.28 175.286 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -91.57 114.71 27.31 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 116.358 -0.383 . . . . 62.3 111.187 -178.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.55 ' HG2' ' HG3' ' A' ' 43' ' ' GLU . 72.4 mt-30 -95.82 120.31 35.86 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.562 -0.29 . . . . 73.41 111.571 177.687 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 55.2 tp -85.67 103.47 14.51 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.872 0.368 . . . . 51.34 110.426 173.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 55.4 mtt180 -106.5 141.85 37.12 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.464 -0.334 . . . . 71.23 110.325 178.169 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.415 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . . . -109.6 167.9 9.8 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.808 0.67 . . . . 74.45 112.808 -173.275 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -77.36 -54.48 6.41 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 115.631 -0.713 . . . . 71.13 111.98 -176.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.537 ' HB3' ' HA ' ' A' ' 35' ' ' PRO . 60.0 m-70 -123.43 164.05 30.59 Favored Pre-proline 0 CA--C 1.547 0.83 0 C-N-CA 122.597 0.359 . . . . 63.41 110.929 178.694 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.537 ' HA ' ' HB3' ' A' ' 34' ' ' HIS . 36.8 Cg_endo -64.76 -50.16 0.17 OUTLIER 'Cis proline' 0 C--N 1.362 1.278 0 C-N-CA 124.825 -0.906 . . . . 61.3 113.572 1.158 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -98.6 149.05 35.36 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 122.169 0.188 . . . . 75.03 110.548 173.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -67.87 -14.9 42.76 Favored 'Trans proline' 0 CA--C 1.537 0.64 0 C-N-CA 122.212 1.942 . . . . 73.03 112.502 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -88.61 1.05 55.72 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.98 -0.555 . . . . 71.15 111.874 -179.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 64.0 m -56.78 92.52 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 112.259 0.466 . . . . 72.23 112.259 -175.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 49.6 tp -83.88 107.23 16.14 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 116.265 -0.425 . . . . 72.52 110.508 176.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 45.0 mm -69.44 -53.7 23.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 116.312 -0.404 . . . . 64.13 111.641 -177.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.9 t -175.24 149.64 1.08 Allowed 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 121.038 0.447 . . . . 63.41 112.01 -179.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.55 ' HG3' ' HG2' ' A' ' 29' ' ' GLN . 2.2 mp0 -100.42 130.81 46.55 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 116.044 -0.525 . . . . 75.04 110.595 176.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -134.95 147.04 61.13 Favored Pre-proline 0 N--CA 1.473 0.69 0 CA-C-O 120.839 0.352 . . . . 62.14 111.584 -179.047 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.84 -18.59 19.04 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 122.825 2.35 . . . . 60.1 114.146 -174.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 30.6 p -116.88 151.67 36.1 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.093 0.473 . . . . 71.32 111.399 179.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.34 -36.46 74.24 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.302 -0.408 . . . . 74.2 111.824 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 24.6 tp60 -56.8 -42.02 78.79 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.529 -0.305 . . . . 61.02 111.767 -177.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -59.23 -51.07 71.55 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 121.094 0.473 . . . . 64.23 111.35 176.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.07 -37.74 88.52 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.982 -0.553 . . . . 73.32 111.689 -178.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 95.1 mmm -68.28 -44.83 74.68 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 116.511 -0.313 . . . . 62.44 111.642 178.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -61.74 -48.58 80.05 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.05 0.452 . . . . 55.15 110.701 178.022 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.37 -33.84 76.42 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 116.029 -0.532 . . . . 64.02 111.452 177.073 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.489 ' HE2' ' O ' ' A' ' 11' ' ' ALA . 65.7 tttm -61.82 -57.34 12.22 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.91 0.386 . . . . 73.22 110.503 175.793 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -55.77 -44.65 77.88 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.205 -0.452 . . . . 70.22 111.297 178.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -61.11 -44.49 97.27 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.092 -0.504 . . . . 74.21 111.526 178.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 80.5 t80 -67.04 -38.9 86.67 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 116.373 -0.376 . . . . 75.12 111.375 179.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.464 ' HG3' ' O ' ' A' ' 54' ' ' LYS . 56.5 mt-10 -72.31 -5.41 35.95 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.371 0.508 . . . . 72.31 112.371 -176.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 68.4 m-20 . . . . . 0 CA--C 1.544 0.733 0 O-C-N 122.375 -0.203 . . . . 54.32 110.891 169.213 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 . . . . . 0 N--CA 1.469 0.505 0 CA-C-O 120.574 0.226 . . . . 74.14 110.439 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.465 ' HB2' ' CD2' ' A' ' 57' ' ' TYR . . . -117.96 167.03 11.81 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.626 0.602 . . . . 72.31 112.626 -174.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 28.5 p90 -147.88 150.47 34.17 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.533 -0.758 . . . . 63.53 110.883 178.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 55.1 mt -102.2 123.76 55.66 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-O 120.951 0.405 . . . . 73.15 111.339 -178.264 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.9 t -106.27 124.71 61.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-N 116.457 -0.338 . . . . 52.53 111.291 179.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 71.0 p -89.87 113.56 25.18 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.895 0.378 . . . . 54.02 111.285 178.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.447 HD12 ' HE3' ' A' ' 18' ' ' LYS . 30.0 pt -112.95 161.62 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-O 120.66 0.267 . . . . 62.23 111.337 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -124.14 130.07 51.92 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.165 0.507 . . . . 65.24 111.264 176.174 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.447 ' HE3' HD12 ' A' ' 16' ' ' ILE . 97.1 mttt -128.53 175.32 8.63 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 120.997 0.427 . . . . 72.34 111.131 177.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 90.52 -137.93 14.18 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 121.136 -0.554 . . . . 64.42 113.544 178.141 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -85.86 139.62 35.13 Favored Pre-proline 0 CA--C 1.541 0.599 0 C-N-CA 122.335 0.254 . . . . 75.03 111.503 -176.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -51.01 -45.33 37.12 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 C-N-CA 122.533 2.155 . . . . 73.4 112.833 178.008 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.03 -58.1 6.46 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 120.8 -0.714 . . . . 24.41 112.158 175.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -98.98 82.92 2.82 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 121.033 0.444 . . . . 72.41 110.702 179.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 46.0 p -86.12 150.22 24.57 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 116.003 -0.544 . . . . 70.41 112.202 179.154 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 47.2 t -111.79 116.33 52.25 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 115.965 -0.561 . . . . 71.12 110.458 174.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 94.5 m -81.75 117.95 22.47 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 111.888 0.329 . . . . 71.33 111.888 -178.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -110.92 131.63 54.89 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 120.88 0.371 . . . . 74.21 111.351 178.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -90.68 114.35 26.64 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.833 0.349 . . . . 72.34 110.907 177.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.404 ' HB3' HD13 ' A' ' 40' ' ' LEU . 80.5 mt-30 -103.92 120.51 41.17 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.304 -0.407 . . . . 75.04 111.588 -179.17 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.7 tp -83.32 110.97 18.56 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 120.62 0.248 . . . . 73.44 110.816 174.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 31' ' ' ARG . 60.3 mtt180 -123.29 166.44 15.27 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.805 0.336 . . . . 71.31 110.798 177.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.411 ' O ' ' HA ' ' A' ' 37' ' ' PRO . . . -137.79 171.99 13.62 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.529 -0.305 . . . . 73.25 111.096 178.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -90.2 -14.64 33.04 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.308 0.575 . . . . 71.42 110.594 175.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.409 ' HA ' ' C ' ' A' ' 35' ' ' PRO . 92.2 m-70 -122.03 130.98 24.5 Favored Pre-proline 0 CA--C 1.546 0.795 0 CA-C-N 116.005 -0.543 . . . . 73.22 110.261 173.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.409 ' C ' ' HA ' ' A' ' 34' ' ' HIS . 24.7 Cg_exo -64.85 -44.71 0.38 Allowed 'Cis proline' 0 C--N 1.357 0.992 0 C-N-CA 124.479 -1.05 . . . . 64.33 113.9 0.539 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -137.58 153.64 74.41 Favored Pre-proline 0 N--CA 1.474 0.754 0 C-N-CA 122.04 0.136 . . . . 74.14 111.058 179.144 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.411 ' HA ' ' O ' ' A' ' 32' ' ' ALA . 88.7 Cg_exo -50.49 -27.28 18.42 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 122.75 2.3 . . . . 75.1 113.372 175.405 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -74.67 -23.82 58.7 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 116.131 -0.486 . . . . 54.04 112.014 178.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 53.0 m -57.52 105.86 0.28 Allowed 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.146 0.498 . . . . 74.3 112.288 -175.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.404 HD13 ' HB3' ' A' ' 29' ' ' GLN . 49.7 tp -95.3 124.91 39.58 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 115.86 -0.609 . . . . 62.51 111.229 178.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.1 mm -86.01 -50.88 13.93 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 CA-C-O 120.981 0.419 . . . . 73.41 111.784 -179.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 29.1 t -168.77 149.02 4.43 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 120.991 0.424 . . . . 64.12 112.09 -178.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -106.91 140.22 40.08 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.216 -0.447 . . . . 73.41 110.334 174.384 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . 0.419 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 85.4 m-70 -139.81 151.26 65.33 Favored Pre-proline 0 N--CA 1.471 0.597 0 CA-C-O 120.795 0.331 . . . . 53.22 111.784 179.005 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 44' ' ' HIS . 9.9 Cg_exo -69.77 -37.22 9.45 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 122.853 2.369 . . . . 72.11 112.798 177.757 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 41.9 p -105.35 148.62 26.87 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 121.104 0.478 . . . . 74.54 111.718 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.444 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -65.79 -31.31 72.21 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.304 -0.407 . . . . 73.44 111.195 176.002 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 25.7 tp60 -57.16 -49.19 76.74 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 116.485 -0.325 . . . . 73.52 111.571 179.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -58.78 -43.55 90.44 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.34 0.591 . . . . 73.22 110.982 175.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.89 -35.21 79.27 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.767 -0.651 . . . . 50.34 111.497 177.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' MET . . . . . 0.497 ' O ' ' HG3' ' A' ' 55' ' ' LYS . 68.4 mtt -68.2 -42.61 79.61 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.477 -0.329 . . . . 44.04 111.226 176.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -56.99 -49.27 76.28 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.274 0.559 . . . . 70.33 110.507 176.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.02 -36.81 85.21 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 115.943 -0.572 . . . . 65.15 111.54 176.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.7 tttm -61.96 -42.88 99.62 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.078 0.466 . . . . 74.11 110.606 176.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.497 ' HG3' ' O ' ' A' ' 51' ' ' MET . 95.7 mttt -56.67 -55.1 38.3 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.426 0.632 . . . . 71.43 109.929 171.729 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 30.1 ttm-85 -60.23 -25.71 65.85 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 115.151 -0.931 . . . . 64.44 112.544 -174.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.465 ' CD2' ' HB2' ' A' ' 11' ' ' ALA . 90.1 t80 -76.68 -54.42 6.68 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 120.777 0.323 . . . . 61.14 111.505 176.454 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -74.59 -49.82 20.25 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.674 0.273 . . . . 65.43 111.246 -179.11 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 . . . . . 0 CA--C 1.537 0.47 0 N-CA-C 109.227 -0.657 . . . . 73.42 109.227 168.035 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.6 ptt? . . . . . 0 N--CA 1.488 1.469 0 N-CA-C 112.277 0.473 . . . . 70.35 112.277 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -92.47 150.25 2.94 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.051 2.5 . . . . 75.14 111.863 170.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.9 t -141.71 130.52 22.95 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.141 0.496 . . . . 71.31 111.91 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -114.67 109.83 47.5 Favored Pre-proline 0 CA--C 1.538 0.505 0 CA-C-N 116.018 -0.537 . . . . 61.4 110.661 176.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -71.72 161.45 45.13 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 122.574 2.183 . . . . 75.0 112.847 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.77 -23.75 73.19 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 122.594 2.196 . . . . 71.33 112.517 177.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -123.15 87.88 51.21 Favored Pre-proline 0 CA--C 1.54 0.591 0 CA-C-N 116.175 -0.466 . . . . 73.32 110.643 175.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -64.86 160.57 40.36 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 122.977 2.451 . . . . 60.35 113.914 -177.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.495 ' NH2' ' HB3' ' A' ' 62' ' ' LYS . 15.2 ptm180 -80.73 88.17 5.8 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.639 0.733 . . . . 75.35 110.956 179.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -124.42 138.89 54.32 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.897 -0.592 . . . . 65.21 111.798 -177.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -129.05 175.81 8.39 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 116.138 -0.483 . . . . 32.54 111.655 179.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 41.1 p90 -153.52 179.78 8.49 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 121.095 0.474 . . . . 71.5 111.336 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 58.1 mt -117.96 146.05 23.02 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-N 116.48 -0.327 . . . . 73.35 111.497 -177.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 57.4 t -128.09 121.1 55.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 122.546 0.338 . . . . 71.14 110.947 176.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 77.2 p -87.93 115.32 25.31 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 111.85 0.315 . . . . 72.23 111.85 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.446 HD11 ' HE3' ' A' ' 18' ' ' LYS . 37.4 pt -121.07 175.59 4.67 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-O 121.204 0.526 . . . . 73.04 111.772 -179.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.434 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 45.4 mt-10 -125.21 141.55 52.03 Favored 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 116.05 -0.523 . . . . 74.14 110.801 176.369 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.446 ' HE3' HD11 ' A' ' 16' ' ' ILE . 93.7 mttt -131.81 175.85 8.85 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.035 0.445 . . . . 74.55 111.724 178.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.27 -136.72 12.85 Favored Glycine 0 CA--C 1.525 0.687 0 C-N-CA 121.086 -0.578 . . . . 65.33 113.455 176.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -87.71 146.87 40.08 Favored Pre-proline 0 CA--C 1.538 0.485 0 C-N-CA 122.424 0.29 . . . . 75.41 111.54 -176.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -53.09 -31.51 54.66 Favored 'Trans proline' 0 C--N 1.354 0.859 0 C-N-CA 122.927 2.418 . . . . 51.42 113.088 -178.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -96.41 -42.64 3.39 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 121.14 -0.552 . . . . 42.44 112.709 175.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -99.69 85.24 3.07 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.144 0.497 . . . . 72.43 111.234 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.434 ' HB ' ' HB3' ' A' ' 17' ' ' GLU . 75.1 p -91.95 152.77 19.87 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 121.178 0.513 . . . . 74.3 112.349 -179.65 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 61.9 t -121.16 145.67 27.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 CA-C-N 115.902 -0.59 . . . . 60.31 110.505 176.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 41.7 m -78.5 127.97 32.9 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.256 0.465 . . . . 45.32 112.256 -176.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 44.4 m95 -132.13 151.21 51.9 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.235 0.54 . . . . 72.25 111.916 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -118.8 119.12 33.44 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.976 -0.557 . . . . 61.44 111.498 -179.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -100.58 129.84 46.57 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 120.967 0.413 . . . . 72.24 111.689 177.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 65.4 tp -88.77 111.72 22.33 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.398 -0.365 . . . . 54.53 110.592 174.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 31' ' ' ARG . 71.7 mtt-85 -127.24 153.87 45.57 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.707 0.289 . . . . 74.5 110.595 178.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -134.14 145.18 49.04 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.809 0.3 . . . . 72.43 111.809 -176.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -62.64 -17.35 60.25 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 121.44 0.638 . . . . 62.13 111.156 176.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 29.6 m80 -120.29 128.81 25.64 Favored Pre-proline 0 CA--C 1.542 0.652 0 CA-C-N 115.736 -0.666 . . . . 70.23 110.777 -176.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -80.11 -17.6 26.39 Favored 'Cis proline' 0 CA--C 1.541 0.851 0 C-N-CA 123.815 -1.327 . . . . 74.42 113.276 0.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -143.35 143.34 23.85 Favored Pre-proline 0 N--CA 1.471 0.583 0 C-N-CA 122.439 0.296 . . . . 71.14 110.822 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -70.37 -8.61 24.02 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 122.513 2.142 . . . . 74.11 112.981 -174.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -97.1 -0.97 46.18 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 120.911 0.386 . . . . 75.41 111.229 175.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.6 t -72.64 103.87 3.72 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.103 0.477 . . . . 72.33 111.667 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 58.4 tp -82.99 122.62 28.54 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.989 -0.55 . . . . 74.14 110.295 176.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.4 mm -88.42 -54.16 8.36 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-O 120.987 0.423 . . . . 72.04 111.393 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 44.2 t -159.48 156.69 28.71 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 116.376 -0.375 . . . . 64.32 111.404 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -119.29 139.31 52.13 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.855 0.359 . . . . 65.42 111.036 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 48.2 m80 -143.32 143.07 22.88 Favored Pre-proline 0 N--CA 1.472 0.642 0 CA-C-N 116.643 -0.253 . . . . 75.52 111.377 -179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -75.35 -15.1 20.17 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 122.436 2.091 . . . . 70.14 113.355 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 44.6 p -116.91 148.69 41.12 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 121.118 0.485 . . . . 71.0 111.992 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.29 -42.71 99.11 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.075 -0.511 . . . . 51.22 112.165 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.2 tp60 -56.86 -46.42 81.8 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 111.89 0.33 . . . . 52.41 111.89 -178.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -59.75 -34.22 72.68 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 120.839 0.352 . . . . 75.43 111.462 177.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.97 -43.98 73.87 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 120.969 0.414 . . . . 73.15 111.458 178.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 66.2 mtt -65.33 -42.76 92.61 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.256 0.55 . . . . 72.32 111.311 177.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.423 ' O ' ' HD2' ' A' ' 56' ' ' ARG . 12.8 t70 -63.64 -47.99 79.09 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.919 -0.582 . . . . 73.1 110.563 178.408 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.57 -39.35 80.03 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.314 -0.403 . . . . 64.1 111.29 176.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 49.5 tttp -55.11 -44.32 74.87 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.326 -0.397 . . . . 72.13 110.718 174.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -63.1 -41.7 99.44 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 122.327 -0.233 . . . . 72.0 111.605 175.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.462 ' HA ' ' HE ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -56.27 -32.78 64.85 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 122.194 -0.317 . . . . 73.1 111.809 176.811 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -77.75 -37.59 48.84 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 111.878 0.325 . . . . 63.4 111.878 177.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -92.27 -22.8 19.56 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.084 0.772 . . . . 72.32 113.084 -172.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -76.05 155.07 84.68 Favored Pre-proline 0 CA--C 1.543 0.681 0 CA-C-O 120.935 0.398 . . . . 73.12 111.4 179.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -62.75 -6.51 9.25 Favored 'Trans proline' 0 C--N 1.354 0.847 0 C-N-CA 122.737 2.292 . . . . 54.4 113.507 -178.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -66.87 -36.9 83.36 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 120.7 0.286 . . . . 73.11 111.23 177.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.495 ' HB3' ' NH2' ' A' ' 9' ' ' ARG . 58.2 tptt -78.16 98.41 5.82 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.164 0.507 . . . . 62.31 109.862 173.268 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -75.68 168.94 19.07 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.662 -0.699 . . . . 72.3 112.336 -177.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 7.3 mp -63.1 103.55 0.48 Allowed 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 121.038 0.447 . . . . 70.14 110.765 178.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -96.14 16.72 17.33 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 121.283 0.563 . . . . 73.31 112.102 -173.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 78.4 m-70 -74.92 119.48 19.16 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.989 -0.444 . . . . 74.12 109.887 174.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 56.7 m80 -58.41 120.93 9.65 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.476 0.655 . . . . 74.24 112.574 -175.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 16.4 t-80 -53.25 114.34 1.44 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 114.956 -1.02 . . . . 73.5 112.572 -176.326 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 66.5 t60 53.86 35.06 20.73 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 116.066 -0.515 . . . . 70.13 112.05 176.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 72.6 m80 65.97 32.47 8.44 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.006 0.431 . . . . 71.13 112.15 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 76.6 t60 . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.635 -0.697 . . . . 61.13 111.146 175.58 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.4 mmm . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 120.709 0.29 . . . . 74.32 111.102 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -77.2 -9.19 17.73 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.715 2.276 . . . . 75.04 113.321 -178.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.441 HG22 ' O ' ' A' ' 3' ' ' THR . 9.0 m 66.35 23.19 10.72 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 121.502 0.667 . . . . 54.4 110.995 178.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 53.5 tttp -140.35 94.62 8.49 Favored Pre-proline 0 CA--C 1.542 0.664 0 CA-C-N 116.373 -0.376 . . . . 65.31 111.126 -177.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.461 ' HG2' ' HB3' ' A' ' 8' ' ' PRO . 2.8 Cg_endo -84.66 152.23 11.64 Favored 'Trans proline' 0 CA--C 1.544 1.022 0 C-N-CA 123.145 2.564 . . . . 43.24 112.46 174.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -68.52 -43.45 4.07 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 122.549 2.166 . . . . 73.11 113.319 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 60.7 m-85 -137.32 80.69 33.11 Favored Pre-proline 0 N--CA 1.474 0.74 0 CA-C-O 120.973 0.416 . . . . 72.51 111.53 177.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.461 ' HB3' ' HG2' ' A' ' 5' ' ' PRO . 49.8 Cg_endo -95.82 -0.13 2.22 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 122.999 2.466 . . . . 71.12 113.47 176.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.513 ' NH2' ' HA ' ' A' ' 58' ' ' GLU . 13.2 ptm180 -174.33 138.78 0.57 Allowed 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.785 0.661 . . . . 74.24 112.785 -175.645 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -152.78 139.26 18.62 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 122.856 0.462 . . . . 74.15 110.958 169.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.484 ' O ' ' HE3' ' A' ' 54' ' ' LYS . . . -101.52 143.92 30.91 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 120.725 0.297 . . . . 45.44 111.339 176.2 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 49.7 p90 -139.65 144.3 37.57 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 121.181 0.515 . . . . 74.53 111.725 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 62.3 mt -95.34 140.49 16.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-N 116.153 -0.476 . . . . 63.25 111.333 -178.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 43.0 t -122.47 140.52 46.04 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 C-N-CA 122.586 0.354 . . . . 51.51 111.05 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.4 p -102.86 113.47 26.93 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.036 0.446 . . . . 74.04 111.942 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.443 HD13 ' NE2' ' A' ' 29' ' ' GLN . 37.4 pt -120.96 176.01 4.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-O 121.103 0.478 . . . . 55.22 111.702 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.413 ' HB2' ' HB ' ' A' ' 24' ' ' THR . 12.3 pt-20 -142.27 132.11 24.28 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.266 -0.425 . . . . 64.0 110.836 177.158 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -117.22 161.04 20.12 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-O 120.833 0.349 . . . . 71.34 111.876 -178.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.19 -147.16 17.19 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 121.471 -0.395 . . . . 64.33 113.583 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.453 ' O ' HG23 ' A' ' 24' ' ' THR . 94.9 mttt -89.1 151.95 47.5 Favored Pre-proline 0 N--CA 1.473 0.68 0 N-CA-C 112.187 0.44 . . . . 74.23 112.187 -173.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -53.59 123.09 12.5 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 122.345 2.03 . . . . 71.31 111.932 175.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 88.33 -50.84 3.89 Favored Glycine 0 CA--C 1.528 0.883 0 C-N-CA 121.05 -0.595 . . . . 55.01 112.48 -175.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.416 HE21 ' HA ' ' A' ' 23' ' ' GLN . 0.1 OUTLIER -95.33 76.75 3.4 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.259 0.552 . . . . 65.43 110.896 177.311 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.453 HG23 ' O ' ' A' ' 20' ' ' LYS . 33.0 p -118.09 161.42 19.87 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.718 0.636 . . . . 70.25 112.718 -177.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 62.0 t -108.76 130.33 61.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 CA-C-N 115.793 -0.639 . . . . 74.32 110.617 178.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.7 m -76.07 115.29 15.63 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 120.774 0.321 . . . . 73.41 111.737 -178.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.404 ' HB2' HG13 ' A' ' 16' ' ' ILE . 88.7 m95 -117.36 144.3 45.07 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.173 0.511 . . . . 75.21 111.52 177.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -111.01 115.39 29.39 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.053 -0.521 . . . . 75.42 110.817 176.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.539 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 91.4 mt-30 -97.49 125.4 42.15 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 120.727 0.298 . . . . 72.14 111.647 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.7 tp -90.49 115.08 27.36 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 122.281 -0.262 . . . . 70.1 110.336 173.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 58.3 mtt-85 -122.95 151.61 41.65 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 116.771 -0.195 . . . . 73.21 110.925 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -122.43 167.74 12.94 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 120.885 0.374 . . . . 64.04 111.782 179.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.3 p-10 -85.59 -30.55 23.22 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-O 121.097 0.475 . . . . 74.23 111.352 178.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -117.29 145.64 36.45 Favored Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 122.89 0.476 . . . . 72.25 110.799 176.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -72.28 -13.99 17.07 Favored 'Cis proline' 0 CA--C 1.543 0.951 0 C-N-CA 124.365 -1.098 . . . . 71.12 113.516 2.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -151.42 150.73 27.52 Favored Pre-proline 0 CA--C 1.539 0.551 0 CA-C-N 116.558 -0.292 . . . . 74.43 110.691 177.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -58.98 -24.73 74.61 Favored 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 122.747 2.298 . . . . 71.23 112.918 -178.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -82.68 3.02 30.73 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.741 -0.663 . . . . 72.54 111.897 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 89.2 p -64.81 105.09 0.93 Allowed 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 121.196 0.522 . . . . 45.31 111.851 -176.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 54.5 tp -91.92 111.09 22.49 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.169 -0.469 . . . . 73.15 110.35 175.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 44.7 mm -77.49 -51.81 17.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 CA-C-N 116.356 -0.384 . . . . 55.32 111.386 -179.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 94.5 p -168.77 159.03 9.46 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.049 0.452 . . . . 62.15 111.954 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.539 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 45.8 mt-10 -114.79 121.42 43.24 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.961 -0.563 . . . . 72.21 110.465 175.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -126.59 141.95 41.71 Favored Pre-proline 0 N--CA 1.47 0.574 0 O-C-N 122.081 -0.387 . . . . 71.25 111.721 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -71.78 -27.08 18.48 Favored 'Trans proline' 0 CA--C 1.542 0.888 0 C-N-CA 122.573 2.182 . . . . 70.45 113.616 -177.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 28.1 p -106.07 148.14 28.11 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.066 0.46 . . . . 74.22 111.781 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.438 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -64.14 -31.75 73.06 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.308 -0.406 . . . . 74.53 111.335 175.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 27.9 tp60 -57.01 -54.49 46.14 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 116.465 -0.334 . . . . 54.23 111.319 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -56.18 -42.45 77.11 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 120.897 0.379 . . . . 55.42 111.33 177.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.53 -41.68 99.02 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.873 0.368 . . . . 62.11 111.678 179.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.438 ' HG3' ' O ' ' A' ' 47' ' ' ALA . 66.0 mtt -64.97 -49.11 71.6 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.368 -0.378 . . . . 64.11 110.944 177.183 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -62.22 -37.62 86.06 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 111.779 0.288 . . . . 73.42 111.779 178.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.68 -43.36 89.5 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.514 -0.312 . . . . 74.31 111.048 176.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.484 ' HE3' ' O ' ' A' ' 11' ' ' ALA . 87.6 tttt -61.58 -53.97 49.26 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.466 -0.334 . . . . 73.31 111.109 176.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -56.9 -45.88 82.32 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.358 -0.383 . . . . 71.32 111.266 178.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 55.1 ttm-85 -56.74 -44.73 81.99 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.055 0.455 . . . . 71.42 110.929 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -63.26 -48.38 78.43 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.966 -0.561 . . . . 75.04 110.577 175.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.513 ' HA ' ' NH2' ' A' ' 9' ' ' ARG . 6.0 mm-40 -76.98 15.41 0.68 Allowed 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.743 0.646 . . . . 72.35 112.743 -175.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 52.0 m-20 -90.18 132.76 34.95 Favored Pre-proline 0 CA--C 1.537 0.464 0 O-C-N 122.178 -0.326 . . . . 75.01 110.818 170.103 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -72.05 11.24 0.75 Allowed 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 122.494 2.13 . . . . 71.02 112.756 177.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -79.33 -34.4 42.24 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 116.127 -0.488 . . . . 72.42 111.331 178.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -100.25 136.54 39.98 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.177 0.513 . . . . 75.43 111.627 -178.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -85.79 -172.16 3.96 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.41 0.624 . . . . 72.12 112.177 -178.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 83.8 mt -71.25 99.78 1.98 Allowed 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.031 -0.531 . . . . 74.24 111.539 -178.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -63.6 90.85 0.05 Allowed 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.508 0.67 . . . . 70.45 109.878 175.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 19.5 p-80 -96.53 37.68 1.26 Allowed 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 112.915 0.709 . . . . 75.53 112.915 -169.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 46.8 t-80 -78.47 99.77 6.58 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.999 0.428 . . . . 72.01 110.02 173.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -78.34 31.4 0.18 Allowed 'General case' 0 CA--C 1.543 0.701 0 CA-C-O 120.83 0.348 . . . . 74.23 111.89 -174.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 44.0 t-80 56.57 13.97 1.54 Allowed 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 112.899 0.703 . . . . 70.15 112.899 -179.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 10.8 t60 -77.73 68.4 3.79 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 109.594 -0.521 . . . . 64.25 109.594 177.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 . . . . . 0 C--O 1.251 1.173 0 CA-C-N 115.481 -0.781 . . . . 51.43 111.107 -170.642 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.9 ptt? . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 121.087 0.47 . . . . 75.42 111.214 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -82.27 165.41 16.72 Favored 'Trans proline' 0 CA--C 1.538 0.703 0 C-N-CA 122.633 2.222 . . . . 74.42 113.071 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 54.3 p -66.88 107.1 2.09 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 120.912 0.386 . . . . 63.1 110.967 176.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt 59.5 84.73 0.2 Allowed Pre-proline 0 N--CA 1.471 0.616 0 CA-C-N 115.973 -0.558 . . . . 73.41 111.232 -171.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.416 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 17.1 Cg_exo -68.75 154.37 71.36 Favored 'Trans proline' 0 CA--C 1.541 0.835 0 C-N-CA 122.728 2.285 . . . . 74.0 113.357 -178.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 5' ' ' PRO . 37.1 Cg_exo -62.37 169.47 8.01 Favored 'Trans proline' 0 CA--C 1.541 0.828 0 C-N-CA 122.654 2.236 . . . . 64.31 112.593 173.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 14.9 p90 -118.27 95.23 48.24 Favored Pre-proline 0 CA--C 1.545 0.786 0 CA-C-O 121.089 0.471 . . . . 73.15 111.943 -177.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -73.12 64.42 4.24 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 122.861 2.374 . . . . 71.14 112.133 175.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.426 ' NH2' ' O ' ' A' ' 57' ' ' TYR . 30.7 mtp-105 -98.5 102.93 14.82 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.934 -0.575 . . . . 70.52 111.545 -176.081 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -145.57 144.88 30.76 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.984 0.421 . . . . 73.23 111.767 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.43 ' HB2' ' CD2' ' A' ' 57' ' ' TYR . . . -128.78 152.47 48.42 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.981 -0.554 . . . . 72.12 111.511 179.188 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 33.9 p90 -142.27 168.79 18.91 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 120.856 0.36 . . . . 73.24 111.745 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 59.6 mt -109.81 136.87 44.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 N-CA-C 112.053 0.39 . . . . 63.12 112.053 -174.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 78.4 t -127.0 131.87 70.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 CA-C-N 116.46 -0.336 . . . . 70.53 110.731 175.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 68.2 p -89.91 123.05 33.51 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.312 0.486 . . . . 63.4 112.312 -177.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.483 HD13 ' NE2' ' A' ' 29' ' ' GLN . 37.1 pt -123.0 175.26 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 CA-C-N 116.326 -0.397 . . . . 72.4 110.495 173.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -134.61 137.89 44.08 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-O 120.935 0.398 . . . . 74.42 111.959 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 53.1 mttp -124.11 176.76 6.18 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 116.179 -0.464 . . . . 55.22 110.248 174.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.47 -142.48 15.87 Favored Glycine 0 CA--C 1.529 0.949 0 C-N-CA 121.214 -0.517 . . . . 50.32 113.635 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 9.4 mtpm? -104.01 146.37 32.41 Favored Pre-proline 0 N--CA 1.473 0.722 0 C-N-CA 122.574 0.35 . . . . 74.05 111.571 -178.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_exo -45.51 125.48 7.62 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 122.98 2.453 . . . . 35.14 113.039 178.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 86.94 -65.93 3.65 Favored Glycine 0 CA--C 1.525 0.682 0 C-N-CA 120.904 -0.665 . . . . 62.4 112.237 -175.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -83.05 68.55 9.57 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.284 0.564 . . . . 74.33 110.652 177.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 71.5 p -103.8 159.62 15.48 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 121.264 0.554 . . . . 74.4 112.288 -176.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 86.8 t -109.73 127.07 66.83 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-N 115.931 -0.577 . . . . 75.21 110.178 174.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 59.0 m -79.68 115.59 19.38 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.095 0.474 . . . . 64.42 111.719 -178.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 73.6 m95 -102.71 132.31 48.93 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.104 -0.498 . . . . 74.11 110.953 177.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -97.1 114.4 26.06 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.001 0.429 . . . . 73.01 110.907 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.737 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 92.0 mt-30 -95.3 120.75 36.07 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.123 -0.489 . . . . 73.2 111.696 -178.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 58.2 tp -85.09 105.3 15.72 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.309 -0.405 . . . . 62.04 110.418 175.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.455 ' NH2' ' HA ' ' A' ' 38' ' ' ASP . 15.2 mtp-105 -111.49 139.97 46.48 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.336 -0.393 . . . . 70.13 110.945 -177.307 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -109.86 149.17 30.26 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 120.932 0.396 . . . . 73.54 111.324 177.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -77.36 -22.76 51.26 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 112.422 0.527 . . . . 75.2 112.422 -175.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -128.22 148.26 66.97 Favored Pre-proline 0 N--CA 1.472 0.659 0 O-C-N 122.113 -0.367 . . . . 64.34 111.13 179.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -70.31 -42.28 0.79 Allowed 'Cis proline' 0 C--N 1.359 1.116 0 C-N-CA 124.215 -1.161 . . . . 73.41 113.32 0.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -103.65 145.8 31.3 Favored Pre-proline 0 N--CA 1.469 0.482 0 N-CA-C 110.293 -0.262 . . . . 74.44 110.293 175.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -62.85 -6.41 9.22 Favored 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 122.288 1.992 . . . . 74.42 113.124 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.455 ' HA ' ' NH2' ' A' ' 31' ' ' ARG . 5.5 m-20 -103.9 14.93 29.79 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.098 0.407 . . . . 63.14 112.098 178.665 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.7 m -65.52 87.27 0.08 Allowed 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.893 0.378 . . . . 71.23 111.093 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 59.0 tp -72.55 103.06 3.41 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 121.108 0.48 . . . . 64.1 111.081 178.05 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.2 mm -71.62 -43.36 71.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 CA-C-N 116.202 -0.453 . . . . 63.44 111.174 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.6 t -174.12 149.54 1.45 Allowed 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 112.069 0.396 . . . . 74.05 112.069 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.737 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 45.1 mt-10 -108.13 134.22 51.31 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 116.209 -0.451 . . . . 54.52 110.521 173.052 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 37.9 m80 -136.33 145.07 50.31 Favored Pre-proline 0 CA--C 1.538 0.504 0 O-C-N 122.236 -0.29 . . . . 75.23 111.311 178.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -73.66 -15.81 24.13 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 122.479 2.119 . . . . 50.24 112.851 179.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 34.8 p -115.97 142.33 46.93 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 120.936 0.398 . . . . 74.34 111.372 178.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.462 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -64.15 -35.6 81.3 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 120.967 0.413 . . . . 53.13 110.855 176.779 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.408 HE21 ' N ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -55.26 -49.34 72.29 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.282 -0.417 . . . . 73.35 111.529 178.92 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.408 ' N ' HE21 ' A' ' 48' ' ' GLN . 52.4 mt-10 -62.49 -38.53 90.25 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 120.881 0.372 . . . . 73.53 111.126 177.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.32 -40.91 98.62 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 120.93 0.395 . . . . 72.32 111.221 178.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.462 ' HG3' ' O ' ' A' ' 47' ' ' ALA . 86.8 mtp -69.49 -44.42 71.14 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.018 0.437 . . . . 64.22 111.329 178.288 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.601 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 12.4 t70 -65.79 -41.68 91.68 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-O 120.967 0.413 . . . . 70.45 111.122 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.24 -36.58 84.57 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.019 0.437 . . . . 61.53 110.773 175.141 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 43.7 tttp -56.9 -49.14 76.46 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 115.986 -0.552 . . . . 71.22 111.345 175.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.601 ' HG2' ' O ' ' A' ' 52' ' ' ASP . 17.0 pttm -61.59 -43.97 97.88 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 121.084 -0.246 . . . . 53.42 110.854 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -65.2 -35.36 80.83 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 120.601 0.239 . . . . 72.41 111.497 -178.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.467 ' HA ' ' HB2' ' A' ' 62' ' ' LYS . 66.6 t80 -64.15 -47.56 79.4 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.867 0.365 . . . . 73.32 110.895 175.13 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -71.97 -21.57 61.57 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 116.288 -0.415 . . . . 50.31 111.512 -177.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -64.84 148.93 96.98 Favored Pre-proline 0 CA--C 1.543 0.69 0 N-CA-C 110.371 -0.233 . . . . 71.33 110.371 167.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -54.49 -14.34 6.94 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 122.608 2.205 . . . . 71.33 113.276 177.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -57.25 -28.63 63.12 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 112.609 0.596 . . . . 72.13 112.609 179.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.602 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -119.34 101.14 7.76 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.215 0.82 . . . . 71.51 113.215 -177.641 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -122.43 108.72 13.52 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 108.806 -0.813 . . . . 71.42 108.806 167.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 84.4 mt -115.3 40.76 2.61 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 113.298 0.851 . . . . 62.23 113.298 -165.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -72.87 85.01 1.24 Allowed 'General case' 0 N--CA 1.468 0.454 0 O-C-N 121.698 -0.626 . . . . 74.1 111.384 176.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 64.0 t60 -70.45 85.48 0.61 Allowed 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 109.257 -0.646 . . . . 71.42 109.257 172.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 52.9 t60 -59.87 94.52 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.181 0.515 . . . . 74.41 111.933 -170.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 39.9 t60 -172.34 91.43 0.11 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.498 -0.774 . . . . 71.33 109.295 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -67.18 86.32 0.15 Allowed 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 112.46 0.541 . . . . 73.33 112.46 -170.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 38.7 t-80 -77.52 113.16 15.05 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.351 -0.386 . . . . 61.21 110.524 173.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 26.7 p-80 . . . . . 0 C--O 1.25 1.097 0 CA-C-O 119.19 -0.433 . . . . 74.42 111.291 177.046 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.595 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.1 mpt? . . . . . 0 N--CA 1.488 1.448 0 CA-C-O 120.319 0.104 . . . . 74.2 111.059 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_exo -57.48 -56.99 1.41 Allowed 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 122.938 2.425 . . . . 75.24 113.042 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 90.6 m 63.54 -73.71 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 116.116 -0.493 . . . . 72.3 111.537 -177.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -100.13 115.03 65.88 Favored Pre-proline 0 CA--C 1.543 0.682 0 C-N-CA 122.274 0.229 . . . . 71.2 110.772 176.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.425 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 92.6 Cg_endo -75.94 150.92 34.86 Favored 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 122.644 2.23 . . . . 74.54 113.119 -177.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 5' ' ' PRO . 12.1 Cg_exo -70.31 96.39 0.64 Allowed 'Trans proline' 0 CA--C 1.539 0.725 0 C-N-CA 122.43 2.087 . . . . 73.13 112.073 176.028 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -60.94 113.04 6.7 Favored Pre-proline 0 CA--C 1.542 0.656 0 CA-C-N 116.548 -0.297 . . . . 75.24 110.895 178.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -55.3 110.4 0.54 Allowed 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 122.986 2.457 . . . . 64.1 114.175 -173.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.61 ' HG3' ' HA ' ' A' ' 58' ' ' GLU . 20.0 tpp180 -86.01 90.49 8.11 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 121.0 0.428 . . . . 75.31 110.034 174.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -141.36 141.65 33.81 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 112.05 0.389 . . . . 74.32 112.05 -172.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -138.03 162.07 35.08 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 120.801 0.334 . . . . 72.02 111.704 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 33.3 p90 -141.68 141.21 33.34 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 121.187 0.517 . . . . 71.41 111.952 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 62.4 mt -92.81 137.07 23.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-N 116.182 -0.463 . . . . 74.32 111.836 -177.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 48.2 t -123.65 137.62 56.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 C-N-CA 122.724 0.409 . . . . 74.15 110.854 177.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 77.8 p -98.07 129.74 44.89 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 112.376 0.51 . . . . 75.15 112.376 -177.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.415 HD13 ' NE2' ' A' ' 29' ' ' GLN . 41.3 pt -124.5 171.72 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-N 116.293 -0.412 . . . . 74.44 110.823 177.216 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -129.66 128.35 42.39 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.011 0.434 . . . . 72.43 111.909 -178.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -120.44 169.24 10.5 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 116.418 -0.356 . . . . 73.25 110.821 177.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.71 -141.76 15.52 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 120.957 -0.64 . . . . 31.43 114.049 177.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -94.49 141.3 23.28 Favored Pre-proline 0 CA--C 1.541 0.626 0 N-CA-C 111.997 0.369 . . . . 60.3 111.997 -173.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -55.63 99.6 0.07 OUTLIER 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.583 2.188 . . . . 72.41 111.935 175.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 116.21 -52.64 0.66 Allowed Glycine 0 CA--C 1.525 0.674 0 N-CA-C 111.537 -0.625 . . . . 43.24 111.537 -173.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.7 mm-40 -99.41 78.14 2.17 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.124 0.488 . . . . 53.02 110.67 173.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 81.6 p -105.89 164.73 11.72 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 121.342 0.592 . . . . 70.32 112.094 -177.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 61.7 t -121.49 118.43 55.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 CA-C-N 115.797 -0.638 . . . . 72.45 109.633 173.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 87.9 m -76.07 115.33 15.67 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 120.945 0.402 . . . . 71.52 111.665 -177.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 36.9 m95 -97.37 151.08 20.29 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.079 -0.51 . . . . 74.23 111.271 177.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -109.67 115.0 29.06 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 116.204 -0.453 . . . . 73.01 111.34 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.615 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 92.6 mt-30 -98.26 130.21 44.97 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.002 -0.545 . . . . 74.14 111.041 178.083 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.5 tp -92.95 107.92 19.59 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 120.86 0.362 . . . . 65.33 111.121 175.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -102.95 163.97 11.89 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 120.917 0.389 . . . . 71.41 110.48 175.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -144.11 140.63 29.54 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.46 -0.336 . . . . 53.5 111.466 177.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -63.89 -17.79 63.55 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 121.014 0.435 . . . . 73.53 111.737 176.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 48.4 m80 -127.82 133.88 25.6 Favored Pre-proline 0 CA--C 1.544 0.745 0 CA-C-N 116.313 -0.403 . . . . 74.05 111.339 -174.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -77.96 -53.04 0.16 OUTLIER 'Cis proline' 0 CA--C 1.544 1.018 0 C-N-CA 123.853 -1.311 . . . . 72.55 113.334 -2.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.438 ' HE2' ' HD2' ' A' ' 37' ' ' PRO . 14.1 mmmm -77.92 141.49 63.63 Favored Pre-proline 0 CA--C 1.54 0.584 0 O-C-N 122.008 -0.433 . . . . 74.13 110.43 177.067 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.438 ' HD2' ' HE2' ' A' ' 36' ' ' LYS . 14.9 Cg_endo -56.22 -28.11 69.53 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 122.382 2.055 . . . . 34.1 112.871 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -99.05 22.73 9.92 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 116.558 -0.292 . . . . 72.4 111.7 177.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.0 t -57.85 94.99 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 121.014 0.435 . . . . 70.21 111.548 -178.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 58.8 tp -85.41 113.89 22.04 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.175 -0.466 . . . . 71.34 110.641 178.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.7 mm -81.27 -55.41 8.17 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 CA-C-N 116.61 -0.268 . . . . 72.23 111.624 -179.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 45.4 m -164.67 155.13 14.36 Favored 'General case' 0 N--CA 1.481 1.107 0 CA-C-O 120.923 0.392 . . . . 71.42 111.631 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.615 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 45.2 mt-10 -105.45 139.45 40.06 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.189 -0.46 . . . . 75.53 110.296 174.271 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . 0.423 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 34.7 m80 -137.06 148.07 61.29 Favored Pre-proline 0 N--CA 1.473 0.702 0 N-CA-C 112.115 0.413 . . . . 74.22 112.115 179.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 44' ' ' HIS . 22.4 Cg_exo -63.65 -49.41 4.32 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 123.056 2.504 . . . . 73.24 113.499 178.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 34.0 p -101.64 158.97 15.71 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-O 121.352 0.596 . . . . 73.31 112.095 -178.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.425 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -64.68 -40.11 94.82 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.812 -0.631 . . . . 75.42 111.561 179.008 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.3 tp60 -58.94 -46.04 88.96 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.541 -0.3 . . . . 73.22 111.407 -178.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -56.36 -42.76 78.32 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 121.401 0.619 . . . . 62.13 111.001 175.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.88 -38.91 90.02 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.016 -0.538 . . . . 50.22 111.612 179.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.425 ' HG3' ' O ' ' A' ' 47' ' ' ALA . 73.6 mtp -70.98 -39.63 72.36 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.6 -0.273 . . . . 64.41 111.556 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.536 ' HA ' ' HD3' ' A' ' 55' ' ' LYS . 13.2 m-20 -59.92 -40.81 90.13 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 120.917 0.389 . . . . 53.23 111.343 174.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.8 -44.92 91.87 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.976 0.417 . . . . 63.53 110.942 174.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -56.88 -46.49 81.82 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.083 0.468 . . . . 73.12 110.896 176.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.536 ' HD3' ' HA ' ' A' ' 52' ' ' ASP . 47.3 mtpt -55.12 -53.94 49.51 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.77 -0.65 . . . . 74.14 111.174 175.187 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 56' ' ' ARG . 13.8 mtp180 -56.69 -26.56 56.89 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 111.992 0.367 . . . . 64.23 111.992 178.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -80.03 -47.15 15.34 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 111.645 0.239 . . . . 75.11 111.645 176.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.61 ' HA ' ' HG3' ' A' ' 9' ' ' ARG . 48.1 mt-10 -84.17 -16.13 44.58 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.687 0.625 . . . . 64.02 112.687 -173.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -79.28 161.55 67.31 Favored Pre-proline 0 CA--C 1.541 0.628 0 O-C-N 122.311 -0.243 . . . . 74.21 110.97 176.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -47.53 88.83 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 122.751 2.3 . . . . 45.02 114.119 -177.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -68.31 1.07 3.19 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.805 -0.634 . . . . 74.02 112.176 178.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.587 ' HD2' ' N ' ' A' ' 62' ' ' LYS . 3.4 mptp? -84.1 -9.85 58.27 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 111.892 0.33 . . . . 53.44 111.892 -178.12 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.556 ' HG2' ' H ' ' A' ' 65' ' ' GLU . 35.6 tt0 -64.72 150.85 46.52 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 120.994 0.426 . . . . 63.43 111.364 179.049 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.444 HD22 ' N ' ' A' ' 64' ' ' LEU . 2.9 mm? -70.74 -42.37 70.61 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.403 -0.362 . . . . 73.22 111.04 176.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.556 ' H ' ' HG2' ' A' ' 63' ' ' GLU . 71.7 tt0 68.46 -9.32 0.53 Allowed 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.316 0.646 . . . . 73.22 112.259 -178.386 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 50.8 t-80 -80.05 129.37 34.44 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 122.106 -0.371 . . . . 71.2 110.383 176.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 47.4 t-80 71.62 -48.83 0.68 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.342 0.657 . . . . 74.15 111.663 -175.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 49.8 t-80 -64.55 88.38 0.06 Allowed 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.033 0.444 . . . . 74.0 110.826 174.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 35.6 p-80 -74.87 136.27 41.52 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.993 0.425 . . . . 71.13 112.004 -176.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 9.3 p-80 -86.76 -12.96 46.61 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 120.813 0.34 . . . . 71.21 111.306 177.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 73.2 t60 . . . . . 0 C--O 1.253 1.268 0 CA-C-O 118.641 -0.695 . . . . 73.4 110.999 176.998 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.4 ptm . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 120.434 0.159 . . . . 70.04 111.269 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -65.69 133.92 35.98 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 122.404 2.069 . . . . 63.21 112.394 173.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 63.5 p -86.83 17.1 4.24 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-O 120.885 0.374 . . . . 74.21 111.009 178.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 51.8 tptt -60.95 111.08 3.59 Favored Pre-proline 0 CA--C 1.544 0.726 0 CA-C-N 115.925 -0.579 . . . . 71.2 112.545 -174.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -89.57 157.38 5.3 Favored 'Trans proline' 0 CA--C 1.546 1.091 0 C-N-CA 122.931 2.421 . . . . 72.42 112.907 177.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -69.1 151.79 72.79 Favored 'Trans proline' 0 CA--C 1.542 0.897 0 C-N-CA 122.662 2.241 . . . . 65.31 112.555 174.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.411 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 25.5 p90 -114.07 147.36 37.66 Favored Pre-proline 0 CA--C 1.542 0.654 0 CA-C-N 116.724 -0.216 . . . . 74.34 111.374 178.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 7' ' ' TYR . 38.9 Cg_exo -58.83 121.73 10.44 Favored 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 122.962 2.441 . . . . 71.03 114.166 -177.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.442 ' NH2' ' O ' ' A' ' 57' ' ' TYR . 0.0 OUTLIER -137.36 80.69 1.82 Allowed 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.186 0.517 . . . . 74.42 111.119 176.715 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -88.28 164.64 15.5 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.94 -0.573 . . . . 74.2 111.62 -177.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.581 ' HA ' ' HA ' ' A' ' 32' ' ' ALA . . . -131.72 156.87 45.16 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 116.156 -0.474 . . . . 52.25 111.663 176.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 55.5 p90 -149.22 169.56 20.48 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 121.04 0.448 . . . . 74.14 111.63 178.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 69.2 mt -113.04 130.12 67.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 N-CA-C 112.238 0.458 . . . . 72.32 112.238 -175.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.49 HG21 ' HD2' ' A' ' 31' ' ' ARG . 60.1 t -111.5 124.59 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-N 116.395 -0.366 . . . . 75.42 111.083 177.376 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 68.2 p -90.2 113.0 24.71 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 122.029 -0.419 . . . . 72.04 111.986 -178.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.438 HD13 ' NE2' ' A' ' 29' ' ' GLN . 32.4 pt -115.87 160.06 15.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 120.64 0.257 . . . . 75.53 111.101 176.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -124.39 121.61 35.4 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.131 0.491 . . . . 75.5 111.266 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 5.3 mtpm? -118.0 175.28 5.75 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 116.011 -0.541 . . . . 55.52 110.678 -178.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.29 -136.88 12.94 Favored Glycine 0 CA--C 1.526 0.733 0 C-N-CA 120.564 -0.827 . . . . 62.43 113.62 177.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.583 ' HD2' ' N ' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -96.28 156.45 36.92 Favored Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 122.526 0.33 . . . . 65.22 111.47 -175.16 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -56.38 123.28 13.47 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.686 2.257 . . . . 52.1 112.424 174.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 80.38 -60.73 4.5 Favored Glycine 0 CA--C 1.526 0.746 0 C-N-CA 120.88 -0.676 . . . . 74.13 112.494 -176.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -80.15 73.5 6.97 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.514 0.673 . . . . 64.42 110.628 176.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 78.2 p -100.01 167.96 10.16 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.558 -0.746 . . . . 75.42 112.638 -175.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 59.2 t -118.36 126.06 74.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.241 -0.89 . . . . 62.04 109.455 170.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 35.5 m -81.13 114.67 20.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.917 0.389 . . . . 70.44 110.866 -179.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 93.8 m95 -108.88 131.0 55.44 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.094 0.473 . . . . 75.45 110.847 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 48.6 m-85 -98.1 114.27 26.41 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 116.361 -0.381 . . . . 74.21 110.953 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.474 ' HB2' ' HB ' ' A' ' 14' ' ' VAL . 68.8 mt-30 -88.6 117.78 27.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.369 -0.378 . . . . 75.31 111.645 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.6 tp -81.16 103.94 11.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.914 0.388 . . . . 72.31 110.195 173.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.49 ' HD2' HG21 ' A' ' 14' ' ' VAL . 58.8 mtt180 -114.27 171.41 7.63 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.518 -0.31 . . . . 73.34 110.752 178.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.581 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . . . -126.77 150.59 49.04 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.117 0.484 . . . . 61.14 111.865 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -72.17 -25.31 61.64 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.168 0.509 . . . . 72.42 111.43 175.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -132.45 141.83 42.7 Favored Pre-proline 0 CA--C 1.544 0.745 0 CA-C-N 116.2 -0.454 . . . . 64.41 111.105 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -77.17 -30.36 6.04 Favored 'Cis proline' 0 C--N 1.355 0.872 0 C-N-CA 124.068 -1.221 . . . . 73.13 113.31 0.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -124.53 143.73 44.11 Favored Pre-proline 0 CA--C 1.54 0.584 0 CA-C-O 120.568 0.223 . . . . 74.23 111.532 -176.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -55.26 -27.78 58.84 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.718 2.278 . . . . 62.25 113.22 177.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -92.9 13.44 20.49 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.098 0.407 . . . . 75.31 112.098 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.7 m -68.4 83.84 0.26 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.159 0.504 . . . . 75.22 110.336 174.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 58.1 tp -82.94 122.32 28.12 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 116.015 -0.539 . . . . 72.11 111.772 -177.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 45.9 mm -87.67 -49.98 14.11 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-N 116.284 -0.416 . . . . 61.14 111.495 179.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.7 t -172.74 148.79 1.93 Allowed 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 111.851 0.315 . . . . 75.3 111.851 -177.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -103.61 133.55 48.44 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.027 0.441 . . . . 73.14 110.856 175.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . 0.559 ' HB3' ' HB3' ' A' ' 49' ' ' GLU . 45.0 m-70 -128.63 143.53 48.76 Favored Pre-proline 0 N--CA 1.47 0.542 0 O-C-N 122.287 -0.258 . . . . 75.54 111.473 -178.011 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -71.87 -26.93 18.33 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 C-N-CA 122.827 2.351 . . . . 74.21 114.492 -174.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 25.6 p -114.47 151.18 33.65 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.85 -0.531 . . . . 73.0 111.964 -178.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.04 -39.71 86.87 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.196 -0.456 . . . . 63.42 111.62 177.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.9 tp60 -61.77 -42.58 99.17 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 120.665 0.269 . . . . 75.14 110.942 178.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.559 ' HB3' ' HB3' ' A' ' 44' ' ' HIS . 12.0 mm-40 -56.24 -47.06 79.25 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.993 0.425 . . . . 61.23 111.355 174.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.82 -50.91 69.1 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.136 -0.484 . . . . 64.13 111.959 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 93.5 mmm -63.15 -39.38 94.49 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 111.894 0.331 . . . . 73.43 111.894 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.445 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 32.8 t70 -64.06 -49.69 71.33 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.952 0.406 . . . . 74.3 110.844 179.51 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.23 -37.71 86.43 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.1 0.476 . . . . 73.53 111.306 175.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.7 tttm -56.01 -47.47 77.73 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.027 -0.533 . . . . 63.43 111.264 177.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -58.98 -43.76 91.46 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.025 0.441 . . . . 64.31 111.482 176.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.445 ' HG3' ' O ' ' A' ' 52' ' ' ASP . 51.5 mtt-85 -62.27 -32.97 73.75 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.167 -0.47 . . . . 74.32 111.359 -179.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.445 ' CD2' ' HB2' ' A' ' 11' ' ' ALA . 57.2 t80 -76.89 -44.08 33.27 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.442 -0.345 . . . . 72.51 111.775 177.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -80.18 5.75 13.63 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.517 0.562 . . . . 75.13 112.517 -175.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -62.19 135.84 95.18 Favored Pre-proline 0 CA--C 1.547 0.83 0 N-CA-C 109.532 -0.544 . . . . 63.42 109.532 174.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_exo -37.75 -60.35 0.44 Allowed 'Trans proline' 0 CA--C 1.543 0.975 0 C-N-CA 123.735 2.957 . . . . 75.34 115.16 -172.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -149.33 23.35 0.92 Allowed 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.967 0.728 . . . . 70.41 112.967 -177.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.505 ' NZ ' ' HB2' ' A' ' 62' ' ' LYS . 3.5 ttmp? -63.81 135.18 56.42 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.931 0.396 . . . . 74.32 111.709 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -100.2 105.53 17.12 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.319 -0.4 . . . . 63.32 111.51 -178.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 88.0 mt -67.98 -25.43 65.42 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.488 0.661 . . . . 75.32 110.265 173.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -145.31 163.12 35.49 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.004 -0.998 . . . . 64.25 109.741 171.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 33.5 m80 -69.85 119.81 14.64 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.063 0.459 . . . . 74.1 112.063 -174.18 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 31.4 p-80 -57.59 138.77 54.92 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 116.223 -0.444 . . . . 71.4 111.304 178.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 19.2 p-80 -137.16 150.02 47.65 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.309 -0.405 . . . . 74.52 111.561 -176.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 43.0 t-80 -63.01 -68.41 0.34 Allowed 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 112.915 0.709 . . . . 72.35 112.915 -174.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 -158.94 157.81 32.1 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.132 0.492 . . . . 74.13 111.71 -175.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 82.8 t60 . . . . . 0 C--O 1.245 0.867 0 CA-C-O 118.54 -0.743 . . . . 75.12 110.814 172.148 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.6 mtm . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 120.453 0.168 . . . . 65.41 110.928 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -61.9 108.67 0.68 Allowed 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 122.61 2.207 . . . . 71.34 113.449 -176.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 48.1 p -103.49 -57.21 2.07 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.142 0.496 . . . . 71.41 111.175 178.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.719 ' HZ3' ' HB2' ' A' ' 4' ' ' LYS . 0.2 OUTLIER -102.55 102.09 23.97 Favored Pre-proline 0 N--CA 1.471 0.578 0 CA-C-N 116.224 -0.444 . . . . 72.33 110.576 175.47 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -93.43 163.54 2.4 Favored 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 123.012 2.474 . . . . 72.01 113.161 178.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -67.09 130.75 23.53 Favored 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 122.356 2.037 . . . . 75.11 111.496 171.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 -57.41 144.68 70.71 Favored Pre-proline 0 CA--C 1.542 0.661 0 N-CA-C 111.944 0.35 . . . . 63.44 111.944 -177.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -59.57 171.62 2.52 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 122.954 2.436 . . . . 72.44 113.51 -178.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.725 ' HB2' ' HA ' ' A' ' 58' ' ' GLU . 18.1 ptp180 -121.45 7.21 10.09 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.466 0.913 . . . . 73.04 113.466 -168.235 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -95.2 143.05 26.93 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-O 121.487 0.661 . . . . 75.31 112.489 -170.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.417 ' HB1' ' O ' ' A' ' 31' ' ' ARG . . . -139.31 -174.8 3.97 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.53 -0.759 . . . . 71.41 111.048 -177.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -152.33 145.72 24.8 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.066 0.46 . . . . 55.35 111.605 178.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 70.2 mt -101.56 131.09 50.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-N 116.348 -0.387 . . . . 71.21 111.417 -179.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 59.9 t -105.84 127.31 60.96 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-N 116.394 -0.366 . . . . 72.4 111.05 177.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.6 p -91.29 112.68 24.69 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.741 0.305 . . . . 71.51 111.712 -178.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.516 HD11 ' HE3' ' A' ' 18' ' ' LYS . 29.3 pt -115.77 170.53 5.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 116.476 -0.329 . . . . 70.55 110.97 177.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.437 ' HB2' ' HB ' ' A' ' 24' ' ' THR . 9.9 pt-20 -133.17 126.47 31.72 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.442 0.639 . . . . 74.44 111.58 176.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.516 ' HE3' HD11 ' A' ' 16' ' ' ILE . 98.5 mttt -114.61 178.15 4.39 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.848 -0.614 . . . . 63.41 111.203 -178.171 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.32 -136.93 12.96 Favored Glycine 0 CA--C 1.527 0.811 0 C-N-CA 121.107 -0.568 . . . . 70.14 113.309 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 48.7 mmtm -119.18 154.23 53.54 Favored Pre-proline 0 CA--C 1.539 0.537 0 O-C-N 122.663 -0.316 . . . . 72.43 111.337 -178.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -49.09 127.5 17.47 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 122.609 2.206 . . . . 65.45 112.76 176.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 90.51 -51.91 3.35 Favored Glycine 0 CA--C 1.526 0.758 0 C-N-CA 120.942 -0.647 . . . . 74.32 112.369 -175.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -99.66 74.32 1.86 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.871 0.367 . . . . 70.31 111.08 177.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.437 ' HB ' ' HB2' ' A' ' 17' ' ' GLU . 76.9 p -103.08 145.64 29.6 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.384 0.611 . . . . 74.53 112.156 -178.452 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 54.0 t -108.93 124.88 65.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 CA-C-N 115.801 -0.636 . . . . 64.22 110.176 174.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.2 m -75.31 115.55 15.07 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.629 0.252 . . . . 73.3 111.238 -178.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 82.0 m95 -108.51 132.8 53.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.267 0.556 . . . . 71.02 111.235 177.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -99.28 115.03 28.22 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.976 -0.556 . . . . 75.2 110.858 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.481 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 83.9 mt-30 -98.44 114.65 27.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.086 -0.506 . . . . 63.32 111.552 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 60.6 tp -79.22 111.3 15.31 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.858 0.361 . . . . 71.54 110.572 176.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.417 ' O ' ' HB1' ' A' ' 11' ' ' ALA . 66.8 mtt180 -118.76 169.25 10.0 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.675 0.274 . . . . 71.45 110.885 178.185 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -140.66 143.91 35.39 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.93 0.395 . . . . 51.33 111.711 -178.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -68.75 -20.17 64.36 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 116.189 -0.46 . . . . 64.31 111.975 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 70.8 m80 -119.49 133.64 23.8 Favored Pre-proline 0 CA--C 1.543 0.681 0 CA-C-N 116.245 -0.434 . . . . 70.51 111.24 -176.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -80.18 -24.13 12.91 Favored 'Cis proline' 0 CA--C 1.539 0.766 0 C-N-CA 123.877 -1.301 . . . . 72.03 113.103 -0.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -131.68 129.5 22.07 Favored Pre-proline 0 N--CA 1.47 0.546 0 CA-C-N 116.615 -0.266 . . . . 54.4 110.995 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -67.72 7.74 0.53 Allowed 'Trans proline' 0 CA--C 1.544 0.993 0 C-N-CA 122.643 2.229 . . . . 73.42 113.445 -179.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.9 m-20 -101.17 -3.75 28.52 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 122.153 -0.342 . . . . 63.43 111.082 175.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.6 t -77.06 142.14 39.96 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.014 0.435 . . . . 74.21 112.064 -176.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 56.1 tp -115.73 123.59 48.67 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.128 -0.487 . . . . 72.41 111.051 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 44.4 mm -88.02 -53.95 8.85 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 N-CA-C 111.739 0.274 . . . . 72.34 111.739 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.8 t -163.43 154.15 16.22 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 112.319 0.488 . . . . 72.11 112.319 -178.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.481 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 46.4 mt-10 -113.91 132.57 55.88 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 116.333 -0.394 . . . . 74.24 110.757 177.43 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -141.16 139.73 19.74 Favored Pre-proline 0 N--CA 1.473 0.711 0 O-C-N 122.221 -0.3 . . . . 73.43 111.539 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo -72.64 -15.68 27.13 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 122.642 2.228 . . . . 73.43 113.641 -177.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 44.2 p -116.82 148.78 40.91 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 120.914 0.388 . . . . 44.22 111.534 177.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.71 -31.2 72.06 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.867 0.365 . . . . 75.05 111.439 177.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.423 ' O ' ' HB2' ' A' ' 52' ' ' ASP . 0.1 OUTLIER -60.62 -52.33 65.63 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.271 -0.422 . . . . 71.42 110.571 179.43 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -55.97 -45.85 78.8 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 120.897 0.379 . . . . 74.31 111.803 178.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.81 -49.24 78.49 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 120.99 0.424 . . . . 71.12 111.447 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.441 ' O ' ' HG3' ' A' ' 55' ' ' LYS . 24.2 mmt -64.23 -33.84 76.72 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.195 0.522 . . . . 53.24 111.101 175.167 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.825 ' HA ' ' HE2' ' A' ' 55' ' ' LYS . 3.6 t70 -61.97 -46.29 89.9 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.93 -0.577 . . . . 65.4 110.846 -177.469 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.95 -33.39 72.05 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 116.016 -0.538 . . . . 70.45 111.231 175.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 65.7 tttm -61.49 -37.22 82.88 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.193 -0.458 . . . . 54.54 111.346 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.825 ' HE2' ' HA ' ' A' ' 52' ' ' ASP . 51.1 mtmt -51.97 -55.37 20.78 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.742 0.306 . . . . 71.31 111.242 177.041 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 15.8 mtp180 -67.05 -26.71 66.89 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.002 0.371 . . . . 64.33 112.002 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -66.19 -32.45 73.89 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.035 0.445 . . . . 73.21 110.535 173.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.725 ' HA ' ' HB2' ' A' ' 9' ' ' ARG . 52.0 mt-10 -77.92 -45.37 24.23 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.952 0.406 . . . . 61.53 110.845 175.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -67.51 167.57 15.28 Favored Pre-proline 0 CA--C 1.549 0.908 0 N-CA-C 112.256 0.465 . . . . 64.3 112.256 177.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.24 -7.11 20.38 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.382 2.055 . . . . 63.24 112.455 172.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -76.78 29.96 0.13 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 122.707 0.403 . . . . 71.13 111.783 177.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.438 ' HE3' ' HB2' ' A' ' 62' ' ' LYS . 37.0 ttmt -77.0 131.58 38.53 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 122.787 0.435 . . . . 72.44 111.065 -179.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 45.2 mm-40 -104.15 -11.45 17.28 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.395 0.517 . . . . 65.24 112.395 -173.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 94.1 mt -55.49 126.8 26.74 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 120.904 0.383 . . . . 72.12 111.766 179.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -68.75 164.13 22.46 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.236 0.541 . . . . 72.13 111.763 177.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 68.2 m-70 -74.5 105.45 5.63 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.365 -0.38 . . . . 74.45 110.152 176.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 46.6 m80 -79.43 139.24 37.73 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.258 -0.428 . . . . 62.15 111.702 -176.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 72.9 m80 -88.61 164.8 15.19 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.43 0.634 . . . . 75.14 112.124 -177.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 21.5 m80 -81.49 84.1 6.8 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.663 -0.698 . . . . 72.23 111.387 -175.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 75.6 t60 -68.51 129.38 39.75 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 120.897 0.379 . . . . 74.31 111.799 -177.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 75.8 m80 . . . . . 0 C--O 1.254 1.297 0 CA-C-O 118.533 -0.746 . . . . 73.24 111.224 176.137 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.488 1.443 0 N-CA-C 110.604 -0.147 . . . . 44.1 110.604 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -66.58 78.61 0.35 Allowed 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.315 2.01 . . . . 72.42 113.349 -179.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 92.5 m -92.34 94.58 9.21 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 109.758 -0.46 . . . . 74.53 109.758 172.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.434 ' O ' ' HG3' ' A' ' 4' ' ' LYS . 20.7 pttp -59.24 111.51 3.85 Favored Pre-proline 0 CA--C 1.545 0.772 0 N-CA-C 112.791 0.663 . . . . 65.14 112.791 -173.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_endo -87.69 151.63 7.46 Favored 'Trans proline' 0 CA--C 1.544 1.014 0 C-N-CA 122.531 2.154 . . . . 61.04 112.041 173.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -73.55 -1.3 10.5 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 122.44 2.093 . . . . 74.32 112.849 178.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 33.5 p90 -143.61 147.66 40.18 Favored Pre-proline 0 CA--C 1.543 0.676 0 CA-C-N 116.382 -0.372 . . . . 71.01 110.894 -178.222 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -66.66 122.26 9.63 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 122.377 2.052 . . . . 73.41 111.808 172.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.428 ' HD3' ' O ' ' A' ' 58' ' ' GLU . 2.8 ptp180 -104.24 87.99 2.88 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.45 0.643 . . . . 75.04 112.187 -177.052 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -151.82 156.61 40.54 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.542 -0.753 . . . . 73.1 110.932 175.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.41 ' O ' ' HE3' ' A' ' 54' ' ' LYS . . . -134.5 178.65 6.82 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 121.062 0.458 . . . . 70.3 111.824 -175.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 33.0 p90 -144.41 141.46 29.66 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.338 0.589 . . . . 75.53 111.383 178.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 57.3 mt -91.58 125.53 44.27 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 CA-C-N 116.075 -0.511 . . . . 73.41 111.786 -177.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.452 HG21 ' HD2' ' A' ' 31' ' ' ARG . 83.8 t -106.1 132.4 53.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 CA-C-O 120.862 0.363 . . . . 74.1 111.047 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 67.8 p -93.19 120.86 33.94 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.306 0.484 . . . . 71.01 112.306 -178.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 37.8 pt -123.89 171.83 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 CA-C-O 120.763 0.316 . . . . 73.01 110.877 176.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.557 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 45.6 mt-10 -136.0 127.68 28.99 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.22 0.533 . . . . 73.02 111.623 178.047 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -104.99 174.69 5.77 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.266 -0.424 . . . . 73.01 110.83 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.41 -140.27 14.83 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 120.789 -0.719 . . . . 64.34 113.864 177.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.55 ' HB2' ' HB2' ' A' ' 23' ' ' GLN . 1.9 mptp? -102.29 154.43 37.41 Favored Pre-proline 0 N--CA 1.471 0.618 0 C-N-CA 122.43 0.292 . . . . 63.33 111.328 -176.135 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -54.91 112.81 1.14 Allowed 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 122.346 2.031 . . . . 74.35 111.885 172.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 94.72 -45.51 2.16 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 121.265 -0.493 . . . . 74.2 112.323 -175.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.55 ' HB2' ' HB2' ' A' ' 20' ' ' LYS . 27.8 mm-40 -96.52 71.63 2.69 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.322 0.582 . . . . 74.05 110.521 175.54 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.557 ' HB ' ' HB3' ' A' ' 17' ' ' GLU . 40.1 p -101.84 168.63 9.31 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.964 0.727 . . . . 71.33 112.964 -174.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 57.7 t -127.31 125.37 65.84 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 CA-C-N 115.217 -0.901 . . . . 71.4 110.159 176.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 90.6 m -68.86 124.74 24.51 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.384 0.513 . . . . 75.52 112.384 -177.284 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -130.29 150.71 51.41 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.109 0.48 . . . . 75.14 111.292 176.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -117.34 115.26 24.9 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.222 -0.445 . . . . 63.4 111.436 -179.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.626 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 70.9 mt-30 -94.48 107.33 19.31 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 120.914 0.388 . . . . 64.33 111.087 175.253 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.6 tp -74.81 111.66 10.23 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.634 -0.257 . . . . 72.4 110.594 175.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.452 ' HD2' HG21 ' A' ' 14' ' ' VAL . 74.4 mtt180 -116.43 142.61 46.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.781 0.324 . . . . 65.24 111.004 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -109.6 140.23 43.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.836 0.35 . . . . 73.31 111.662 -178.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.524 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 26.6 t70 -68.74 -21.58 64.36 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.136 0.494 . . . . 65.54 111.482 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.415 ' HA ' ' C ' ' A' ' 35' ' ' PRO . 78.9 m-70 -123.58 136.43 27.24 Favored Pre-proline 0 CA--C 1.543 0.7 0 CA-C-N 116.461 -0.336 . . . . 60.32 111.483 -176.107 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.415 ' C ' ' HA ' ' A' ' 34' ' ' HIS . 21.1 Cg_exo -67.36 -51.57 0.16 OUTLIER 'Cis proline' 0 C--N 1.359 1.1 0 C-N-CA 124.287 -1.13 . . . . 73.11 113.363 -0.383 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 31.5 mtmm -109.23 139.25 20.85 Favored Pre-proline 0 N--CA 1.472 0.629 0 O-C-N 122.298 -0.251 . . . . 71.4 110.897 176.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.524 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 77.2 Cg_exo -52.05 -29.78 37.74 Favored 'Trans proline' 0 CA--C 1.542 0.91 0 C-N-CA 123.182 2.588 . . . . 54.14 114.45 -177.222 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -78.34 6.78 7.59 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 112.222 0.453 . . . . 61.24 112.222 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 43.8 t -70.41 93.35 0.87 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.001 0.429 . . . . 60.44 111.511 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 59.8 tp -71.71 114.17 9.52 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 116.4 -0.364 . . . . 43.43 110.848 176.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.0 mm -79.02 -45.8 24.06 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-N 116.227 -0.442 . . . . 72.15 111.459 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 86.2 p -176.1 149.19 0.86 Allowed 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 112.473 0.546 . . . . 64.45 112.473 178.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.626 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 49.1 mt-10 -95.95 136.65 36.11 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 116.182 -0.463 . . . . 73.13 110.884 173.344 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 52.1 m80 -142.66 143.19 25.1 Favored Pre-proline 0 N--CA 1.471 0.623 0 C-N-CA 122.18 0.192 . . . . 73.15 111.393 177.222 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -71.75 -18.99 28.1 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.387 2.058 . . . . 71.0 112.921 -178.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 66.4 p -119.19 150.08 40.65 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.128 0.49 . . . . 73.21 111.524 179.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.442 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -67.77 -33.37 74.71 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.224 -0.444 . . . . 52.35 111.144 177.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -59.46 -48.34 82.04 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.28 -0.418 . . . . 72.41 111.629 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -63.34 -34.43 77.7 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.801 0.334 . . . . 71.33 111.862 177.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.51 -40.3 92.86 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 120.904 0.383 . . . . 74.23 110.786 174.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.442 ' HG3' ' O ' ' A' ' 47' ' ' ALA . 64.7 mtt -67.08 -34.41 77.59 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.285 -0.416 . . . . 75.13 111.42 176.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.493 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 12.7 t70 -57.27 -53.19 60.97 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.05 0.452 . . . . 73.35 110.823 176.137 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.07 -31.56 72.15 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 116.239 -0.437 . . . . 54.34 111.331 178.369 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.435 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 87.8 tttt -62.59 -49.01 76.95 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 116.241 -0.436 . . . . 71.42 110.95 175.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -59.43 -43.64 93.06 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 116.277 -0.419 . . . . 64.32 111.217 176.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.493 ' HG3' ' O ' ' A' ' 52' ' ' ASP . 78.5 mtp180 -59.03 -38.71 79.92 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.81 0.338 . . . . 72.3 111.174 176.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -64.93 -39.55 93.68 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-O 121.062 0.458 . . . . 71.02 110.979 175.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 54' ' ' LYS . 42.3 mt-10 -69.52 -36.25 76.25 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.168 -0.469 . . . . 73.33 111.569 179.372 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.4 ' HB3' ' HD2' ' A' ' 60' ' ' PRO . 9.4 m-20 -80.88 164.27 51.69 Favored Pre-proline 0 CA--C 1.543 0.69 0 C-N-CA 122.42 0.288 . . . . 73.34 111.129 174.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.4 ' HD2' ' HB3' ' A' ' 59' ' ' ASP . 73.1 Cg_endo -74.38 46.58 1.42 Allowed 'Trans proline' 0 CA--C 1.545 1.056 0 C-N-CA 122.167 1.911 . . . . 71.23 113.05 176.373 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -67.23 -50.91 58.93 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-O 120.827 0.346 . . . . 72.4 111.716 -178.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -141.96 136.84 30.76 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 120.92 0.391 . . . . 65.42 111.095 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -90.15 143.01 27.16 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 120.882 0.372 . . . . 74.34 111.644 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.45 ' N ' HD12 ' A' ' 64' ' ' LEU . 5.7 mp -103.23 -10.03 19.09 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 112.223 0.453 . . . . 71.41 112.223 -176.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -81.0 143.47 32.5 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 122.225 -0.297 . . . . 74.32 111.74 -177.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -137.47 88.95 2.38 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.191 0.441 . . . . 75.44 112.191 -179.369 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 30.5 m-70 -133.95 142.17 47.59 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 122.687 0.395 . . . . 63.51 110.249 173.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 16.2 p80 -94.19 115.0 27.21 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.327 0.491 . . . . 73.24 112.327 -172.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 57.31 22.4 7.73 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 112.382 0.512 . . . . 63.41 112.382 173.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 55.5 t-80 -97.79 142.0 30.09 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.611 0.597 . . . . 73.13 112.611 -174.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 44.8 p-80 . . . . . 0 C--O 1.247 0.941 0 CA-C-N 115.717 -0.674 . . . . 64.1 110.514 170.284 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.534 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.1 mpt? . . . . . 0 N--CA 1.489 1.524 0 N-CA-C 111.156 0.058 . . . . 64.2 111.156 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -62.15 113.73 2.02 Favored 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 122.715 2.277 . . . . 63.4 112.538 176.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 69.7 p -89.44 -39.35 13.43 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.027 0.38 . . . . 74.25 112.027 -178.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt 59.19 91.61 0.07 OUTLIER Pre-proline 0 CA--C 1.543 0.694 0 CA-C-O 121.074 0.464 . . . . 64.32 111.438 -177.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -57.96 142.62 96.68 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 123.041 2.494 . . . . 70.13 113.833 -175.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.55 138.78 30.18 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.508 2.139 . . . . 70.14 112.207 173.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -60.83 145.09 89.15 Favored Pre-proline 0 CA--C 1.544 0.731 0 N-CA-C 111.957 0.355 . . . . 74.41 111.957 -177.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.04 95.14 0.04 OUTLIER 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 123.313 2.676 . . . . 75.41 114.718 -172.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -88.84 89.6 8.05 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 116.275 -0.42 . . . . 72.21 109.988 173.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -127.09 127.1 44.13 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 112.016 0.376 . . . . 54.02 112.016 -173.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.435 ' O ' ' HE2' ' A' ' 54' ' ' LYS . . . -120.85 155.58 33.8 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.837 0.351 . . . . 33.52 111.335 175.368 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 26.2 p90 -139.04 142.24 38.24 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.168 0.508 . . . . 73.11 111.588 178.469 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 64.8 mt -94.02 131.13 41.79 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 116.12 -0.491 . . . . 74.14 111.51 -178.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 67.3 t -117.91 127.79 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-O 120.817 0.342 . . . . 71.21 111.18 178.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 75.3 p -86.79 112.81 22.07 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.136 0.493 . . . . 74.21 111.95 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.5 pt -114.85 176.83 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 116.084 -0.507 . . . . 62.1 110.57 174.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.551 ' HB2' ' HB ' ' A' ' 24' ' ' THR . 10.2 pt-20 -140.83 126.91 19.51 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.266 0.555 . . . . 72.31 111.879 177.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -104.94 170.25 7.98 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.115 -0.493 . . . . 74.22 110.745 179.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 98.88 -168.33 22.36 Favored Glycine 0 CA--C 1.527 0.84 0 C-N-CA 120.846 -0.692 . . . . 32.22 113.562 177.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.9 mttm -70.04 143.12 91.14 Favored Pre-proline 0 N--CA 1.472 0.65 0 N-CA-C 112.064 0.394 . . . . 62.32 112.064 -178.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -54.32 119.45 6.38 Favored 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.465 2.11 . . . . 62.2 111.815 176.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.2 -47.71 1.34 Allowed Glycine 0 CA--C 1.526 0.74 0 C-N-CA 121.322 -0.466 . . . . 35.25 112.373 -174.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -99.33 60.43 1.17 Allowed 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.047 0.451 . . . . 73.12 110.65 176.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.551 ' HB ' ' HB2' ' A' ' 17' ' ' GLU . 38.6 p -98.52 154.46 17.88 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 113.029 0.751 . . . . 51.32 113.029 -174.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 56.9 t -110.8 127.12 68.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-N 115.618 -0.719 . . . . 62.42 110.458 175.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 88.2 m -72.96 115.33 12.14 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 112.25 0.463 . . . . 75.5 112.25 -178.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 56.7 m95 -110.07 141.37 43.01 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.227 -0.442 . . . . 64.13 111.104 176.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -103.29 115.27 30.24 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.529 -0.305 . . . . 71.23 110.876 178.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.588 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 90.0 mt-30 -94.33 119.22 32.77 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 120.959 0.409 . . . . 53.43 111.572 176.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.2 tp -84.51 110.97 19.08 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 120.863 0.363 . . . . 75.3 110.122 174.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 47.0 mtp180 -118.92 166.64 12.58 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.473 -0.33 . . . . 73.21 110.673 -176.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -133.04 144.03 49.78 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 111.68 0.252 . . . . 54.42 111.68 178.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -79.41 -28.52 41.79 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 111.963 0.357 . . . . 73.43 111.963 178.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 85.7 m-70 -107.01 128.34 26.27 Favored Pre-proline 0 CA--C 1.542 0.67 0 CA-C-N 116.605 -0.27 . . . . 71.03 111.385 -175.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -85.84 -22.36 13.32 Favored 'Cis proline' 0 C--N 1.354 0.864 0 C-N-CA 123.969 -1.263 . . . . 70.11 113.249 -2.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -117.7 141.94 29.82 Favored Pre-proline 0 N--CA 1.469 0.51 0 CA-C-N 116.32 -0.4 . . . . 74.45 111.114 -179.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_exo -61.19 -24.44 79.07 Favored 'Trans proline' 0 N--CA 1.479 0.631 0 C-N-CA 122.594 2.196 . . . . 70.12 112.088 177.123 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -82.13 10.84 5.98 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.504 -0.771 . . . . 54.51 111.982 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 51.7 m -73.56 89.31 1.7 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.065 0.459 . . . . 61.44 111.007 177.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 60.8 tp -85.57 125.1 32.84 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.19 -0.459 . . . . 65.41 110.861 178.198 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.6 mm -92.25 -53.92 8.04 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-O 120.741 0.305 . . . . 72.1 111.561 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 84.0 p -168.71 152.37 5.51 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 112.194 0.442 . . . . 73.21 112.194 -178.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.588 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 49.2 mt-10 -105.15 135.65 46.11 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 116.215 -0.448 . . . . 74.12 110.587 174.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 37.9 m80 -138.41 136.79 19.46 Favored Pre-proline 0 CA--C 1.539 0.534 0 O-C-N 122.394 -0.191 . . . . 64.42 111.497 179.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -76.57 -4.31 14.85 Favored 'Trans proline' 0 CA--C 1.54 0.824 0 C-N-CA 122.622 2.214 . . . . 73.24 113.569 -177.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 71.1 p -129.73 144.08 51.12 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.095 0.474 . . . . 74.44 111.24 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.76 -38.73 86.24 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.239 -0.437 . . . . 60.41 111.531 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.605 HE21 ' N ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -55.2 -49.32 72.21 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.642 0.258 . . . . 73.11 111.11 178.335 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.605 ' N ' HE21 ' A' ' 48' ' ' GLN . 10.7 mm-40 -63.28 -35.92 81.96 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 120.936 0.398 . . . . 74.13 111.664 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.37 -52.91 50.46 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.048 0.452 . . . . 61.33 111.203 176.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 87.8 mtp -62.09 -37.7 86.07 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 116.012 -0.54 . . . . 74.25 111.347 177.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.478 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 20.2 t70 -61.09 -52.23 65.78 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.874 -0.603 . . . . 64.14 110.924 178.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.56 -39.94 92.93 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.241 -0.436 . . . . 60.11 111.398 176.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.435 ' HE2' ' O ' ' A' ' 11' ' ' ALA . 61.0 tttm -56.27 -54.92 39.6 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 120.93 0.395 . . . . 74.15 111.448 179.35 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.478 ' HG2' ' O ' ' A' ' 52' ' ' ASP . 22.4 pttm -58.28 -40.81 82.88 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.563 -0.29 . . . . 73.41 110.328 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 69.5 mtp180 -67.21 -25.69 66.24 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 111.985 0.365 . . . . 64.43 111.985 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 75.4 t80 -77.02 -29.67 55.45 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 120.909 0.385 . . . . 64.3 111.509 174.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -102.54 -15.71 16.34 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.445 0.905 . . . . 74.01 113.445 -177.14 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 -69.07 159.28 83.71 Favored Pre-proline 0 N--CA 1.475 0.792 0 O-C-N 121.993 -0.442 . . . . 64.32 112.039 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_exo -57.52 -34.47 98.09 Favored 'Trans proline' 0 C--N 1.354 0.818 0 C-N-CA 122.583 2.189 . . . . 74.13 112.742 175.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -75.62 98.83 4.13 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.133 0.492 . . . . 62.41 110.923 177.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -120.19 147.75 44.53 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.486 0.55 . . . . 73.43 112.486 -176.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 53.53 33.46 16.25 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 112.79 0.663 . . . . 75.2 112.79 171.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.434 HD23 ' H ' ' A' ' 64' ' ' LEU . 2.2 pt? -72.82 -0.28 12.97 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 112.394 0.516 . . . . 54.31 112.394 -179.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -69.81 88.67 0.55 Allowed 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.375 0.607 . . . . 74.31 112.119 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 15.9 p-80 -100.1 90.76 4.49 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.13 0.49 . . . . 73.01 110.51 173.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -88.78 143.52 26.85 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.071 -0.513 . . . . 62.41 110.062 -178.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 24.7 t60 -62.93 -12.73 27.35 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 112.412 0.523 . . . . 74.11 112.412 -175.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 51.4 m-70 -123.67 15.9 9.49 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-O 120.696 0.284 . . . . 65.33 111.616 175.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 32.5 t-80 -169.55 118.42 0.63 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 120.918 0.389 . . . . 70.3 111.849 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 . . . . . 0 C--O 1.25 1.125 0 CA-C-O 118.558 -0.734 . . . . 74.25 111.354 179.134 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 81.9 mtp . . . . . 0 N--CA 1.487 1.403 0 N-CA-C 111.608 0.225 . . . . 73.54 111.608 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -59.9 99.89 0.13 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 121.98 1.786 . . . . 72.1 111.098 170.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 59.0 p -67.03 83.51 0.12 Allowed 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.803 0.668 . . . . 70.14 112.803 -173.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -157.16 141.98 12.14 Favored Pre-proline 0 C--O 1.239 0.515 0 CA-C-N 115.468 -0.787 . . . . 71.53 110.357 174.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -54.37 142.61 68.79 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 122.627 2.218 . . . . 72.21 112.873 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -63.47 178.61 1.18 Allowed 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 122.527 2.152 . . . . 74.34 112.322 178.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.7 t80 61.97 62.93 2.22 Favored Pre-proline 0 CA--C 1.548 0.884 0 CA-C-O 121.529 0.681 . . . . 75.24 110.046 -175.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -91.56 5.25 3.84 Favored 'Trans proline' 0 CA--C 1.538 0.724 0 C-N-CA 122.987 2.458 . . . . 71.24 113.893 -175.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.443 ' NH2' ' HA ' ' A' ' 58' ' ' GLU . 22.0 ptt180 -165.8 146.26 6.69 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.014 0.435 . . . . 65.53 111.907 179.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.46 152.48 32.01 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 116.136 -0.483 . . . . 63.11 110.197 172.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.481 ' HB3' ' HG3' ' A' ' 54' ' ' LYS . . . -113.06 166.28 11.57 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.674 0.273 . . . . 74.5 111.009 176.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 22.6 p90 -155.78 143.56 19.67 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.248 0.547 . . . . 63.45 111.907 177.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 57.1 mt -96.85 111.32 26.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 CA-C-N 115.949 -0.568 . . . . 64.32 112.277 -175.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 72.4 t -106.26 126.89 61.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 122.518 0.327 . . . . 72.44 111.188 178.025 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 61.7 p -87.23 124.12 32.98 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 122.201 -0.312 . . . . 74.02 111.544 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.521 HD13 ' NE2' ' A' ' 29' ' ' GLN . 43.3 pt -114.63 154.37 16.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 CA-C-O 121.005 0.431 . . . . 75.43 111.705 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -100.74 109.68 21.72 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.19 -0.459 . . . . 71.42 111.733 -179.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.509 ' HE2' HD11 ' A' ' 16' ' ' ILE . 67.6 mttm -104.47 177.7 4.77 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 120.756 0.312 . . . . 75.4 110.285 175.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 88.32 -136.58 13.83 Favored Glycine 0 CA--C 1.527 0.793 0 C-N-CA 120.682 -0.77 . . . . 73.4 113.721 176.013 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -102.4 160.59 25.89 Favored Pre-proline 0 CA--C 1.54 0.578 0 CA-C-O 120.739 0.305 . . . . 62.42 111.669 -177.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -60.42 132.44 43.58 Favored 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 122.034 1.823 . . . . 74.33 111.685 169.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 80.37 -61.49 4.42 Favored Glycine 0 CA--C 1.528 0.864 0 C-N-CA 120.794 -0.717 . . . . 44.41 112.426 -175.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -87.39 75.8 9.17 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 121.449 0.642 . . . . 72.44 110.426 174.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 65.4 p -94.46 165.04 12.75 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.608 0.718 . . . . 64.12 112.632 -177.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 40.4 t -122.2 110.44 27.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-N 115.33 -0.85 . . . . 73.14 109.58 172.319 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 59.0 m -78.03 115.57 17.86 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.986 0.422 . . . . 72.11 111.963 -177.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 40.4 m95 -108.44 140.03 42.33 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.084 0.469 . . . . 73.52 111.561 178.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -92.35 114.31 26.82 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.228 -0.442 . . . . 70.51 110.931 178.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.692 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 76.6 mt-30 -97.84 116.99 31.16 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.341 -0.39 . . . . 74.43 111.553 178.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 49.8 tp -85.61 103.75 14.72 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 120.768 0.318 . . . . 73.2 110.183 173.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -103.71 148.24 26.29 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 110.319 -0.252 . . . . 70.33 110.319 178.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -124.02 149.11 46.44 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 112.139 0.422 . . . . 62.31 112.139 -178.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.635 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 34.4 t70 -66.38 -25.07 66.61 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 113.344 0.868 . . . . 72.32 113.344 -173.357 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 43.8 m-70 -122.06 142.5 36.68 Favored Pre-proline 0 N--CA 1.475 0.809 0 O-C-N 121.739 -0.601 . . . . 72.33 111.729 -178.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -74.42 -28.92 7.04 Favored 'Cis proline' 0 C--N 1.359 1.087 0 C-N-CA 124.182 -1.174 . . . . 62.12 113.385 0.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm -121.21 143.79 38.14 Favored Pre-proline 0 N--CA 1.467 0.408 0 N-CA-C 110.152 -0.314 . . . . 75.0 110.152 174.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.635 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 11.0 Cg_endo -52.36 -31.88 49.3 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.025 2.483 . . . . 72.35 114.62 -171.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -99.79 20.83 13.45 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 112.618 0.599 . . . . 72.22 112.618 -177.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 26.7 m -62.18 101.15 0.2 Allowed 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 121.266 0.555 . . . . 31.22 110.975 174.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.414 HD13 ' HB3' ' A' ' 29' ' ' GLN . 50.9 tp -72.41 106.51 4.56 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.764 -0.653 . . . . 65.41 112.259 -177.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 47.3 mm -65.31 -54.29 30.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-N 116.274 -0.421 . . . . 72.52 111.099 176.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 42.1 t -169.22 149.77 4.22 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 112.043 0.386 . . . . 74.35 112.043 -178.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.692 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 46.1 mt-10 -103.03 125.12 49.64 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 116.251 -0.431 . . . . 73.34 110.802 176.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 84.7 m-70 -128.2 148.62 68.46 Favored Pre-proline 0 N--CA 1.477 0.905 0 N-CA-C 111.797 0.295 . . . . 75.02 111.797 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -73.61 -21.25 19.47 Favored 'Trans proline' 0 CA--C 1.544 1.018 0 C-N-CA 122.547 2.165 . . . . 72.55 113.451 178.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 33.4 p -118.73 152.36 36.29 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 120.927 0.394 . . . . 45.35 111.654 179.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.41 -35.21 77.32 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.313 -0.403 . . . . 60.22 111.394 176.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -53.6 -49.12 68.46 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 120.767 0.318 . . . . 64.52 111.834 -179.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -58.76 -44.07 90.48 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 120.991 0.424 . . . . 74.14 111.743 178.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.38 -40.72 85.71 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 116.273 -0.421 . . . . 64.45 111.77 179.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 65.7 mtt -64.47 -43.22 94.86 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.856 0.36 . . . . 73.1 110.964 177.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -55.09 -51.1 67.46 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.076 0.465 . . . . 73.11 110.602 175.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.62 -35.58 78.3 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.011 -0.54 . . . . 71.3 111.487 179.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.481 ' HG3' ' HB3' ' A' ' 11' ' ' ALA . 63.2 tttm -63.6 -56.02 19.14 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 116.487 -0.324 . . . . 64.11 111.315 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 11.9 mptt -59.14 -43.72 92.02 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.102 0.477 . . . . 72.13 111.103 176.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 51.2 ttm-85 -65.85 -30.67 71.32 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.087 -0.506 . . . . 64.51 111.478 -178.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -67.88 -41.87 82.14 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 116.224 -0.443 . . . . 71.32 110.96 175.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.443 ' HA ' ' NH2' ' A' ' 9' ' ' ARG . 66.0 mm-40 -77.78 -8.58 58.2 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 112.696 0.628 . . . . 73.44 112.696 179.514 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -56.91 115.26 9.82 Favored Pre-proline 0 CA--C 1.546 0.799 0 CA-C-O 121.014 0.435 . . . . 75.21 111.189 179.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -83.2 88.32 1.21 Allowed 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.737 2.292 . . . . 63.33 113.964 -174.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -82.14 95.31 7.46 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.99 -0.55 . . . . 70.42 109.902 172.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.0 tptt -151.44 116.41 5.23 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.52 0.563 . . . . 70.35 112.52 -173.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -74.21 120.87 20.38 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.269 -0.423 . . . . 62.42 109.902 172.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.3 pp -144.68 174.23 11.15 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 112.92 0.711 . . . . 72.42 112.92 -178.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 37.9 mm-40 -99.8 105.0 16.73 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.729 -0.669 . . . . 74.45 111.645 177.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.2 p-80 -86.28 152.77 22.49 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 109.97 -0.381 . . . . 64.35 109.97 171.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 46.1 t60 -54.66 110.94 0.71 Allowed 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 120.742 0.306 . . . . 74.33 111.485 -178.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -140.55 142.28 35.19 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 120.938 0.399 . . . . 73.35 111.942 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 31.4 t-80 -66.52 107.42 2.07 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.099 -0.5 . . . . 75.33 111.748 179.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -92.86 146.33 23.72 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 116.379 -0.373 . . . . 73.01 110.837 176.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 54.9 t-80 . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.663 -0.684 . . . . 72.44 111.723 178.666 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.426 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 62.0 mtt . . . . . 0 N--CA 1.492 1.654 0 N-CA-C 111.847 0.314 . . . . 74.25 111.847 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 1' ' ' MET . 7.2 Cg_exo -75.14 35.64 0.43 Allowed 'Trans proline' 0 CA--C 1.544 0.991 0 C-N-CA 123.218 2.612 . . . . 73.52 113.09 176.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 91.2 m -54.76 116.51 2.76 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.069 0.461 . . . . 74.31 112.14 -175.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -98.65 128.01 34.01 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-N 116.271 -0.422 . . . . 61.54 111.63 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -64.8 119.93 7.08 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 C-N-CA 122.569 2.18 . . . . 64.23 112.144 174.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.6 161.05 46.83 Favored 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 122.85 2.367 . . . . 75.25 113.422 -176.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -103.97 107.53 57.19 Favored Pre-proline 0 CA--C 1.542 0.669 0 CA-C-N 116.018 -0.537 . . . . 72.32 111.325 -176.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -60.94 104.39 0.27 Allowed 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 122.219 1.946 . . . . 63.13 111.712 176.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 34.6 ttt180 -85.63 91.76 8.36 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.206 0.527 . . . . 74.14 110.848 -175.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -114.0 131.79 56.22 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.006 -0.543 . . . . 75.04 111.678 -175.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -129.49 158.04 40.33 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.114 -0.494 . . . . 54.22 111.119 177.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 39.5 p90 -151.37 155.24 38.26 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.099 0.476 . . . . 62.14 112.004 -177.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 60.1 mt -98.12 128.39 49.6 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 N-CA-C 112.401 0.519 . . . . 73.44 112.401 -176.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 48.7 t -115.67 141.7 31.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 C-N-CA 122.604 0.362 . . . . 73.53 110.944 176.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 60.8 p -102.1 128.47 48.55 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 121.166 0.508 . . . . 74.44 112.005 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.545 HD13 ' NE2' ' A' ' 29' ' ' GLN . 41.9 pt -132.72 176.35 9.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-O 121.005 0.431 . . . . 73.04 111.094 176.674 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.54 ' HB2' ' HB ' ' A' ' 24' ' ' THR . 9.1 pt-20 -137.23 137.96 39.63 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.097 0.475 . . . . 73.44 111.674 177.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.401 ' HE3' HD11 ' A' ' 16' ' ' ILE . 95.4 mttt -127.53 164.91 20.92 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.113 -0.494 . . . . 73.25 111.016 179.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.74 -140.16 14.76 Favored Glycine 0 CA--C 1.533 1.18 0 N-CA-C 114.698 0.639 . . . . 71.13 114.698 175.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -86.1 157.11 57.18 Favored Pre-proline 0 N--CA 1.473 0.687 0 N-CA-C 112.279 0.474 . . . . 70.52 112.279 -173.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.35 141.4 68.1 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 122.092 1.861 . . . . 73.44 111.82 174.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.2 -61.75 3.79 Favored Glycine 0 CA--C 1.53 1.031 0 C-N-CA 120.949 -0.643 . . . . 74.25 112.477 -176.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -92.23 71.78 5.34 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 121.277 0.56 . . . . 74.13 111.099 176.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.54 ' HB ' ' HB2' ' A' ' 17' ' ' GLU . 63.1 p -93.88 159.2 15.29 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.737 -0.665 . . . . 61.24 111.236 178.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 61.0 t -108.98 127.78 65.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-N 116.521 -0.309 . . . . 64.3 111.028 178.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 37.8 m -76.78 116.11 17.15 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.773 0.32 . . . . 72.44 111.849 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -112.31 131.08 55.71 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.051 0.453 . . . . 75.2 111.281 176.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -96.9 114.13 25.72 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.034 0.445 . . . . 74.04 110.637 177.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.545 ' NE2' HD13 ' A' ' 16' ' ' ILE . 92.5 mt-30 -94.37 119.28 32.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.053 -0.521 . . . . 54.41 111.546 179.429 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.8 tp -83.45 107.36 15.89 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 110.197 -0.297 . . . . 74.5 110.197 172.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 31' ' ' ARG . 50.9 mtt180 -111.86 161.31 16.5 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 120.918 0.389 . . . . 71.12 111.231 179.435 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -123.25 166.88 14.51 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 120.988 0.423 . . . . 53.42 111.343 178.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -86.79 -37.71 17.55 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 116.381 -0.372 . . . . 62.15 111.841 -178.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 43.6 m80 -115.22 147.79 39.29 Favored Pre-proline 0 N--CA 1.475 0.777 0 C-N-CA 122.439 0.296 . . . . 74.2 111.555 178.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -82.7 -2.19 52.3 Favored 'Cis proline' 0 C--N 1.355 0.918 0 C-N-CA 124.147 -1.189 . . . . 74.54 112.851 -2.244 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -140.66 135.54 15.77 Favored Pre-proline 0 N--CA 1.466 0.372 0 CA-C-N 115.742 -0.663 . . . . 64.41 110.246 177.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -61.73 -20.95 70.98 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 121.939 1.759 . . . . 74.53 111.687 175.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -80.38 -3.03 48.08 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 115.632 -0.713 . . . . 73.12 111.629 177.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 42.5 t -60.79 96.61 0.05 OUTLIER 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 121.05 0.452 . . . . 75.13 112.176 -175.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 64.9 tp -81.39 106.47 13.38 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.067 0.46 . . . . 65.21 111.062 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.2 mm -71.6 -51.73 30.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 116.386 -0.37 . . . . 54.1 111.135 179.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 43.2 t -171.53 149.55 2.67 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 116.382 -0.372 . . . . 72.32 111.747 178.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.483 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 52.0 mt-10 -102.1 141.26 35.22 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 116.452 -0.34 . . . . 71.35 110.885 177.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 64.2 m80 -144.07 141.22 18.0 Favored Pre-proline 0 CA--C 1.539 0.53 0 O-C-N 122.304 -0.247 . . . . 73.3 111.269 178.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.49 -12.64 24.95 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 122.431 2.087 . . . . 71.51 113.156 -178.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 80.3 p -122.58 141.88 51.23 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-O 121.051 0.453 . . . . 73.43 111.212 177.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.28 -31.84 72.44 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.356 -0.384 . . . . 63.51 111.696 -179.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.412 HE21 ' C ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -54.51 -46.98 73.62 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 120.704 0.288 . . . . 45.11 110.755 177.614 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -60.92 -39.48 89.58 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.996 0.427 . . . . 74.32 111.575 175.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.68 -37.89 89.13 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 116.331 -0.395 . . . . 72.14 111.023 176.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 67.3 mtt -68.44 -51.97 37.81 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.594 -0.276 . . . . 74.31 111.515 177.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -57.36 -41.35 79.97 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 120.773 0.32 . . . . 70.15 111.854 178.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.07 -40.19 87.0 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 120.85 0.357 . . . . 61.5 111.132 175.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 52.5 tttp -62.77 -58.64 6.73 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 122.669 0.387 . . . . 71.2 112.024 178.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -56.45 -36.39 68.97 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 121.207 0.527 . . . . 71.21 111.655 -179.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 32.5 ttp180 -80.44 -26.5 38.35 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 116.007 -0.542 . . . . 74.33 111.798 -178.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -81.6 -42.72 19.65 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.752 0.31 . . . . 73.34 111.537 178.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -64.42 -9.71 20.1 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 121.491 0.662 . . . . 72.42 111.155 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -100.91 139.05 20.21 Favored Pre-proline 0 CA--C 1.548 0.897 0 CA-C-N 115.406 -0.815 . . . . 61.33 109.657 171.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -58.67 -6.88 3.64 Favored 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 122.816 2.344 . . . . 73.31 114.575 -176.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -59.41 -50.6 73.32 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 112.289 0.478 . . . . 75.24 112.289 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.15 117.06 24.74 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 112.043 0.386 . . . . 72.13 112.043 -178.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -120.8 -178.98 3.86 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.876 0.369 . . . . 63.14 110.923 175.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.505 ' N ' HD23 ' A' ' 64' ' ' LEU . 1.6 pt? -158.85 89.69 0.96 Allowed 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 121.347 0.594 . . . . 63.21 110.719 176.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -88.19 174.9 7.95 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.16 0.505 . . . . 73.24 111.215 -179.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 19.6 p80 -149.44 110.6 4.39 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.156 -0.474 . . . . 71.33 111.435 178.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 -72.27 -24.96 61.43 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.229 0.538 . . . . 51.24 110.462 175.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 19.8 p80 -152.1 135.74 16.19 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.629 -0.714 . . . . 75.22 109.807 171.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 1.5 p80 -66.84 143.01 57.13 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 112.744 0.646 . . . . 73.43 112.744 -176.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 25.8 m170 -79.14 -38.64 35.55 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 120.889 0.376 . . . . 75.54 110.614 174.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 . . . . . 0 C--O 1.252 1.234 0 CA-C-O 118.135 -0.936 . . . . 75.34 111.708 -178.605 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.434 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 62.8 mtm . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.558 0.218 . . . . 43.55 110.676 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 1' ' ' MET . 31.2 Cg_exo -60.04 105.37 0.28 Allowed 'Trans proline' 0 CA--C 1.543 0.956 0 C-N-CA 122.436 2.09 . . . . 52.21 113.979 -177.07 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.466 ' O ' ' HD3' ' A' ' 5' ' ' PRO . 22.3 m -82.07 130.37 35.06 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 116.478 -0.328 . . . . 63.44 110.131 170.621 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.532 ' HD2' ' N ' ' A' ' 4' ' ' LYS . 10.3 mptt -92.54 110.09 42.78 Favored Pre-proline 0 CA--C 1.541 0.623 0 N-CA-C 111.859 0.318 . . . . 74.11 111.859 -175.204 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.466 ' HD3' ' O ' ' A' ' 3' ' ' THR . 87.6 Cg_endo -91.62 146.8 3.32 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 122.684 2.256 . . . . 73.22 112.141 173.375 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.53 93.93 0.04 OUTLIER 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 122.278 1.985 . . . . 73.23 112.56 177.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -147.05 75.2 11.79 Favored Pre-proline 0 CA--C 1.54 0.567 0 CA-C-O 121.384 0.612 . . . . 73.54 110.708 179.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -73.09 107.43 2.37 Favored 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 122.912 2.408 . . . . 65.54 112.607 -179.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 44.7 mtm-85 -79.48 83.74 5.45 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.076 0.465 . . . . 73.21 110.196 177.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -88.32 123.68 33.15 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.093 -0.503 . . . . 74.11 111.264 -176.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.537 ' O ' ' HE2' ' A' ' 54' ' ' LYS . . . -106.73 146.31 30.97 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 120.614 0.245 . . . . 73.44 111.427 179.345 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 40.2 p90 -144.98 153.24 41.29 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.162 0.506 . . . . 73.41 112.132 179.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.2 mt -96.18 135.21 31.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-N 116.095 -0.502 . . . . 71.03 111.951 -178.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 95.4 t -123.9 134.56 66.15 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-N 116.143 -0.48 . . . . 75.5 110.897 177.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 65.3 p -96.45 124.96 40.62 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 120.899 0.38 . . . . 71.2 111.807 -178.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.419 HD13 ' NE2' ' A' ' 29' ' ' GLN . 35.2 pt -126.14 170.79 15.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-N 116.317 -0.401 . . . . 75.4 111.462 179.22 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -128.49 135.11 49.0 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 116.351 -0.386 . . . . 74.41 110.858 178.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -122.43 158.11 30.45 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 120.896 0.379 . . . . 75.03 111.844 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.62 -138.79 14.08 Favored Glycine 0 CA--C 1.529 0.931 0 CA-C-N 116.268 -0.424 . . . . 63.51 113.966 177.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 54.2 mttp -94.64 155.46 39.43 Favored Pre-proline 0 CA--C 1.541 0.609 0 N-CA-C 111.926 0.343 . . . . 74.14 111.926 -174.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -52.96 130.3 37.22 Favored 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 122.879 2.386 . . . . 72.54 113.185 -178.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 77.46 -64.47 3.22 Favored Glycine 0 CA--C 1.523 0.55 0 C-N-CA 121.123 -0.561 . . . . 72.3 112.822 -178.208 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -80.93 71.53 7.89 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.272 0.558 . . . . 63.31 110.942 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 45.6 p -106.6 172.24 6.92 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.429 0.633 . . . . 75.31 112.201 -176.389 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 91.1 t -111.25 128.66 67.58 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-N 115.745 -0.662 . . . . 75.13 109.981 169.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 87.2 m -83.94 115.37 22.27 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.122 0.487 . . . . 71.23 111.762 -176.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 65.1 m95 -109.07 149.76 28.81 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 116.132 -0.485 . . . . 73.11 111.612 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -112.94 116.06 29.39 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.237 -0.438 . . . . 72.11 111.078 -179.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.699 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 85.4 mt-30 -101.02 133.33 45.67 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.297 -0.411 . . . . 62.24 111.882 -179.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.472 HD11 ' HB1' ' A' ' 11' ' ' ALA . 56.7 tp -91.66 111.35 22.82 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 110.145 -0.317 . . . . 73.15 110.145 172.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 37.5 mtp180 -115.12 148.67 38.68 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 110.17 -0.307 . . . . 73.54 110.17 -178.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -115.06 160.81 19.19 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.923 0.712 . . . . 73.52 112.923 -175.057 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -71.16 -36.0 71.86 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 115.461 -0.79 . . . . 73.25 112.498 -177.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.488 ' HA ' ' C ' ' A' ' 35' ' ' PRO . 45.6 m-70 -137.45 157.14 74.49 Favored Pre-proline 0 CA--C 1.544 0.724 0 C-N-CA 122.289 0.235 . . . . 74.34 111.473 -179.365 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.488 ' C ' ' HA ' ' A' ' 34' ' ' HIS . 24.5 Cg_endo -60.47 -47.98 0.18 OUTLIER 'Cis proline' 0 C--N 1.363 1.334 0 C-N-CA 124.906 -0.872 . . . . 55.22 113.85 2.387 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -112.85 150.12 42.31 Favored Pre-proline 0 CA--C 1.538 0.489 0 CA-C-O 120.466 0.174 . . . . 74.21 110.702 175.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -65.82 -22.85 56.04 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 122.091 1.86 . . . . 70.43 112.602 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -75.88 -9.32 58.51 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 116.434 -0.348 . . . . 64.43 111.159 178.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 98.5 p -53.91 116.68 2.67 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 121.407 0.622 . . . . 63.2 112.267 -176.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 57.8 tp -95.09 117.43 30.17 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.156 -0.474 . . . . 64.03 111.006 177.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 50.3 mm -78.73 -54.23 12.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-O 120.909 0.385 . . . . 74.53 110.944 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 36.9 t -168.94 162.14 11.03 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.024 0.44 . . . . 74.04 111.729 179.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.699 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 40.6 mt-10 -116.85 138.12 51.73 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 116.003 -0.544 . . . . 72.34 110.887 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 50.4 m80 -143.25 147.27 39.81 Favored Pre-proline 0 N--CA 1.472 0.647 0 CA-C-O 120.597 0.236 . . . . 71.31 111.102 178.074 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -77.38 -4.37 14.64 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.571 2.181 . . . . 61.31 113.268 -178.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 31.1 p -128.0 144.4 51.1 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 120.831 0.348 . . . . 74.04 111.185 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.409 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -66.37 -33.71 76.34 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 120.829 0.347 . . . . 52.13 111.104 177.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -55.67 -52.13 64.9 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 116.264 -0.425 . . . . 75.03 111.116 179.331 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -58.32 -41.0 83.57 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.063 0.459 . . . . 74.01 111.533 177.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.75 -38.65 88.76 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.938 0.399 . . . . 63.02 111.27 178.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.468 ' O ' ' HG3' ' A' ' 55' ' ' LYS . 66.2 mtt -68.48 -43.51 76.76 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 116.277 -0.42 . . . . 74.2 110.884 176.344 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -54.68 -44.11 73.07 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.274 0.559 . . . . 74.21 111.236 177.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.07 -39.16 75.79 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 116.155 -0.475 . . . . 71.14 111.56 176.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.537 ' HE2' ' O ' ' A' ' 11' ' ' ALA . 62.2 tttm -56.09 -50.09 72.0 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 121.081 0.467 . . . . 75.14 110.928 177.723 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 51' ' ' MET . 62.7 mttm -61.15 -47.65 85.26 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.983 -0.553 . . . . 72.21 111.241 179.479 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 41.9 ttp180 -65.69 -25.18 67.21 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 115.969 -0.559 . . . . 73.01 111.713 -177.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.741 ' HA ' ' HG2' ' A' ' 63' ' ' GLU . 77.6 t80 -79.0 -51.58 9.4 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 121.131 0.491 . . . . 71.02 111.339 176.728 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -67.4 -32.43 73.33 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 116.351 -0.386 . . . . 73.22 111.75 -177.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -95.84 108.91 43.45 Favored Pre-proline 0 CA--C 1.536 0.432 0 N-CA-C 110.134 -0.321 . . . . 61.33 110.134 171.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -46.08 98.55 0.03 OUTLIER 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 122.741 2.294 . . . . 63.23 113.234 -177.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -145.37 -53.13 0.28 Allowed 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.32 -0.4 . . . . 64.21 111.753 -177.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -164.15 96.76 0.8 Allowed 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 120.825 0.345 . . . . 64.54 110.767 -178.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.741 ' HG2' ' HA ' ' A' ' 57' ' ' TYR . 29.2 mt-10 -117.52 -179.43 3.73 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.274 0.472 . . . . 71.33 112.274 -173.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.42 ' N ' HD12 ' A' ' 64' ' ' LEU . 5.1 mp -124.45 110.1 14.1 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 116.506 -0.316 . . . . 74.45 111.087 179.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -115.7 -175.66 2.77 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.151 0.5 . . . . 74.53 111.39 177.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 34.5 p-80 -172.38 91.72 0.11 Allowed 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.645 -0.707 . . . . 62.25 110.605 171.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 8.3 p-80 -76.82 70.6 3.29 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 121.572 0.701 . . . . 53.31 111.691 -178.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -144.4 113.66 6.97 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.263 -0.88 . . . . 74.34 110.114 176.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 51.8 m170 -74.37 150.31 40.12 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 121.061 0.458 . . . . 60.41 111.643 -178.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -135.95 147.09 47.93 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.071 -0.513 . . . . 74.23 110.871 177.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 78.5 t60 . . . . . 0 C--O 1.251 1.133 0 CA-C-O 118.774 -0.631 . . . . 75.23 111.458 -177.933 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.589 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.8 OUTLIER . . . . . 0 N--CA 1.488 1.43 0 N-CA-C 111.665 0.246 . . . . 63.42 111.665 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -59.63 115.99 2.98 Favored 'Trans proline' 0 CA--C 1.54 0.809 0 C-N-CA 122.3 2.0 . . . . 62.24 111.74 174.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 85.0 m -113.08 117.13 31.12 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.187 0.44 . . . . 72.1 112.187 -175.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -91.73 148.24 36.78 Favored Pre-proline 0 CA--C 1.54 0.563 0 CA-C-N 116.38 -0.373 . . . . 72.52 111.252 176.199 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -65.18 152.29 82.69 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 121.922 1.748 . . . . 51.5 110.843 166.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -71.84 -5.73 17.69 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 121.987 1.791 . . . . 54.3 113.649 -176.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 51.81 87.21 0.14 Allowed Pre-proline 0 CA--C 1.542 0.64 0 CA-C-O 120.922 0.391 . . . . 74.34 111.545 -175.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -51.36 112.72 0.87 Allowed 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 122.934 2.423 . . . . 75.51 112.95 -179.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.44 144.79 29.36 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 116.152 -0.476 . . . . 65.22 111.337 -176.795 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -124.53 157.17 35.99 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 121.123 0.487 . . . . 71.21 111.91 -179.533 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -138.7 -174.85 3.94 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 116.174 -0.466 . . . . 63.41 111.7 -179.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -159.56 169.66 23.34 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.92 0.39 . . . . 75.4 111.325 179.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.9 mt -112.12 139.15 38.11 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 CA-C-O 120.995 0.426 . . . . 74.11 111.7 179.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.515 HG21 ' HD2' ' A' ' 31' ' ' ARG . 89.3 t -115.62 136.31 52.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 CA-C-N 116.444 -0.344 . . . . 71.52 110.79 175.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 50.7 p -104.09 113.2 26.57 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 112.184 0.439 . . . . 71.24 112.184 -178.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 38.8 pt -114.06 168.09 6.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 CA-C-N 116.432 -0.349 . . . . 61.43 110.994 176.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -126.12 134.68 51.27 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 121.218 0.532 . . . . 74.15 111.611 -177.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -129.15 160.24 33.49 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 116.231 -0.441 . . . . 72.42 111.294 178.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.52 -137.22 13.13 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 121.132 -0.556 . . . . 61.13 113.91 177.393 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -87.66 144.28 35.05 Favored Pre-proline 0 N--CA 1.469 0.507 0 O-C-N 122.682 -0.305 . . . . 63.3 111.64 -176.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -50.81 -43.78 44.81 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 122.987 2.458 . . . . 75.22 113.685 -177.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.08 -61.23 3.31 Favored Glycine 0 CA--C 1.526 0.725 0 C-N-CA 121.117 -0.564 . . . . 44.51 112.747 179.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -100.06 84.09 2.8 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.111 0.481 . . . . 64.51 111.161 178.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 48.2 p -85.69 159.13 19.88 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.405 0.622 . . . . 64.33 111.936 178.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 57.4 t -109.3 124.11 65.72 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 CA-C-N 115.899 -0.591 . . . . 74.44 109.983 173.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 85.8 m -80.91 115.27 20.31 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.11 0.481 . . . . 74.42 111.643 -178.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 60.7 m95 -105.75 131.25 53.33 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.027 -0.533 . . . . 74.34 110.999 176.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 51.9 m-85 -97.09 114.18 25.82 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.138 -0.483 . . . . 62.14 111.087 -178.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.534 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 87.7 mt-30 -91.83 108.81 20.18 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.223 -0.444 . . . . 70.51 111.186 176.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.0 tp -71.1 109.54 5.23 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.026 0.441 . . . . 61.01 110.434 172.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.515 ' HD2' HG21 ' A' ' 14' ' ' VAL . 58.5 mtt180 -125.17 158.11 34.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.145 0.498 . . . . 74.2 111.406 -178.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -118.14 157.44 26.92 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.236 -0.438 . . . . 72.52 110.325 172.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.439 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 29.4 t70 -86.82 -20.12 28.01 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.441 0.638 . . . . 75.34 110.486 174.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 48.5 m80 -126.65 138.78 33.19 Favored Pre-proline 0 CA--C 1.542 0.644 0 CA-C-N 115.9 -0.591 . . . . 61.4 110.858 -179.084 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -82.69 -1.34 52.59 Favored 'Cis proline' 0 CA--C 1.542 0.882 0 C-N-CA 124.292 -1.128 . . . . 74.2 113.417 0.011 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -136.99 142.77 39.68 Favored Pre-proline 0 N--CA 1.469 0.515 0 CA-C-N 116.311 -0.404 . . . . 71.11 110.409 177.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.439 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 55.6 Cg_endo -71.15 -37.13 6.33 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 122.264 1.976 . . . . 71.31 112.817 -177.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -89.0 24.44 2.09 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.984 -0.448 . . . . 74.32 111.725 176.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 75.9 p -65.26 97.38 0.27 Allowed 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.223 0.535 . . . . 75.1 110.904 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 37.7 tp -78.85 102.83 8.41 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 120.99 0.424 . . . . 63.01 111.143 -178.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 39.3 mm -84.33 -47.86 17.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-O 120.983 0.42 . . . . 73.34 111.205 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 43.7 t -164.3 157.08 17.28 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 116.426 -0.352 . . . . 74.13 111.945 -178.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.534 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 45.2 mt-10 -130.36 125.03 33.61 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 122.453 0.301 . . . . 75.34 110.816 176.256 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 33.4 m80 -139.6 146.17 46.71 Favored Pre-proline 0 N--CA 1.473 0.71 0 CA-C-O 120.693 0.283 . . . . 72.2 111.615 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -76.28 -12.14 19.12 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.573 2.182 . . . . 65.31 113.411 -176.053 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 32.2 p -118.54 142.89 47.16 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 120.897 0.38 . . . . 63.22 111.219 178.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.73 -33.21 75.34 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 120.612 0.244 . . . . 50.14 111.401 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 26.0 tp60 -53.85 -48.17 70.24 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.471 -0.331 . . . . 71.54 111.505 177.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -62.73 -42.67 99.77 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.889 0.376 . . . . 74.15 111.545 177.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.58 -43.94 92.27 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.333 -0.394 . . . . 65.41 111.575 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 90.8 mtp -67.08 -39.21 86.77 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.362 -0.381 . . . . 74.41 111.399 179.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.421 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 37.9 t70 -63.56 -40.35 96.77 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 120.961 0.41 . . . . 70.32 111.157 177.405 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -75.49 -32.8 60.68 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 116.132 -0.486 . . . . 52.22 111.433 177.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -59.55 -52.21 66.54 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.471 -0.331 . . . . 60.23 111.242 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' 52' ' ' ASP . 19.3 pttm -58.45 -25.97 62.82 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.383 0.611 . . . . 75.12 110.985 177.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -78.08 -44.78 25.29 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.8 -0.637 . . . . 74.34 111.397 -179.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -68.32 -37.03 80.16 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.915 0.388 . . . . 75.31 111.377 178.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 54.7 mt-10 -78.56 13.87 1.47 Allowed 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.436 -0.347 . . . . 63.14 111.915 -178.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -108.39 92.84 10.44 Favored Pre-proline 0 CA--C 1.544 0.742 0 N-CA-C 110.118 -0.327 . . . . 71.05 110.118 175.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -87.32 13.33 2.7 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 122.571 2.181 . . . . 53.53 113.02 -179.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -109.99 -44.41 3.79 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 112.26 0.467 . . . . 52.15 112.26 -173.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.585 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 0.6 OUTLIER -93.39 117.62 30.3 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.615 0.598 . . . . 53.31 112.615 -174.179 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -125.52 157.42 37.09 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 116.061 -0.518 . . . . 75.32 110.095 171.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.473 ' N ' HD23 ' A' ' 64' ' ' LEU . 1.8 pt? -146.66 145.9 30.19 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.257 0.551 . . . . 73.12 112.045 -176.177 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -81.91 80.38 8.2 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 112.66 0.615 . . . . 74.44 112.66 -173.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 28.7 m170 -132.96 -52.12 0.91 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 116.19 -0.459 . . . . 53.44 110.617 173.207 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -137.29 131.1 31.79 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 116.221 -0.445 . . . . 72.03 111.027 178.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 32.3 t-80 -67.43 104.24 1.5 Allowed 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 109.79 -0.448 . . . . 74.31 109.79 176.274 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 32.9 p-80 -76.69 30.2 0.13 Allowed 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.23 0.826 . . . . 73.24 113.23 -169.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 49.8 t-80 -158.79 141.02 13.97 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 122.19 -0.319 . . . . 75.3 110.988 177.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 71.7 m80 . . . . . 0 C--O 1.25 1.124 0 CA-C-O 118.652 -0.69 . . . . 75.41 111.131 177.017 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.2 mtm . . . . . 0 N--CA 1.487 1.402 0 CA-C-O 120.855 0.36 . . . . 64.41 110.658 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -79.04 151.05 23.6 Favored 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 122.785 2.324 . . . . 65.51 113.506 -175.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 5.0 t -82.98 81.41 8.67 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.66 0.743 . . . . 74.5 110.273 174.23 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -64.37 112.16 7.11 Favored Pre-proline 0 CA--C 1.545 0.785 0 N-CA-C 113.235 0.828 . . . . 74.05 113.235 -170.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -94.65 159.14 1.89 Allowed 'Trans proline' 0 CA--C 1.548 1.198 0 C-N-CA 123.347 2.698 . . . . 65.45 113.025 175.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -90.51 142.34 3.47 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 122.91 2.407 . . . . 71.25 112.879 175.454 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -90.42 121.43 68.47 Favored Pre-proline 0 CA--C 1.541 0.627 0 CA-C-O 120.659 0.266 . . . . 72.21 110.979 179.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.463 ' HB2' ' H ' ' A' ' 9' ' ' ARG . 72.8 Cg_endo -74.4 -146.09 0.03 OUTLIER 'Trans proline' 0 CA--C 1.549 1.246 0 C-N-CA 122.89 2.393 . . . . 71.34 113.504 -179.271 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.463 ' H ' ' HB2' ' A' ' 8' ' ' PRO . 0.3 OUTLIER -152.84 85.48 1.24 Allowed 'General case' 0 CA--C 1.547 0.852 0 CA-C-O 121.368 0.604 . . . . 64.31 111.603 -173.772 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -85.96 139.04 31.55 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.418 0.525 . . . . 62.23 112.418 -176.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.51 160.42 21.77 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.086 -0.506 . . . . 74.23 111.594 178.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 50.6 p90 -142.59 145.38 33.49 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.471 -0.331 . . . . 72.12 110.819 177.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 62.2 mt -104.01 131.32 53.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-O 121.074 0.464 . . . . 75.42 111.838 -178.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 63.0 t -116.03 125.49 73.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 CA-C-N 116.246 -0.434 . . . . 51.13 111.043 177.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 42.9 p -87.19 120.84 28.88 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 120.975 0.417 . . . . 73.45 111.39 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.452 HD13 ' NE2' ' A' ' 29' ' ' GLN . 35.1 pt -118.08 166.9 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-O 120.863 0.363 . . . . 73.4 111.348 178.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.436 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 44.0 mt-10 -125.1 114.82 19.56 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.494 -0.321 . . . . 62.23 110.865 178.486 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -122.45 174.16 7.21 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 116.608 -0.269 . . . . 64.32 111.661 -177.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.71 -136.89 12.94 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 121.013 -0.613 . . . . 73.13 112.808 -178.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -79.21 153.91 77.04 Favored Pre-proline 0 CA--C 1.539 0.545 0 O-C-N 122.469 -0.43 . . . . 70.34 111.22 178.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -57.78 -44.23 42.71 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.396 2.064 . . . . 74.31 112.474 176.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -82.89 -46.01 6.46 Favored Glycine 0 CA--C 1.528 0.853 0 C-N-CA 121.301 -0.476 . . . . 43.21 112.839 177.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -96.83 79.5 2.94 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.1 0.476 . . . . 74.43 111.286 178.171 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.436 ' HB ' ' HB3' ' A' ' 17' ' ' GLU . 69.3 p -88.23 146.18 25.49 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.969 -0.56 . . . . 74.01 111.54 178.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 54.8 t -109.47 128.6 65.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.917 -0.583 . . . . 73.44 110.33 174.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 94.6 m -79.21 114.22 17.97 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.135 0.493 . . . . 65.3 111.082 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -110.07 131.29 55.19 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 116.146 -0.479 . . . . 74.25 111.52 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -93.28 114.21 26.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.834 0.35 . . . . 74.35 110.538 176.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.816 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 72.9 mt-30 -98.01 113.65 25.56 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.412 -0.358 . . . . 70.15 111.668 -179.342 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 54.8 tp -79.53 116.72 19.91 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.352 -0.385 . . . . 74.41 110.513 174.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.426 HH11 ' HD3' ' A' ' 31' ' ' ARG . 51.7 mtt180 -129.26 170.5 13.53 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.869 0.366 . . . . 71.14 111.97 -177.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -136.01 167.09 21.88 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.981 0.42 . . . . 73.52 111.129 175.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -95.53 -9.74 31.57 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 112.271 0.471 . . . . 74.04 112.271 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 39.9 m80 -142.81 149.53 50.18 Favored Pre-proline 0 CA--C 1.541 0.606 0 O-C-N 122.357 -0.214 . . . . 54.42 110.95 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -70.54 -21.98 10.61 Favored 'Cis proline' 0 C--N 1.356 0.95 0 C-N-CA 124.392 -1.087 . . . . 70.43 113.244 -0.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -118.55 135.28 23.57 Favored Pre-proline 0 N--CA 1.47 0.557 0 CA-C-N 116.705 -0.225 . . . . 73.02 110.708 176.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.0 -27.21 84.37 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 122.219 1.946 . . . . 64.11 111.592 174.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -77.77 -2.39 36.09 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 115.2 -0.909 . . . . 74.23 112.504 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 90.2 p -58.44 110.46 0.98 Allowed 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.271 0.558 . . . . 73.31 112.327 -173.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 56.4 tp -104.03 114.45 28.71 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.918 -0.583 . . . . 71.41 110.463 176.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.3 mm -83.64 -53.6 10.91 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 116.288 -0.415 . . . . 74.34 111.935 -177.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.413 ' HG ' ' CD2' ' A' ' 44' ' ' HIS . 40.6 t -162.78 157.53 21.64 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.389 0.514 . . . . 64.24 112.389 -175.58 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.816 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 37.4 mt-10 -120.96 118.41 29.79 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 116.243 -0.435 . . . . 73.02 110.753 177.135 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . 0.413 ' CD2' ' HG ' ' A' ' 42' ' ' SER . 61.8 m170 -123.49 143.6 41.9 Favored Pre-proline 0 N--CA 1.475 0.791 0 O-C-N 122.375 -0.203 . . . . 74.0 111.278 -178.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -70.1 -22.93 29.85 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 122.632 2.221 . . . . 44.15 114.13 -176.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.461 ' OG1' ' HB2' ' A' ' 49' ' ' GLU . 59.6 p -120.74 153.78 36.52 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.11 0.481 . . . . 71.51 111.508 178.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.17 -45.32 70.31 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.262 -0.426 . . . . 65.12 111.811 -177.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.81 -50.58 70.14 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 120.954 0.407 . . . . 64.32 110.637 179.346 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.461 ' HB2' ' OG1' ' A' ' 46' ' ' THR . 0.7 OUTLIER -56.28 -39.59 72.92 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 121.357 0.599 . . . . 73.31 110.45 178.718 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.74 -41.29 75.47 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 116.292 -0.413 . . . . 45.34 111.857 177.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 85.1 mtp -67.59 -34.67 77.49 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 112.075 0.398 . . . . 65.54 112.075 -178.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.656 ' HA ' ' HE3' ' A' ' 55' ' ' LYS . 4.6 t70 -64.5 -30.86 71.89 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-O 121.128 0.489 . . . . 75.03 110.934 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -75.88 -40.3 54.78 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.343 0.592 . . . . 72.43 110.618 170.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 66.4 tttm -54.84 -47.51 74.06 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 115.563 -0.744 . . . . 75.32 111.691 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.656 ' HE3' ' HA ' ' A' ' 52' ' ' ASP . 18.6 ptpt -57.71 -38.86 75.98 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 116.558 -0.292 . . . . 74.53 111.521 179.347 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.475 ' HG2' ' HB2' ' A' ' 62' ' ' LYS . 80.1 ttt180 -73.79 -26.02 60.42 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 120.821 0.343 . . . . 74.42 111.798 -178.562 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.1 t80 -73.33 -51.27 18.08 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 120.854 0.359 . . . . 74.31 110.999 175.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -73.02 -34.51 66.4 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.241 -0.436 . . . . 64.1 112.096 -176.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -100.43 171.89 5.08 Favored Pre-proline 0 CA--C 1.549 0.906 0 CA-C-N 116.365 -0.38 . . . . 51.13 111.434 179.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -60.49 -171.45 0.07 OUTLIER 'Trans proline' 0 CA--C 1.547 1.136 0 C-N-CA 122.6 2.2 . . . . 73.21 113.56 174.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.9 t70 77.81 19.49 1.13 Allowed 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.701 0.801 . . . . 73.42 111.091 -175.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.475 ' HB2' ' HG2' ' A' ' 56' ' ' ARG . 64.4 tttp -140.05 145.56 37.86 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.806 -0.634 . . . . 65.41 110.712 175.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -70.94 158.18 36.91 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.308 0.575 . . . . 74.35 112.135 178.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.42 HD22 ' N ' ' A' ' 64' ' ' LEU . 3.2 mm? -70.19 129.03 38.29 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.966 -0.561 . . . . 51.41 111.249 178.597 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.42 ' H ' ' CD ' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -81.18 -30.22 34.41 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 120.95 0.405 . . . . 65.01 111.735 -177.654 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 35.2 t-80 -104.91 69.52 0.87 Allowed 'General case' 0 CA--C 1.547 0.854 0 CA-C-O 120.996 0.427 . . . . 72.11 110.87 -178.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 -87.94 10.99 16.95 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-O 121.085 0.469 . . . . 75.35 112.193 -174.129 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 27.3 m80 -138.64 135.45 34.89 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 122.437 0.295 . . . . 74.13 110.772 174.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 8.0 p80 -149.28 95.49 2.38 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 113.036 0.754 . . . . 71.52 113.036 -177.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 33.3 p80 -97.82 179.63 4.74 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 116.159 -0.473 . . . . 60.33 110.392 170.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 20.9 p80 . . . . . 0 C--O 1.251 1.161 0 CA-C-O 119.58 -0.247 . . . . 75.23 111.629 176.934 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.8 mtt . . . . . 0 N--CA 1.49 1.527 0 CA-C-O 120.608 0.242 . . . . 75.21 110.834 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -62.12 103.96 0.32 Allowed 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 122.675 2.25 . . . . 74.12 113.363 -178.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 68.5 p -87.58 140.32 29.65 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 116.57 -0.286 . . . . 74.2 111.38 178.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.524 ' N ' ' HD3' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -146.26 108.63 4.22 Favored Pre-proline 0 CA--C 1.545 0.772 0 CA-C-O 121.012 0.434 . . . . 73.44 111.74 -178.092 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.424 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 65.5 Cg_endo -87.5 150.45 7.67 Favored 'Trans proline' 0 CA--C 1.545 1.065 0 C-N-CA 122.889 2.393 . . . . 63.22 113.226 176.799 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 5' ' ' PRO . 51.3 Cg_exo -55.56 153.94 27.09 Favored 'Trans proline' 0 CA--C 1.544 0.99 0 C-N-CA 122.912 2.408 . . . . 43.24 113.308 178.384 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.4 p90 -62.47 132.27 94.24 Favored Pre-proline 0 CA--C 1.544 0.745 0 N-CA-C 112.285 0.476 . . . . 72.41 112.285 -178.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -74.94 116.03 4.47 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 122.565 2.177 . . . . 73.21 112.441 174.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.7 ptp85 -78.09 154.19 31.54 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.666 0.617 . . . . 65.44 112.666 -175.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.54 ' HA ' ' HG2' ' A' ' 58' ' ' GLU . 13.2 pt-20 -132.63 165.52 24.24 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.147 -0.479 . . . . 71.43 110.736 172.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.449 ' HB2' ' CD2' ' A' ' 57' ' ' TYR . . . -124.29 171.87 9.54 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 120.794 0.33 . . . . 70.32 111.534 179.259 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 36.9 p90 -147.36 157.62 43.65 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.139 0.495 . . . . 71.31 111.923 178.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 58.6 mt -100.4 137.26 28.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 CA-C-N 116.073 -0.512 . . . . 74.15 111.838 -177.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 61.1 t -117.07 127.44 74.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-N 116.163 -0.471 . . . . 64.24 110.571 177.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 65.1 p -95.06 114.41 26.21 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.017 0.437 . . . . 73.51 111.861 -178.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.4 pt -121.51 172.18 9.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 121.021 0.439 . . . . 51.12 111.259 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.405 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 1.6 mp0 -128.91 148.84 50.95 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 120.856 0.36 . . . . 61.15 111.057 177.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -134.15 166.68 22.21 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-O 120.844 0.354 . . . . 70.43 111.441 178.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.53 -143.17 16.17 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 121.234 -0.508 . . . . 71.43 113.734 178.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -81.26 142.93 51.43 Favored Pre-proline 0 N--CA 1.471 0.577 0 O-C-N 122.575 -0.368 . . . . 71.04 111.636 -178.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -53.44 116.93 3.3 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.371 2.048 . . . . 63.13 112.365 176.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 97.61 -67.41 0.8 Allowed Glycine 0 CA--C 1.526 0.751 0 C-N-CA 121.249 -0.501 . . . . 61.12 112.283 -174.37 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -80.95 75.56 7.91 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 121.361 0.6 . . . . 74.43 110.277 176.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.405 ' HB ' ' HB3' ' A' ' 17' ' ' GLU . 64.7 p -107.84 163.91 12.71 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.596 -0.729 . . . . 61.42 112.895 -173.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 59.0 t -110.14 127.65 66.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-N 115.489 -0.778 . . . . 74.43 110.201 171.271 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 51.4 m -82.26 118.86 23.44 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.402 0.519 . . . . 72.23 112.402 -175.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 67.7 m95 -110.37 149.42 30.27 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.191 -0.458 . . . . 75.5 111.512 178.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -110.2 114.63 28.27 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.878 0.371 . . . . 74.14 111.193 178.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.721 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 72.8 mt-30 -95.59 121.57 37.43 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.919 0.39 . . . . 75.14 111.542 178.23 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.6 tp -83.02 109.89 17.5 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.571 -0.286 . . . . 71.52 110.322 173.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 53.2 mtt180 -123.4 162.17 23.3 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.448 0.642 . . . . 71.24 112.184 -178.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -140.83 -179.35 6.01 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.516 -0.765 . . . . 65.53 110.72 175.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.511 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 20.4 m-20 -103.1 -0.98 29.87 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.203 0.525 . . . . 54.44 111.209 175.512 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -123.72 129.54 24.79 Favored Pre-proline 0 CA--C 1.544 0.725 0 CA-C-N 116.354 -0.384 . . . . 71.51 111.066 -178.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -78.76 -14.86 30.23 Favored 'Cis proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.757 -1.351 . . . . 60.42 113.206 -1.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -129.03 143.32 48.31 Favored Pre-proline 0 N--CA 1.472 0.663 0 C-N-CA 122.445 0.298 . . . . 61.24 111.101 -178.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.511 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 53.8 Cg_exo -54.54 -28.9 57.43 Favored 'Trans proline' 0 CA--C 1.545 1.073 0 C-N-CA 122.338 2.025 . . . . 42.32 113.023 174.26 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -88.98 16.64 6.7 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-O 121.03 0.443 . . . . 63.04 111.309 177.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 83.1 p -66.52 96.13 0.36 Allowed 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.45 0.643 . . . . 63.24 111.474 -179.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 56.7 tp -87.26 107.6 18.57 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.071 -0.513 . . . . 73.31 110.539 176.081 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 44.0 mm -73.47 -53.96 16.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 120.914 0.388 . . . . 75.24 111.054 178.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 70.1 m -163.55 149.94 11.87 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 120.953 0.406 . . . . 70.11 111.691 -178.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.721 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 42.4 mt-10 -108.2 119.22 38.85 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 116.181 -0.463 . . . . 74.5 110.511 174.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . 0.49 ' HB3' ' HB2' ' A' ' 49' ' ' GLU . 37.7 m170 -128.23 151.14 75.8 Favored Pre-proline 0 CA--C 1.543 0.696 0 N-CA-C 112.187 0.439 . . . . 55.33 112.187 -176.608 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.35 -31.89 8.71 Favored 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 122.857 2.371 . . . . 73.54 114.358 -176.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.449 ' OG1' ' HG2' ' A' ' 49' ' ' GLU . 43.9 p -115.06 152.05 33.18 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.192 0.52 . . . . 65.05 111.886 -177.266 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.48 -29.94 70.29 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.009 -0.541 . . . . 55.04 110.758 175.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 25.0 tp60 -59.09 -51.33 70.52 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.475 -0.33 . . . . 63.2 111.281 175.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.49 ' HB2' ' HB3' ' A' ' 44' ' ' HIS . 78.9 mm-40 -62.96 -30.93 71.96 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.086 0.469 . . . . 54.22 111.475 178.591 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.89 -47.93 34.49 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.392 -0.367 . . . . 62.44 111.35 177.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 90.1 mmm -64.59 -43.43 93.87 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 112.307 0.484 . . . . 74.32 112.307 -178.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.513 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 16.8 t70 -59.31 -51.14 71.24 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.821 0.343 . . . . 73.42 111.11 -179.343 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.39 -36.45 84.01 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.273 0.559 . . . . 64.11 111.296 176.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.521 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 43.7 tttp -53.94 -49.96 67.53 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.855 -0.612 . . . . 75.24 111.469 176.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -65.71 -27.02 68.03 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.231 0.456 . . . . 74.42 112.231 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.513 ' HG3' ' O ' ' A' ' 52' ' ' ASP . 44.9 mtt180 -72.94 -29.08 62.82 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 120.943 0.402 . . . . 75.04 111.073 177.259 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.449 ' CD2' ' HB2' ' A' ' 11' ' ' ALA . 89.5 t80 -77.35 -37.05 53.11 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.287 0.565 . . . . 75.44 110.849 174.125 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.54 ' HG2' ' HA ' ' A' ' 10' ' ' GLU . 56.6 mt-10 -76.97 -25.45 52.8 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.006 -0.543 . . . . 65.15 111.639 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -119.07 96.75 50.35 Favored Pre-proline 0 CA--C 1.54 0.571 0 CA-C-O 120.698 0.285 . . . . 62.4 110.345 175.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -64.83 76.66 0.2 Allowed 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 122.839 2.359 . . . . 71.31 112.828 -177.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -90.93 -58.91 2.31 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 116.137 -0.483 . . . . 75.41 111.287 179.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 40.5 ttpt -75.37 -73.09 0.27 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 120.737 0.303 . . . . 72.34 111.44 179.363 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -165.32 -173.47 2.84 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 116.592 -0.277 . . . . 75.42 110.583 179.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.498 ' N ' HD23 ' A' ' 64' ' ' LEU . 1.7 pt? -146.3 103.34 3.69 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 121.237 0.541 . . . . 64.42 111.605 178.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -64.86 102.49 0.6 Allowed 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 121.293 0.568 . . . . 72.24 110.884 179.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 31.5 p-80 -105.3 141.14 37.34 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 112.731 0.641 . . . . 71.14 112.731 -169.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 53.4 t-80 50.1 95.46 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 113.416 0.895 . . . . 70.31 113.416 176.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 28.5 p80 -161.67 166.69 26.38 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.192 0.52 . . . . 61.03 112.205 176.142 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -57.5 141.86 46.2 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 115.648 -0.706 . . . . 61.24 112.133 -179.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 9.8 m-70 -76.07 91.28 3.1 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 110.139 -0.319 . . . . 74.5 110.139 175.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 51.7 t-80 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 119.471 -0.299 . . . . 63.4 111.482 -178.803 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.697 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 121.124 0.488 . . . . 71.54 112.106 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -105.84 52.3 0.02 OUTLIER 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 123.844 3.029 . . . . 71.24 113.113 175.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.563 ' O ' ' HB2' ' A' ' 4' ' ' LYS . 74.9 p -81.26 55.02 2.42 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.774 0.657 . . . . 64.4 112.774 -174.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.563 ' HB2' ' O ' ' A' ' 3' ' ' THR . 4.0 ttpm? 169.24 91.55 0.03 OUTLIER Pre-proline 0 N--CA 1.477 0.917 0 C-N-CA 123.931 0.892 . . . . 65.04 109.692 170.51 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.42 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 89.3 Cg_endo -77.01 157.73 34.32 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 122.744 2.296 . . . . 71.2 113.667 -174.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 5' ' ' PRO . 19.7 Cg_exo -67.03 -174.86 0.53 Allowed 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.75 2.3 . . . . 65.3 112.593 174.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.3 t80 68.95 95.06 0.05 OUTLIER Pre-proline 0 N--CA 1.474 0.757 0 CA-C-O 121.104 0.478 . . . . 65.01 111.477 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -82.47 167.78 15.05 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 122.537 2.158 . . . . 63.11 112.747 176.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.556 ' H ' ' HD3' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -130.9 132.85 45.38 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.813 0.339 . . . . 70.25 110.844 177.619 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -151.16 109.32 3.74 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.249 -0.432 . . . . 61.22 110.518 179.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -93.31 153.84 18.33 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.914 0.388 . . . . 74.13 110.838 178.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 45.2 p90 -141.09 159.34 42.41 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.188 0.518 . . . . 74.54 111.569 -179.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 67.2 mt -99.74 138.05 25.33 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-N 115.947 -0.569 . . . . 65.53 111.511 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 59.2 t -119.95 121.16 65.27 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 122.509 0.323 . . . . 75.43 110.766 176.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 32.5 p -86.77 112.59 21.84 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.463 0.542 . . . . 45.35 112.463 -178.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.5 pt -113.92 175.87 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-N 116.296 -0.411 . . . . 71.4 110.523 175.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -138.53 128.43 25.26 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.125 0.488 . . . . 74.31 111.44 179.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -115.67 159.9 20.75 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 116.531 -0.304 . . . . 63.43 111.561 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.56 -153.74 19.29 Favored Glycine 0 CA--C 1.531 1.038 0 C-N-CA 121.294 -0.479 . . . . 63.15 113.845 178.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -79.84 155.49 75.46 Favored Pre-proline 0 CA--C 1.54 0.566 0 O-C-N 122.668 -0.313 . . . . 73.44 111.294 -176.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -52.97 -37.68 78.66 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 122.487 2.125 . . . . 70.03 113.002 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -84.69 -48.08 5.11 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 121.106 -0.569 . . . . 74.14 112.619 175.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -99.46 83.38 2.8 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.224 0.535 . . . . 65.54 111.691 178.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 75.2 p -99.64 155.89 17.36 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.769 -0.65 . . . . 74.11 111.457 175.59 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 48.8 t -116.97 128.08 74.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 CA-C-N 116.089 -0.505 . . . . 63.34 110.246 174.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 36.1 m -74.44 115.35 13.87 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.762 0.315 . . . . 62.22 111.444 -179.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 67.3 m95 -113.53 131.08 56.21 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.086 0.469 . . . . 65.21 111.265 177.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -100.76 114.13 27.62 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.109 -0.496 . . . . 74.01 110.813 -179.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.457 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 78.0 mt-30 -96.29 120.58 36.85 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.885 0.374 . . . . 75.15 111.637 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 55.9 tp -83.3 107.48 15.86 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 120.737 0.304 . . . . 72.02 110.259 175.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 54.4 mtt180 -120.92 166.28 14.03 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.158 0.504 . . . . 72.31 111.787 -178.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -139.02 158.57 43.96 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.935 -0.575 . . . . 72.2 111.114 178.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -80.8 -21.72 40.67 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 116.521 -0.309 . . . . 71.32 111.686 -179.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -112.27 144.3 30.55 Favored Pre-proline 0 CA--C 1.542 0.65 0 N-CA-C 111.573 0.212 . . . . 73.01 111.573 -177.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -74.67 -28.47 7.44 Favored 'Cis proline' 0 CA--C 1.542 0.881 0 C-N-CA 123.794 -1.336 . . . . 63.32 112.98 -4.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.403 ' HB3' ' HD2' ' A' ' 37' ' ' PRO . 58.1 mttp -131.23 160.28 67.76 Favored Pre-proline 0 CA--C 1.541 0.603 0 C-N-CA 122.426 0.29 . . . . 51.44 110.941 176.028 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.403 ' HD2' ' HB3' ' A' ' 36' ' ' LYS . 28.8 Cg_endo -61.43 -7.03 7.84 Favored 'Trans proline' 0 CA--C 1.543 0.949 0 C-N-CA 122.573 2.182 . . . . 62.43 113.173 177.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -77.79 -7.12 56.15 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.554 -0.294 . . . . 72.41 111.422 176.329 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 68.6 m -65.44 92.17 0.13 Allowed 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.523 0.564 . . . . 74.22 112.523 -175.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 48.7 tp -100.06 105.11 16.73 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.067 -0.515 . . . . 74.1 109.974 172.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.5 ' N ' HD12 ' A' ' 41' ' ' ILE . 2.3 mp -71.06 -53.87 19.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 CA-C-N 116.383 -0.371 . . . . 61.42 111.397 -175.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 71.1 p -169.58 149.8 3.98 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.178 0.513 . . . . 62.12 111.397 -179.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.457 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 45.2 mt-10 -100.56 140.66 34.5 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.274 -0.421 . . . . 75.43 110.795 177.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 83.0 m-70 -136.74 135.91 20.89 Favored Pre-proline 0 CA--C 1.538 0.516 0 O-C-N 122.219 -0.301 . . . . 72.2 111.183 -178.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.0 -5.57 16.47 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 122.594 2.196 . . . . 64.41 113.58 -179.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 35.8 p -136.14 155.08 50.7 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-O 120.933 0.397 . . . . 45.21 111.345 177.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.55 -41.14 89.13 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.287 -0.415 . . . . 74.22 111.725 178.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 20.1 tp60 -56.55 -51.68 67.67 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 111.396 0.147 . . . . 70.44 111.396 177.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -61.39 -29.09 69.71 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 120.93 0.395 . . . . 62.42 111.82 179.144 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.54 -47.45 40.76 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 120.889 0.376 . . . . 72.32 111.464 176.05 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 65.6 mtt -65.89 -35.9 81.92 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.008 0.432 . . . . 61.23 111.451 178.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -60.52 -49.93 75.58 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.34 0.59 . . . . 64.33 110.37 176.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.27 -39.32 94.25 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.803 -0.635 . . . . 60.43 111.758 176.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 44.1 tttp -54.76 -48.55 72.49 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.709 0.29 . . . . 72.14 111.76 178.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 47.4 mtmt -61.56 -48.75 79.57 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.179 0.514 . . . . 63.44 111.223 177.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 45.2 mtp180 -65.5 -26.07 67.75 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.944 -0.571 . . . . 65.2 111.97 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -71.21 -46.95 60.1 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.965 0.412 . . . . 75.14 111.214 176.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -81.49 -21.64 38.53 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 112.387 0.514 . . . . 63.25 112.387 -178.408 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 -122.28 78.65 44.35 Favored Pre-proline 0 CA--C 1.544 0.717 0 CA-C-O 120.768 0.318 . . . . 75.41 111.146 175.154 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -75.83 88.13 1.33 Allowed 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 122.579 2.186 . . . . 75.11 112.766 178.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -90.27 -23.68 21.14 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.832 0.349 . . . . 55.43 111.418 176.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.485 ' HA ' ' HE2' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -74.52 170.9 14.79 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 120.881 0.372 . . . . 73.24 111.675 -178.831 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -74.66 152.14 39.21 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 112.811 0.671 . . . . 71.45 112.811 -178.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.503 ' N ' HD12 ' A' ' 64' ' ' LEU . 5.2 mp -75.82 150.15 37.74 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.523 -0.762 . . . . 70.04 111.1 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -73.52 179.14 4.22 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.211 0.529 . . . . 73.23 111.751 178.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 52.0 m-70 -119.42 149.2 42.26 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.52 -0.309 . . . . 73.03 111.184 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 71.01 -40.09 0.47 Allowed 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.034 0.753 . . . . 75.03 113.034 178.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 52.3 m170 -60.34 103.0 0.2 Allowed 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.924 0.393 . . . . 73.3 110.622 176.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 19.8 p-80 -92.48 28.56 1.94 Allowed 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 121.079 0.466 . . . . 71.55 112.018 -174.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 78.9 t60 -65.34 139.23 58.56 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.338 -0.392 . . . . 72.52 111.442 176.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 19.4 p-80 . . . . . 0 C--O 1.25 1.117 0 CA-C-O 119.476 -0.297 . . . . 73.54 111.578 175.675 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.5 ptp . . . . . 0 N--CA 1.489 1.521 0 CA-C-O 120.477 0.179 . . . . 74.21 111.254 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -82.71 88.1 1.29 Allowed 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 122.45 2.1 . . . . 74.44 112.506 176.376 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 83.2 m -77.51 93.88 4.22 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.159 0.504 . . . . 62.43 111.53 -179.062 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -144.44 89.43 6.88 Favored Pre-proline 0 CA--C 1.539 0.551 0 CA-C-N 116.069 -0.514 . . . . 73.44 109.923 176.135 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -79.79 124.14 5.53 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 122.858 2.372 . . . . 31.45 112.836 179.141 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.405 ' O ' ' HD3' ' A' ' 8' ' ' PRO . 40.2 Cg_endo -66.06 170.81 11.1 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 122.366 2.044 . . . . 63.25 112.112 175.696 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -79.87 115.64 55.44 Favored Pre-proline 0 CA--C 1.543 0.71 0 N-CA-C 112.15 0.426 . . . . 65.22 112.15 -175.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.405 ' HD3' ' O ' ' A' ' 6' ' ' PRO . 72.9 Cg_endo -91.3 139.77 2.5 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.003 2.469 . . . . 65.41 111.891 172.152 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.451 ' HD3' ' CZ ' ' A' ' 57' ' ' TYR . 91.8 mtt-85 -93.23 144.24 25.49 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 112.578 0.585 . . . . 75.32 112.578 -176.101 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -130.72 128.26 40.49 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.682 -0.69 . . . . 45.52 110.849 178.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -131.61 154.66 48.66 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 116.161 -0.472 . . . . 64.05 110.706 178.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 13.1 p90 -135.11 146.13 48.54 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.272 0.558 . . . . 72.02 111.932 -177.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 62.9 mt -91.06 117.35 34.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 115.81 -0.632 . . . . 61.13 111.359 -177.356 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.54 HG21 ' HD2' ' A' ' 31' ' ' ARG . 61.9 t -105.61 126.63 60.86 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 CA-C-O 120.782 0.325 . . . . 41.11 111.277 -179.203 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 66.4 p -93.53 115.71 28.22 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 120.763 0.316 . . . . 74.45 111.228 178.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 42.3 pt -111.69 166.86 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 CA-C-O 121.004 0.431 . . . . 62.34 111.61 -179.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -115.34 114.98 25.85 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.257 -0.429 . . . . 64.4 111.787 -177.305 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -108.8 165.12 11.8 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 122.095 -0.378 . . . . 71.53 110.677 174.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.3 -137.09 13.06 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 121.024 -0.608 . . . . 55.45 113.652 -179.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -102.17 158.54 31.58 Favored Pre-proline 0 N--CA 1.473 0.684 0 N-CA-C 112.032 0.382 . . . . 75.14 112.032 -175.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -60.69 124.31 14.76 Favored 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 122.18 1.92 . . . . 71.15 111.714 173.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 89.27 -47.8 3.35 Favored Glycine 0 CA--C 1.525 0.692 0 C-N-CA 120.859 -0.686 . . . . 71.44 112.406 -176.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -99.08 79.15 2.31 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.347 0.594 . . . . 74.12 110.41 175.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 77.6 p -107.84 156.56 19.02 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.684 -0.689 . . . . 60.15 112.371 -175.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 63.6 t -113.27 132.31 62.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-N 115.639 -0.709 . . . . 71.44 110.359 175.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 95.0 m -79.73 117.28 20.49 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 120.912 0.387 . . . . 72.15 111.833 -179.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 76.9 m95 -114.87 131.62 56.79 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 116.377 -0.374 . . . . 74.55 111.163 175.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 59.7 m-85 -92.81 114.73 27.36 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.946 0.403 . . . . 75.22 111.131 -178.305 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.64 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 86.0 mt-30 -102.08 130.13 48.58 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.472 -0.331 . . . . 73.11 111.393 177.447 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 59.8 tp -87.51 104.51 16.54 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.779 0.323 . . . . 65.43 110.441 174.521 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.54 ' HD2' HG21 ' A' ' 14' ' ' VAL . 86.5 mtt180 -111.48 154.72 24.3 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.555 -0.293 . . . . 63.43 110.953 179.079 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.29 140.25 51.49 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 120.574 0.226 . . . . 74.41 111.375 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -62.62 -24.54 67.64 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.157 0.429 . . . . 73.25 112.157 -179.148 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.482 ' HA ' ' C ' ' A' ' 35' ' ' PRO . 83.5 m-70 -122.18 134.22 24.69 Favored Pre-proline 0 CA--C 1.541 0.633 0 O-C-N 122.329 -0.232 . . . . 73.03 111.154 179.654 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.482 ' C ' ' HA ' ' A' ' 34' ' ' HIS . 22.2 Cg_exo -65.42 -42.12 0.66 Allowed 'Cis proline' 0 C--N 1.358 1.037 0 C-N-CA 124.643 -0.982 . . . . 70.14 113.709 3.393 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -137.0 145.85 52.27 Favored Pre-proline 0 N--CA 1.471 0.59 0 O-C-N 122.376 -0.202 . . . . 65.11 110.688 178.062 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -50.84 -22.0 9.28 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 C-N-CA 122.933 2.422 . . . . 73.42 113.914 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -84.23 10.89 9.23 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-O 121.052 0.453 . . . . 40.2 111.677 178.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 66.5 m -81.1 100.31 8.97 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.098 0.475 . . . . 55.42 111.109 178.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.401 HD13 ' HB3' ' A' ' 29' ' ' GLN . 56.3 tp -87.1 116.52 25.22 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.193 -0.458 . . . . 73.43 111.366 -179.721 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 47.8 mm -76.76 -54.87 12.31 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-O 120.663 0.268 . . . . 74.54 110.835 176.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 64.0 m -165.8 154.1 11.12 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.603 0.361 . . . . 73.32 111.404 179.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.64 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 50.8 mt-10 -100.31 150.11 22.92 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.03 0.443 . . . . 72.31 111.448 176.409 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . 0.466 ' ND1' ' HB3' ' A' ' 49' ' ' GLU . 89.7 m-70 -147.08 142.2 16.73 Favored Pre-proline 0 CA--C 1.542 0.649 0 CA-C-N 116.454 -0.339 . . . . 65.53 111.215 176.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -74.6 -25.09 13.08 Favored 'Trans proline' 0 CA--C 1.541 0.865 0 C-N-CA 122.31 2.006 . . . . 72.2 113.243 177.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 31.2 p -114.9 151.01 34.74 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-O 121.179 0.514 . . . . 75.41 111.737 -179.311 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.23 -44.25 92.44 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.062 -0.517 . . . . 73.21 112.303 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 24.0 tp60 -53.45 -42.56 67.27 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 111.744 0.275 . . . . 70.52 111.744 -179.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.466 ' HB3' ' ND1' ' A' ' 44' ' ' HIS . 47.1 mt-10 -61.31 -43.13 99.39 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.899 0.38 . . . . 73.31 111.342 176.087 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.08 -43.67 97.9 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.059 0.457 . . . . 74.13 111.385 178.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 58.6 mtt -63.76 -38.12 89.92 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.336 0.589 . . . . 71.14 110.958 176.152 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.453 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 34.0 t70 -62.95 -51.85 65.31 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.761 -0.654 . . . . 73.52 110.971 177.592 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.16 -42.72 86.56 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 116.091 -0.504 . . . . 71.32 111.443 177.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -55.65 -49.79 71.96 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.243 -0.435 . . . . 73.21 111.052 175.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 23.5 mtpp -60.06 -28.97 68.23 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.305 -0.407 . . . . 63.54 112.056 178.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.453 ' HG3' ' O ' ' A' ' 52' ' ' ASP . 72.7 mtt180 -73.58 -40.68 63.71 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 122.062 -0.399 . . . . 62.44 110.561 176.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.451 ' CZ ' ' HD3' ' A' ' 9' ' ' ARG . 79.3 t80 -63.5 -33.32 75.33 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.341 0.591 . . . . 73.33 110.523 176.408 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -80.53 -34.37 35.62 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.909 -0.587 . . . . 74.12 111.836 176.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -132.5 74.86 74.73 Favored Pre-proline 0 CA--C 1.544 0.717 0 CA-C-O 120.962 0.411 . . . . 65.32 111.177 -176.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -99.08 101.61 0.06 OUTLIER 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 123.211 2.607 . . . . 61.35 113.908 -179.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -82.57 1.12 39.62 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.273 0.559 . . . . 71.23 110.912 172.052 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 32.3 mmmt -85.41 150.7 24.54 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.975 -0.557 . . . . 73.15 111.309 178.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 67.55 11.06 8.19 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 113.168 0.803 . . . . 73.35 113.168 172.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 89.8 mt -65.06 159.53 23.03 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.738 0.304 . . . . 70.24 110.834 176.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -77.7 96.83 4.96 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 112.954 0.724 . . . . 72.34 112.954 -174.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 28.6 p-80 -84.9 132.8 34.33 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 109.29 -0.633 . . . . 71.22 109.29 170.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 17.1 p80 -146.57 79.41 1.53 Allowed 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.612 0.597 . . . . 71.44 112.612 -175.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 32.6 m80 65.8 -68.37 0.12 Allowed 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 113.203 0.816 . . . . 63.11 113.203 173.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 41.3 t60 -54.85 102.42 0.06 Allowed 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 112.192 0.442 . . . . 74.42 112.192 -177.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -82.54 -61.08 1.98 Allowed 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.249 0.547 . . . . 41.35 111.227 177.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 71.8 t60 . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.742 -0.647 . . . . 73.42 111.31 -178.943 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.3 mtt . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 120.533 0.206 . . . . 75.43 111.31 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -80.26 159.71 23.16 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.401 2.067 . . . . 61.24 112.116 172.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 73.5 p -71.78 131.17 42.7 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 111.931 0.345 . . . . 64.4 111.931 -179.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt 64.38 89.38 0.1 Allowed Pre-proline 0 N--CA 1.476 0.834 0 C-N-CA 123.064 0.546 . . . . 64.35 112.38 179.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.62 159.42 48.84 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.641 2.227 . . . . 53.31 112.757 179.215 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_exo -67.24 160.46 47.48 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 122.624 2.216 . . . . 52.12 113.053 177.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 52.4 p90 -65.17 147.97 98.21 Favored Pre-proline 0 CA--C 1.544 0.72 0 CA-C-O 120.83 0.347 . . . . 72.33 111.75 178.074 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -69.18 153.75 71.12 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 122.485 2.123 . . . . 74.44 112.94 178.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.2 tpp85 -80.41 143.72 33.24 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.135 0.493 . . . . 74.12 111.791 -178.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -127.7 146.72 50.47 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 116.286 -0.415 . . . . 75.5 111.282 178.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -145.54 155.05 42.83 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.395 -0.366 . . . . 72.12 111.012 176.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 40.5 p90 -149.36 161.54 41.87 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.14 0.495 . . . . 75.31 111.628 -178.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 65.4 mt -101.89 136.86 31.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-O 121.077 0.465 . . . . 74.13 112.106 -177.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.439 HG21 ' HD2' ' A' ' 31' ' ' ARG . 98.4 t -119.07 126.38 75.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 116.353 -0.385 . . . . 72.32 110.802 176.391 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 46.8 p -86.64 114.42 23.33 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.587 0.232 . . . . 74.13 111.615 -179.137 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.513 HD13 ' NE2' ' A' ' 29' ' ' GLN . 37.8 pt -112.83 168.91 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 CA-C-O 121.19 0.519 . . . . 75.34 111.872 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -114.59 124.84 52.87 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.756 -0.656 . . . . 54.13 111.416 -179.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -119.25 159.61 23.75 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.764 0.316 . . . . 73.4 110.932 172.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.26 -146.21 17.6 Favored Glycine 0 CA--C 1.528 0.868 0 C-N-CA 121.314 -0.469 . . . . 65.52 113.401 -179.44 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -95.22 148.96 35.5 Favored Pre-proline 0 N--CA 1.471 0.606 0 N-CA-C 112.088 0.403 . . . . 73.34 112.088 -175.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -56.49 124.35 16.04 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.201 1.934 . . . . 65.12 112.065 176.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 95.17 -52.79 1.86 Allowed Glycine 0 CA--C 1.527 0.786 0 C-N-CA 121.133 -0.556 . . . . 73.25 112.384 -174.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 31.4 mm-40 -99.8 64.8 1.28 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.148 0.499 . . . . 64.31 110.882 176.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 59.9 p -92.05 167.63 11.95 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.376 0.608 . . . . 73.32 112.43 -175.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 60.8 t -124.34 124.7 69.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 CA-C-N 115.707 -0.679 . . . . 74.44 109.95 175.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 94.4 m -77.46 114.86 16.73 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.123 0.487 . . . . 43.03 112.015 -177.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 72.6 m95 -110.58 140.47 44.87 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.926 -0.579 . . . . 74.11 110.784 175.336 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -97.74 113.76 25.6 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 120.884 0.373 . . . . 74.0 111.298 -177.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.661 ' HG2' ' HG3' ' A' ' 43' ' ' GLU . 79.4 mt-30 -91.5 125.85 36.39 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.815 0.341 . . . . 71.3 111.362 177.726 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 60.4 tp -83.25 116.92 22.62 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.664 0.268 . . . . 74.11 110.495 173.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.439 ' HD2' HG21 ' A' ' 14' ' ' VAL . 99.0 mtt180 -126.94 164.7 20.88 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 120.926 0.393 . . . . 73.31 111.217 178.214 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -139.82 140.15 36.53 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.504 -0.316 . . . . 71.11 111.094 176.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.468 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 29.0 t70 -61.05 -38.61 86.78 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.313 0.578 . . . . 42.45 110.869 177.337 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 -105.96 130.54 22.84 Favored Pre-proline 0 CA--C 1.541 0.611 0 CA-C-N 116.105 -0.498 . . . . 72.02 110.392 177.09 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -77.45 -34.49 3.27 Favored 'Cis proline' 0 CA--C 1.545 1.033 0 C-N-CA 123.885 -1.298 . . . . 72.52 114.156 3.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -130.76 130.96 22.99 Favored Pre-proline 0 N--CA 1.474 0.766 0 O-C-N 122.393 -0.192 . . . . 73.51 110.943 -178.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.468 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 91.2 Cg_exo -45.47 -51.34 8.1 Favored 'Trans proline' 0 CA--C 1.542 0.916 0 C-N-CA 123.419 2.746 . . . . 41.01 114.49 -174.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -79.34 24.67 0.34 Allowed 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 112.703 0.631 . . . . 64.3 112.703 -177.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 45.2 p -66.6 89.77 0.15 Allowed 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.161 0.505 . . . . 74.53 111.413 177.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 38.2 tp -72.7 104.1 3.83 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 120.887 0.375 . . . . 64.21 111.476 178.087 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.3 mm -74.88 -54.1 15.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 116.272 -0.422 . . . . 73.32 110.754 175.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 29.3 t -175.76 149.87 0.99 Allowed 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 116.351 -0.386 . . . . 53.13 111.904 -178.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.661 ' HG3' ' HG2' ' A' ' 29' ' ' GLN . 1.9 mp0 -89.39 125.99 35.37 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 116.534 -0.303 . . . . 70.01 110.381 173.525 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 11.9 m170 -116.52 146.93 38.61 Favored Pre-proline 0 CA--C 1.542 0.638 0 C-N-CA 122.574 0.349 . . . . 61.02 111.008 179.519 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -67.0 -40.37 11.94 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 122.827 2.352 . . . . 75.24 114.173 -173.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.517 ' OG1' ' HB2' ' A' ' 49' ' ' GLU . 29.9 p -120.37 153.51 36.4 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 122.064 -0.398 . . . . 61.15 111.243 -179.435 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.21 -41.71 79.95 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 120.896 0.379 . . . . 74.31 111.251 178.02 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.27 -43.75 98.37 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 116.288 -0.415 . . . . 74.02 110.752 176.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.517 ' HB2' ' OG1' ' A' ' 46' ' ' THR . 0.6 OUTLIER -61.44 -33.1 73.16 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.343 0.592 . . . . 53.4 110.727 178.524 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -74.96 -42.76 56.99 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 116.212 -0.449 . . . . 71.23 111.371 176.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.557 ' SD ' ' HD3' ' A' ' 54' ' ' LYS . 22.2 mmt -57.29 -35.74 70.18 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 116.313 -0.403 . . . . 63.22 111.753 176.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -54.47 -43.83 72.06 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 116.133 -0.485 . . . . 75.32 111.088 177.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.08 -40.08 53.94 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.158 0.504 . . . . 50.44 111.408 175.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.557 ' HD3' ' SD ' ' A' ' 51' ' ' MET . 42.3 tttp -53.89 -49.76 67.84 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 115.872 -0.603 . . . . 75.53 112.004 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 60.6 mttp -53.7 -57.97 8.9 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 111.844 0.312 . . . . 64.52 111.844 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 53.0 mtp180 -62.24 -26.4 68.36 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 112.003 0.371 . . . . 63.3 112.003 -178.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.534 ' HA ' ' HB2' ' A' ' 62' ' ' LYS . 60.6 t80 -71.45 -34.47 70.28 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.002 0.43 . . . . 75.41 110.936 176.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.44 ' HG3' ' O ' ' A' ' 54' ' ' LYS . 44.1 mt-10 -86.25 -20.19 28.83 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.086 -0.507 . . . . 70.21 111.48 179.549 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -76.25 163.96 63.02 Favored Pre-proline 0 CA--C 1.543 0.68 0 CA-C-N 116.398 -0.365 . . . . 73.02 110.855 172.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -68.33 4.93 1.38 Allowed 'Trans proline' 0 CA--C 1.544 1.012 0 C-N-CA 122.265 1.976 . . . . 74.22 112.278 172.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -69.03 -37.09 78.41 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.219 0.608 . . . . 74.11 111.179 177.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.534 ' HB2' ' HA ' ' A' ' 57' ' ' TYR . 14.7 tppt? -72.31 156.52 39.02 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.276 0.56 . . . . 74.42 112.306 -175.063 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -82.02 167.42 18.86 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.596 0.712 . . . . 74.34 111.981 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.511 ' N ' HD23 ' A' ' 64' ' ' LEU . 1.1 pt? -130.57 70.17 1.45 Allowed 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 121.653 0.74 . . . . 73.4 110.432 178.138 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -79.55 81.75 5.77 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.227 0.537 . . . . 71.32 111.447 -176.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 36.9 t-80 -92.87 14.58 17.01 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 116.083 -0.508 . . . . 72.23 111.91 -177.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 84.1 m-70 -123.98 104.23 8.78 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 121.844 -0.535 . . . . 74.51 111.605 178.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 39.9 m80 -146.69 164.84 31.43 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.028 0.442 . . . . 61.12 111.001 177.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 31.7 m80 -124.11 100.67 6.83 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 120.858 0.361 . . . . 64.04 110.401 175.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 17.8 m-70 -139.18 130.88 27.42 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.852 0.358 . . . . 73.21 111.881 -178.186 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 32.4 m80 . . . . . 0 C--O 1.252 1.23 0 CA-C-O 119.214 -0.422 . . . . 74.42 110.798 172.338 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.9 mtt . . . . . 0 N--CA 1.489 1.512 0 N-CA-C 110.728 -0.101 . . . . 54.23 110.728 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -70.87 131.37 19.53 Favored 'Trans proline' 0 CA--C 1.54 0.82 0 C-N-CA 122.367 2.044 . . . . 74.41 112.979 -179.27 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 31.9 p -76.27 -22.06 55.54 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 116.493 -0.321 . . . . 75.22 111.483 177.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt 67.62 91.85 0.07 OUTLIER Pre-proline 0 N--CA 1.472 0.663 0 N-CA-C 112.586 0.587 . . . . 72.31 112.586 171.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_exo -72.98 148.64 45.55 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 122.675 2.25 . . . . 71.23 112.304 174.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.88 60.92 4.6 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 122.401 2.067 . . . . 71.13 113.07 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 34.4 t80 63.49 97.52 0.04 OUTLIER Pre-proline 0 CA--C 1.543 0.694 0 C-N-CA 123.182 0.593 . . . . 71.42 112.247 -177.409 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_exo -72.55 110.49 3.0 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 122.618 2.212 . . . . 72.34 112.126 176.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.2 mpt_? -64.35 137.64 58.01 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 120.917 0.389 . . . . 65.43 111.368 -178.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.47 ' HA ' ' HG2' ' A' ' 58' ' ' GLU . 42.1 tt0 -133.53 150.51 51.67 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.975 0.417 . . . . 73.03 111.698 -178.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.434 ' O ' ' NZ ' ' A' ' 54' ' ' LYS . . . -124.89 175.06 7.54 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.049 -0.523 . . . . 72.13 110.96 177.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 41.2 p90 -148.47 153.09 38.0 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.098 0.475 . . . . 74.24 111.693 177.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 63.5 mt -101.66 135.51 37.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 116.107 -0.497 . . . . 74.33 111.557 -176.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.404 HG21 ' HD2' ' A' ' 31' ' ' ARG . 61.6 t -119.28 138.71 49.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-N 116.585 -0.28 . . . . 74.13 111.23 178.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 80.3 p -101.24 117.33 34.77 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 120.522 0.201 . . . . 73.24 111.506 178.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.499 HD13 ' NE2' ' A' ' 29' ' ' GLN . 42.8 pt -120.11 168.47 12.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-O 120.871 0.367 . . . . 72.53 111.614 178.573 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.408 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 47.4 mt-10 -116.12 126.87 54.3 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 116.357 -0.383 . . . . 62.12 111.193 177.233 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.425 ' HE3' HD12 ' A' ' 16' ' ' ILE . 95.1 mttt -130.4 166.63 20.06 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.781 0.325 . . . . 74.54 111.329 176.039 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.08 -136.88 12.94 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 121.186 -0.531 . . . . 53.45 113.164 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.422 ' HB2' ' HB2' ' A' ' 23' ' ' GLN . 75.5 mmtt -75.27 147.01 82.39 Favored Pre-proline 0 CA--C 1.539 0.52 0 O-C-N 122.437 -0.449 . . . . 74.21 111.332 179.093 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_exo -53.06 -46.89 30.73 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 122.781 2.32 . . . . 74.03 113.076 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -84.33 -52.91 3.42 Favored Glycine 0 CA--C 1.526 0.745 0 C-N-CA 121.118 -0.563 . . . . 73.24 112.825 175.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.422 ' HB2' ' HB2' ' A' ' 20' ' ' LYS . 32.9 mm-40 -83.81 77.27 9.92 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.119 0.485 . . . . 62.21 111.032 177.131 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.408 ' HB ' ' HB3' ' A' ' 17' ' ' GLU . 53.0 p -88.4 152.12 22.12 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.182 0.515 . . . . 65.43 111.745 179.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 58.0 t -114.84 129.4 71.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.033 -0.531 . . . . 62.32 109.976 174.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 31.2 m -75.36 115.58 15.17 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 120.697 0.284 . . . . 72.54 111.498 -179.298 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 77.9 m95 -106.58 132.3 52.74 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.053 0.454 . . . . 64.42 110.877 175.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -97.17 114.5 26.21 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.298 0.57 . . . . 64.01 111.138 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.735 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 95.5 mt-30 -97.46 122.29 40.33 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.678 -0.692 . . . . 73.03 111.723 -178.698 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.9 tp -83.24 109.87 17.59 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 120.788 0.328 . . . . 71.42 110.299 171.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.404 ' HD2' HG21 ' A' ' 14' ' ' VAL . 87.5 mtt-85 -121.41 158.63 27.9 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.053 0.454 . . . . 71.3 111.728 -178.635 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -146.01 146.49 31.01 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.241 -0.436 . . . . 73.21 111.211 178.259 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.495 ' HA ' ' HA ' ' A' ' 37' ' ' PRO . 3.9 m-20 -62.67 -22.6 66.59 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.058 0.456 . . . . 72.05 111.847 177.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.555 ' HA ' ' C ' ' A' ' 35' ' ' PRO . 35.3 m80 -125.82 141.39 39.18 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-N 116.365 -0.379 . . . . 75.55 110.52 179.064 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.555 ' C ' ' HA ' ' A' ' 34' ' ' HIS . 31.7 Cg_exo -59.93 -56.62 0.13 OUTLIER 'Cis proline' 0 N--CA 1.49 1.293 0 CA-C-N 119.662 0.915 . . . . 64.53 114.368 4.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -109.68 147.4 36.05 Favored Pre-proline 0 N--CA 1.471 0.576 0 O-C-N 122.231 -0.293 . . . . 73.43 111.229 179.011 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.495 ' HA ' ' HA ' ' A' ' 33' ' ' ASP . 75.9 Cg_exo -50.6 -31.13 30.62 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 122.948 2.432 . . . . 74.15 113.809 -179.344 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -98.74 20.87 12.25 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 120.839 0.352 . . . . 73.23 111.682 -179.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.4 t -72.42 107.4 4.97 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.019 0.437 . . . . 62.43 111.665 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 36.1 tp -92.48 109.82 21.22 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 116.114 -0.493 . . . . 64.52 111.027 177.051 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.8 mm -73.71 -54.61 14.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 116.115 -0.493 . . . . 74.23 111.747 -177.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 30.0 t -164.13 149.46 10.52 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 112.3 0.482 . . . . 71.12 112.3 -176.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.735 ' HG2' ' HG2' ' A' ' 29' ' ' GLN . 88.3 mt-10 -108.93 139.34 43.92 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.277 -0.419 . . . . 71.43 110.856 175.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 89.6 m-70 -138.77 140.32 26.97 Favored Pre-proline 0 CA--C 1.538 0.503 0 O-C-N 122.3 -0.25 . . . . 75.24 111.531 178.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -71.86 -24.13 21.47 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 122.458 2.105 . . . . 52.42 113.517 -179.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 30.4 p -113.07 143.7 43.89 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 121.085 0.469 . . . . 64.12 111.713 179.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -59.95 -34.69 73.6 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.053 -0.521 . . . . 73.4 111.9 177.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.424 HE21 ' C ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -56.5 -48.96 76.07 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 120.577 0.227 . . . . 72.31 110.894 179.829 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -58.66 -42.5 88.56 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.092 0.472 . . . . 63.13 111.199 177.424 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.71 -41.25 98.13 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.939 -0.573 . . . . 71.03 111.726 -179.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 67.1 mtt -65.06 -49.31 70.6 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 120.934 0.397 . . . . 55.52 111.004 177.379 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.547 ' HA ' ' HE2' ' A' ' 55' ' ' LYS . 11.2 m-20 -57.67 -41.29 81.24 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 121.056 0.455 . . . . 73.05 111.767 176.161 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.79 -43.42 93.26 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.953 0.406 . . . . 71.41 111.026 177.339 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.434 ' NZ ' ' O ' ' A' ' 11' ' ' ALA . 59.5 tttp -60.48 -52.43 65.23 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 116.316 -0.402 . . . . 62.14 111.781 178.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.547 ' HE2' ' HA ' ' A' ' 52' ' ' ASP . 63.7 pttt -64.81 -33.92 77.14 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 120.938 0.399 . . . . 75.13 111.567 -179.147 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 51.6 ttt180 -77.89 -26.29 49.08 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.948 0.404 . . . . 65.13 111.001 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -72.27 -43.26 64.55 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.05 0.452 . . . . 75.2 110.855 175.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.47 ' HG2' ' HA ' ' A' ' 10' ' ' GLU . 81.0 mt-10 -75.6 -33.64 60.56 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.935 -0.575 . . . . 73.4 111.849 179.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.5 m-20 -112.38 80.3 3.4 Favored Pre-proline 0 CA--C 1.544 0.739 0 CA-C-O 120.859 0.362 . . . . 71.32 111.162 175.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -81.04 131.98 8.18 Favored 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 122.426 2.084 . . . . 65.43 113.349 -176.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -92.01 12.69 21.03 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.965 -0.561 . . . . 73.15 110.599 178.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.0 tptt -153.85 161.01 42.39 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 116.325 -0.398 . . . . 70.43 110.696 -174.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 64.18 30.6 13.62 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-O 121.058 0.456 . . . . 75.52 112.09 175.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 96.5 mt -80.52 85.44 5.95 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.439 -0.346 . . . . 63.43 111.522 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 50.9 tt0 -63.81 107.85 1.31 Allowed 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.89 0.376 . . . . 52.44 110.49 175.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -81.55 154.49 26.21 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.984 0.421 . . . . 75.52 111.599 -176.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 20.4 p-80 -60.7 125.96 25.65 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.128 0.49 . . . . 72.32 111.888 -179.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 51.9 t-80 -75.93 138.54 41.08 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.285 -0.416 . . . . 73.21 110.689 178.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 48.3 t-80 -46.62 117.42 1.62 Allowed 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 120.965 0.412 . . . . 70.55 111.777 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 28.5 t60 -55.08 128.79 35.35 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 115.87 -0.605 . . . . 60.51 112.13 -176.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 . . . . . 0 C--O 1.251 1.148 0 CA-C-O 118.603 -0.713 . . . . 51.04 111.876 -179.848 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.3 mtt . . . . . 0 N--CA 1.489 1.488 0 CA-C-O 120.298 0.094 . . . . 73.22 110.888 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_exo -62.72 129.61 26.86 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 122.391 2.061 . . . . 75.14 112.583 177.262 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 68.8 p -68.97 96.34 0.77 Allowed 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.127 0.489 . . . . 51.0 110.971 177.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt 69.65 138.55 0.06 OUTLIER Pre-proline 0 CA--C 1.546 0.795 0 CA-C-N 115.761 -0.654 . . . . 74.21 110.882 -172.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_exo -44.52 128.44 8.31 Favored 'Trans proline' 0 CA--C 1.545 1.026 0 C-N-CA 123.309 2.673 . . . . 73.23 114.517 -172.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -68.61 149.63 74.04 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 122.519 2.146 . . . . 51.2 111.983 175.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -88.35 115.71 64.07 Favored Pre-proline 0 CA--C 1.542 0.665 0 N-CA-C 112.247 0.462 . . . . 73.25 112.247 -176.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -80.4 131.68 8.68 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 122.584 2.19 . . . . 74.02 111.958 172.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.42 ' HB2' ' O ' ' A' ' 57' ' ' TYR . 86.8 mtm180 -95.04 157.88 15.7 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 120.762 0.315 . . . . 75.35 111.295 -178.175 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -132.04 140.9 49.04 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 120.674 0.273 . . . . 71.13 111.318 -179.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.489 ' O ' ' HE2' ' A' ' 54' ' ' LYS . . . -140.95 162.31 35.77 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 120.87 0.367 . . . . 61.13 111.889 -179.337 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -151.63 149.63 29.35 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.097 0.475 . . . . 63.15 111.63 178.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 60.2 mt -101.56 134.49 41.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-N 116.35 -0.386 . . . . 73.42 111.895 -176.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.4 t -129.18 122.85 57.12 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 116.289 -0.414 . . . . 64.25 110.49 176.062 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 45.9 p -86.91 129.45 34.88 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 120.817 0.341 . . . . 74.1 111.579 -178.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.51 HD13 ' NE2' ' A' ' 29' ' ' GLN . 43.3 pt -113.33 175.07 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-O 120.955 0.407 . . . . 72.15 111.423 178.039 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.453 ' HB2' ' HB ' ' A' ' 24' ' ' THR . 9.4 pt-20 -118.16 129.83 55.74 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 121.231 0.538 . . . . 71.11 111.754 178.905 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -124.97 178.51 5.47 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 116.384 -0.371 . . . . 53.3 110.933 175.198 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 84.29 -136.79 15.11 Favored Glycine 0 CA--C 1.526 0.733 0 C-N-CA 120.927 -0.654 . . . . 74.52 114.414 172.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -74.63 150.0 86.38 Favored Pre-proline 0 CA--C 1.542 0.635 0 N-CA-C 112.053 0.39 . . . . 60.35 112.053 -173.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -58.68 -38.07 91.06 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 122.701 2.267 . . . . 53.41 112.957 179.087 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -92.3 -52.14 2.25 Favored Glycine 0 CA--C 1.524 0.642 0 C-N-CA 121.173 -0.537 . . . . 71.01 112.492 177.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -93.35 80.87 4.41 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.493 0.663 . . . . 73.35 110.818 177.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.453 ' HB ' ' HB2' ' A' ' 17' ' ' GLU . 71.7 p -80.75 151.17 28.96 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.457 -0.792 . . . . 61.2 111.816 179.602 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 53.7 t -108.54 136.46 44.15 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 CA-C-N 116.176 -0.466 . . . . 72.33 110.852 -179.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 67.6 m -85.28 120.07 26.35 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.068 0.461 . . . . 71.12 112.125 -175.468 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 61.6 m95 -119.66 131.62 55.48 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.047 0.451 . . . . 70.41 111.28 175.286 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -91.57 114.71 27.31 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 116.358 -0.383 . . . . 62.3 111.187 -178.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.55 ' HG2' ' HG3' ' A' ' 43' ' ' GLU . 72.4 mt-30 -95.82 120.31 35.86 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.562 -0.29 . . . . 73.41 111.571 177.687 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 55.2 tp -85.67 103.47 14.51 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.872 0.368 . . . . 51.34 110.426 173.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 55.4 mtt180 -106.5 141.85 37.12 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.464 -0.334 . . . . 71.23 110.325 178.169 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.415 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . . . -109.6 167.9 9.8 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.808 0.67 . . . . 74.45 112.808 -173.275 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -77.36 -54.48 6.41 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 115.631 -0.713 . . . . 71.13 111.98 -176.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.537 ' HB3' ' HA ' ' A' ' 35' ' ' PRO . 60.0 m-70 -123.43 164.05 30.59 Favored Pre-proline 0 CA--C 1.547 0.83 0 C-N-CA 122.597 0.359 . . . . 63.41 110.929 178.694 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.537 ' HA ' ' HB3' ' A' ' 34' ' ' HIS . 36.8 Cg_endo -64.76 -50.16 0.17 OUTLIER 'Cis proline' 0 C--N 1.362 1.278 0 C-N-CA 124.825 -0.906 . . . . 61.3 113.572 1.158 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -98.6 149.05 35.36 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 122.169 0.188 . . . . 75.03 110.548 173.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -67.87 -14.9 42.76 Favored 'Trans proline' 0 CA--C 1.537 0.64 0 C-N-CA 122.212 1.942 . . . . 73.03 112.502 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -88.61 1.05 55.72 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.98 -0.555 . . . . 71.15 111.874 -179.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 64.0 m -56.78 92.52 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 112.259 0.466 . . . . 72.23 112.259 -175.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 49.6 tp -83.88 107.23 16.14 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 116.265 -0.425 . . . . 72.52 110.508 176.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 45.0 mm -69.44 -53.7 23.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 116.312 -0.404 . . . . 64.13 111.641 -177.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.9 t -175.24 149.64 1.08 Allowed 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 121.038 0.447 . . . . 63.41 112.01 -179.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.55 ' HG3' ' HG2' ' A' ' 29' ' ' GLN . 2.2 mp0 -100.42 130.81 46.55 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 116.044 -0.525 . . . . 75.04 110.595 176.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -134.95 147.04 61.13 Favored Pre-proline 0 N--CA 1.473 0.69 0 CA-C-O 120.839 0.352 . . . . 62.14 111.584 -179.047 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.84 -18.59 19.04 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 122.825 2.35 . . . . 60.1 114.146 -174.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 30.6 p -116.88 151.67 36.1 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.093 0.473 . . . . 71.32 111.399 179.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.34 -36.46 74.24 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.302 -0.408 . . . . 74.2 111.824 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 24.6 tp60 -56.8 -42.02 78.79 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.529 -0.305 . . . . 61.02 111.767 -177.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -59.23 -51.07 71.55 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 121.094 0.473 . . . . 64.23 111.35 176.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.07 -37.74 88.52 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.982 -0.553 . . . . 73.32 111.689 -178.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 95.1 mmm -68.28 -44.83 74.68 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 116.511 -0.313 . . . . 62.44 111.642 178.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -61.74 -48.58 80.05 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.05 0.452 . . . . 55.15 110.701 178.022 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.37 -33.84 76.42 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 116.029 -0.532 . . . . 64.02 111.452 177.073 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.489 ' HE2' ' O ' ' A' ' 11' ' ' ALA . 65.7 tttm -61.82 -57.34 12.22 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.91 0.386 . . . . 73.22 110.503 175.793 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -55.77 -44.65 77.88 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.205 -0.452 . . . . 70.22 111.297 178.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -61.11 -44.49 97.27 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.092 -0.504 . . . . 74.21 111.526 178.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.42 ' O ' ' HB2' ' A' ' 9' ' ' ARG . 80.5 t80 -67.04 -38.9 86.67 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 116.373 -0.376 . . . . 75.12 111.375 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.464 ' HG3' ' O ' ' A' ' 54' ' ' LYS . 56.5 mt-10 -72.31 -5.41 35.95 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.371 0.508 . . . . 72.31 112.371 -176.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 68.4 m-20 -84.28 144.91 44.47 Favored Pre-proline 0 CA--C 1.544 0.733 0 O-C-N 122.375 -0.203 . . . . 54.32 110.891 169.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.77 84.45 1.03 Allowed 'Trans proline' 0 CA--C 1.542 0.897 0 C-N-CA 122.05 1.833 . . . . 64.23 111.517 172.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -65.44 -70.92 0.21 Allowed 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.967 0.729 . . . . 64.34 112.967 -174.182 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 15.5 tppt? -81.87 127.09 32.65 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 121.123 0.487 . . . . 73.11 111.995 -172.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -94.7 -177.61 4.26 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.081 -0.509 . . . . 71.13 110.991 174.197 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 8.7 mp 64.12 5.83 2.63 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.11 0.411 . . . . 73.4 112.11 -178.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 41.8 mm-40 -80.41 19.03 0.81 Allowed 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 112.518 0.562 . . . . 72.04 112.518 -179.309 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 58.7 m80 -77.04 -8.67 57.85 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.768 0.318 . . . . 60.03 111.106 176.256 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -75.32 34.83 0.11 Allowed 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 112.42 0.526 . . . . 72.33 112.42 177.056 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 -145.81 142.09 28.53 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 122.359 0.264 . . . . 74.5 110.553 -178.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -57.95 145.64 35.15 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 121.298 0.57 . . . . 73.34 112.157 -177.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 74.2 m80 -113.51 -165.61 1.01 Allowed 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 115.927 -0.579 . . . . 73.04 111.098 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 18.7 p80 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 119.199 -0.429 . . . . 72.44 111.34 175.713 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.7 mtm . . . . . 0 N--CA 1.492 1.626 0 N-CA-C 111.237 0.088 . . . . 75.14 111.237 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -63.03 116.38 3.54 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 122.537 2.158 . . . . 74.42 112.418 178.218 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 77.8 p -92.5 85.33 5.29 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.475 0.546 . . . . 71.42 112.475 -175.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.628 ' HA ' ' HE3' ' A' ' 4' ' ' LYS . 1.6 tpmt? -157.53 97.18 1.98 Allowed Pre-proline 0 CA--C 1.539 0.553 0 N-CA-C 111.979 0.362 . . . . 73.14 111.979 177.239 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -82.53 145.72 13.3 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 122.427 2.085 . . . . 64.53 112.149 172.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -72.25 160.54 46.89 Favored 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 122.205 1.937 . . . . 60.02 112.439 177.424 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 52.8 p90 -63.92 146.0 97.43 Favored Pre-proline 0 CA--C 1.544 0.744 0 CA-C-O 120.835 0.35 . . . . 73.13 111.9 -179.013 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -74.38 165.24 32.22 Favored 'Trans proline' 0 CA--C 1.541 0.835 0 C-N-CA 122.674 2.249 . . . . 71.11 113.238 178.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.486 ' HB2' ' HA ' ' A' ' 58' ' ' GLU . 0.1 OUTLIER -101.38 139.35 37.17 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 116.176 -0.466 . . . . 72.22 111.033 -179.24 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -151.66 117.53 5.48 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 116.525 -0.307 . . . . 74.14 110.439 176.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.465 ' HB2' ' CD2' ' A' ' 57' ' ' TYR . . . -117.96 167.03 11.81 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.626 0.602 . . . . 72.31 112.626 -174.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 28.5 p90 -147.88 150.47 34.17 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.533 -0.758 . . . . 63.53 110.883 178.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 55.1 mt -102.2 123.76 55.66 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-O 120.951 0.405 . . . . 73.15 111.339 -178.264 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.9 t -106.27 124.71 61.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-N 116.457 -0.338 . . . . 52.53 111.291 179.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 71.0 p -89.87 113.56 25.18 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.895 0.378 . . . . 54.02 111.285 178.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.447 HD12 ' HE3' ' A' ' 18' ' ' LYS . 30.0 pt -112.95 161.62 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-O 120.66 0.267 . . . . 62.23 111.337 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -124.14 130.07 51.92 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.165 0.507 . . . . 65.24 111.264 176.174 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.447 ' HE3' HD12 ' A' ' 16' ' ' ILE . 97.1 mttt -128.53 175.32 8.63 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 120.997 0.427 . . . . 72.34 111.131 177.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 90.52 -137.93 14.18 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 121.136 -0.554 . . . . 64.42 113.544 178.141 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -85.86 139.62 35.13 Favored Pre-proline 0 CA--C 1.541 0.599 0 C-N-CA 122.335 0.254 . . . . 75.03 111.503 -176.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -51.01 -45.33 37.12 Favored 'Trans proline' 0 CA--C 1.54 0.807 0 C-N-CA 122.533 2.155 . . . . 73.4 112.833 178.008 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.03 -58.1 6.46 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 120.8 -0.714 . . . . 24.41 112.158 175.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -98.98 82.92 2.82 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 121.033 0.444 . . . . 72.41 110.702 179.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 46.0 p -86.12 150.22 24.57 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 116.003 -0.544 . . . . 70.41 112.202 179.154 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 47.2 t -111.79 116.33 52.25 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 115.965 -0.561 . . . . 71.12 110.458 174.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 94.5 m -81.75 117.95 22.47 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 111.888 0.329 . . . . 71.33 111.888 -178.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -110.92 131.63 54.89 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 120.88 0.371 . . . . 74.21 111.351 178.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -90.68 114.35 26.64 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.833 0.349 . . . . 72.34 110.907 177.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.404 ' HB3' HD13 ' A' ' 40' ' ' LEU . 80.5 mt-30 -103.92 120.51 41.17 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.304 -0.407 . . . . 75.04 111.588 -179.17 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.7 tp -83.32 110.97 18.56 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 120.62 0.248 . . . . 73.44 110.816 174.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 31' ' ' ARG . 60.3 mtt180 -123.29 166.44 15.27 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.805 0.336 . . . . 71.31 110.798 177.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.411 ' O ' ' HA ' ' A' ' 37' ' ' PRO . . . -137.79 171.99 13.62 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.529 -0.305 . . . . 73.25 111.096 178.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -90.2 -14.64 33.04 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.308 0.575 . . . . 71.42 110.594 175.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.409 ' HA ' ' C ' ' A' ' 35' ' ' PRO . 92.2 m-70 -122.03 130.98 24.5 Favored Pre-proline 0 CA--C 1.546 0.795 0 CA-C-N 116.005 -0.543 . . . . 73.22 110.261 173.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.409 ' C ' ' HA ' ' A' ' 34' ' ' HIS . 24.7 Cg_exo -64.85 -44.71 0.38 Allowed 'Cis proline' 0 C--N 1.357 0.992 0 C-N-CA 124.479 -1.05 . . . . 64.33 113.9 0.539 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -137.58 153.64 74.41 Favored Pre-proline 0 N--CA 1.474 0.754 0 C-N-CA 122.04 0.136 . . . . 74.14 111.058 179.144 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.411 ' HA ' ' O ' ' A' ' 32' ' ' ALA . 88.7 Cg_exo -50.49 -27.28 18.42 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 122.75 2.3 . . . . 75.1 113.372 175.405 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -74.67 -23.82 58.7 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 116.131 -0.486 . . . . 54.04 112.014 178.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 53.0 m -57.52 105.86 0.28 Allowed 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.146 0.498 . . . . 74.3 112.288 -175.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.404 HD13 ' HB3' ' A' ' 29' ' ' GLN . 49.7 tp -95.3 124.91 39.58 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 115.86 -0.609 . . . . 62.51 111.229 178.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.1 mm -86.01 -50.88 13.93 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 CA-C-O 120.981 0.419 . . . . 73.41 111.784 -179.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 29.1 t -168.77 149.02 4.43 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 120.991 0.424 . . . . 64.12 112.09 -178.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -106.91 140.22 40.08 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.216 -0.447 . . . . 73.41 110.334 174.384 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . 0.419 ' HA ' ' HD3' ' A' ' 45' ' ' PRO . 85.4 m-70 -139.81 151.26 65.33 Favored Pre-proline 0 N--CA 1.471 0.597 0 CA-C-O 120.795 0.331 . . . . 53.22 111.784 179.005 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 44' ' ' HIS . 9.9 Cg_exo -69.77 -37.22 9.45 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 122.853 2.369 . . . . 72.11 112.798 177.757 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 41.9 p -105.35 148.62 26.87 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 121.104 0.478 . . . . 74.54 111.718 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.444 ' O ' ' HG3' ' A' ' 51' ' ' MET . . . -65.79 -31.31 72.21 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.304 -0.407 . . . . 73.44 111.195 176.002 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 25.7 tp60 -57.16 -49.19 76.74 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 116.485 -0.325 . . . . 73.52 111.571 179.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -58.78 -43.55 90.44 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.34 0.591 . . . . 73.22 110.982 175.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.89 -35.21 79.27 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.767 -0.651 . . . . 50.34 111.497 177.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . 0.497 ' O ' ' HG3' ' A' ' 55' ' ' LYS . 68.4 mtt -68.2 -42.61 79.61 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.477 -0.329 . . . . 44.04 111.226 176.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -56.99 -49.27 76.28 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.274 0.559 . . . . 70.33 110.507 176.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.02 -36.81 85.21 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 115.943 -0.572 . . . . 65.15 111.54 176.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.7 tttm -61.96 -42.88 99.62 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.078 0.466 . . . . 74.11 110.606 176.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.497 ' HG3' ' O ' ' A' ' 51' ' ' MET . 95.7 mttt -56.67 -55.1 38.3 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.426 0.632 . . . . 71.43 109.929 171.729 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.416 ' HG3' ' OD1' ' A' ' 61' ' ' ASP . 30.1 ttm-85 -60.23 -25.71 65.85 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 115.151 -0.931 . . . . 64.44 112.544 -174.197 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.465 ' CD2' ' HB2' ' A' ' 11' ' ' ALA . 90.1 t80 -76.68 -54.42 6.68 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 120.777 0.323 . . . . 61.14 111.505 176.454 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.486 ' HA ' ' HB2' ' A' ' 9' ' ' ARG . 39.2 mt-10 -74.59 -49.82 20.25 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.674 0.273 . . . . 65.43 111.246 -179.11 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -83.85 99.75 0.83 Allowed Pre-proline 0 CA--C 1.537 0.47 0 N-CA-C 109.227 -0.657 . . . . 73.42 109.227 168.035 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -78.9 107.79 2.3 Favored 'Trans proline' 0 CA--C 1.538 0.684 0 C-N-CA 122.306 2.004 . . . . 73.22 115.09 -165.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.416 ' OD1' ' HG3' ' A' ' 56' ' ' ARG . 1.8 m-20 -68.46 79.03 0.27 Allowed 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 108.383 -0.969 . . . . 75.42 108.383 161.366 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 49.1 pttt -48.7 -50.17 34.62 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.178 1.177 . . . . 73.12 114.178 -167.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -99.22 127.36 45.19 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.389 0.614 . . . . 61.31 112.398 -175.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 88.8 mt -77.74 -179.41 5.92 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.097 -0.501 . . . . 61.13 111.079 175.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -59.63 152.59 21.99 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.137 0.494 . . . . 73.55 112.066 -177.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 9.5 p80 -124.19 107.79 11.6 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.995 -0.548 . . . . 61.43 110.76 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -83.29 129.74 35.02 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 111.979 0.363 . . . . 75.42 111.979 -177.56 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 59.3 t-80 -137.56 125.26 22.36 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.52 -0.309 . . . . 73.31 110.919 179.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 64.4 m80 -59.65 139.73 56.98 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 116.34 -0.391 . . . . 73.13 111.68 -179.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 29.3 p-80 -115.45 151.83 34.04 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 120.784 0.326 . . . . 74.21 111.771 -178.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 53.3 p-80 . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.594 -0.717 . . . . 71.11 111.597 171.538 . . . . . . . . 0 0 . 1 stop_ save_