data_2mdz_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 2mdz _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.477 0.889 0 N-CA-C 116.792 2.145 . . . . 74.349999999999994 116.792 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -45.93 106.6 0.08 Allowed 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.017 1.727 . . . . 71.450000000000003 112.714 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 54.57 -5.32 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 128.525 2.73 . . . . 73.510000000000005 116.392 -171.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 48.7 mttt -58.0 -26.97 63.07 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 127.071 2.148 . . . . 73.430000000000007 113.952 -168.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -63.73 -9.42 14.21 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 114.106 1.15 . . . . 74.530000000000001 114.106 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -132.92 39.09 3.34 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 119.336 0.971 . . . . 62.420000000000002 110.143 173.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -146.44 -65.1 0.29 Allowed 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 107.057 -1.46 . . . . 65.109999999999999 107.057 169.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -67.04 158.05 31.99 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 127.052 2.141 . . . . 61.219999999999999 111.004 -172.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -89.04 -57.75 2.79 Favored 'General case' 0 C--O 1.223 -0.311 0 N-CA-C 108.811 -0.811 . . . . 73.540000000000006 108.811 163.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -49.58 -50.96 40.38 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.701 1.0 . . . . 74.409999999999997 113.701 -162.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 15.0 mt -76.43 -26.56 55.6 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 113.509 0.929 . . . . 75.129999999999995 113.509 -178.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -65.69 -51.35 60.11 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.975 1.31 . . . . 72.510000000000005 107.591 175.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -44.4 -49.24 9.76 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 128.936 2.895 . . . . 73.450000000000003 111.359 -171.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.1 pttp -53.7 -51.61 62.72 Favored 'General case' 0 C--O 1.233 0.234 0 O-C-N 121.258 -0.901 . . . . 62.539999999999999 111.984 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.85 -30.4 50.97 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 113.283 0.845 . . . . 61.450000000000003 113.283 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -53.56 -41.25 66.3 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.704 1.602 . . . . 73.150000000000006 108.692 176.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.18 -86.03 0.32 Allowed 'General case' 0 C--N 1.345 0.389 0 CA-C-O 118.674 -0.679 . . . . 62.240000000000002 109.273 178.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 48.61 -24.98 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.201 1 C-N-CA 132.121 4.168 . . . . 74.439999999999998 118.559 179.02 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.99 -36.81 13.37 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 128.516 2.726 . . . . 75.510000000000005 114.202 -167.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -107.67 -19.65 13.48 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.159 0.984 . . . . 72.530000000000001 110.155 -174.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.73 -32.16 71.44 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.973 1.309 . . . . 73.129999999999995 110.969 -176.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -90.17 -5.71 56.14 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.912 0.885 . . . . 75.239999999999995 112.76 -175.288 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 13.1 mt -81.19 -28.44 34.93 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 119.383 0.992 . . . . 60.340000000000003 113.464 -170.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -69.92 -34.32 71.18 Favored Glycine 0 C--O 1.223 -0.572 0 N-CA-C 109.089 -1.604 . . . . 62.219999999999999 109.089 169.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -65.2 -19.29 65.9 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 118.628 1.214 . . . . 62.43 112.295 176.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 32.1 t90 -77.13 -66.21 0.85 Allowed 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 125.594 1.558 . . . . 74.319999999999993 109.363 167.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.41 -31.18 61.65 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 118.407 -0.806 . . . . 61.119999999999997 112.805 -174.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -46.76 -63.29 1.06 Allowed 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 125.656 1.582 . . . . 75.120000000000005 110.567 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -55.63 -44.86 86.18 Favored Glycine 0 C--N 1.336 0.535 0 N-CA-C 111.235 -0.746 . . . . 55.030000000000001 111.235 -178.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 28.4 mt -62.85 -36.03 81.91 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.491 0.716 . . . . 73.439999999999998 111.814 -177.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 77.8 mt -82.7 1.17 39.96 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.114 1.766 . . . . 62.109999999999999 112.495 176.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 84.24 12.18 76.74 Favored Glycine 0 CA--C 1.527 0.797 0 C-N-CA 125.202 1.382 . . . . 74.450000000000003 113.915 177.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -87.78 133.07 33.94 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.852 1.261 . . . . 75.209999999999994 107.969 -177.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 33.0 p -140.84 167.84 21.22 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 125.966 1.706 . . . . 61.219999999999999 107.883 -179.025 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 56.19 -134.69 50.43 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 111.476 -0.65 . . . . 55.210000000000001 111.476 175.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -68.3 -26.96 65.9 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 117.59 0.695 . . . . 74.430000000000007 111.542 178.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.24 -35.56 77.57 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 123.606 0.762 . . . . 73.239999999999995 110.474 176.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.61 -48.02 24.05 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.178 -0.675 . . . . 63.229999999999997 109.178 173.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -62.49 -47.57 83.37 Favored 'General case' 0 C--O 1.226 -0.141 0 N-CA-C 109.846 -0.427 . . . . 73.25 109.846 -168.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.87 -42.83 84.96 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.454 1.102 . . . . 73.450000000000003 110.511 -177.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 31.6 t80 -58.32 -46.33 86.4 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 122.669 0.387 . . . . 72.109999999999999 110.274 175.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.17 -36.44 68.33 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 121.465 -0.772 . . . . 72.310000000000002 111.75 178.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 44.2 mt -75.17 10.14 1.68 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.292 1.437 . . . . 65.420000000000002 112.259 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.7 t -133.68 34.52 3.42 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 120.098 1.317 . . . . 72.430000000000007 111.248 169.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 81.4 t -132.18 85.33 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 O-C-N 121.081 -1.012 . . . . 72.120000000000005 108.853 177.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 16.4 t -151.1 122.54 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 124.615 1.166 . . . . 64.349999999999994 109.5 170.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 6.5 t -149.17 -38.97 0.15 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.202 1.001 . . . . 75.439999999999998 111.445 162.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.5 m . . . . . 0 CA--C 1.542 0.64 0 C-N-CA 126.312 1.845 . . . . 73.239999999999995 112.958 -176.125 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.465 0.298 0 CA-C-O 118.777 -0.63 . . . . 74.329999999999998 110.225 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 72.4 t -57.07 -43.81 81.89 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 CA-C-N 120.304 1.411 . . . . 74.239999999999995 111.342 -173.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -56.91 -53.97 51.89 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.694 1.198 . . . . 54.049999999999997 109.185 175.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 26.8 ttm-85 -53.83 -42.18 68.19 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 125.679 1.591 . . . . 74.150000000000006 112.067 178.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -75.25 -47.61 27.25 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 118.322 0.51 . . . . 74.329999999999998 109.749 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 16.3 mt -59.55 -44.33 93.27 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 117.689 -1.148 . . . . 74.510000000000005 110.444 -179.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.22 -18.79 64.86 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.988 1.267 . . . . 73.109999999999999 112.364 -177.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -87.4 -52.67 5.24 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.513 1.125 . . . . 62.240000000000002 110.371 170.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -60.18 -48.08 83.25 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 121.044 -1.035 . . . . 72.129999999999995 110.012 -174.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.8 tp -91.32 15.62 11.71 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 130.348 3.459 . . . . 75.540000000000006 111.577 -175.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -55.87 109.87 0.64 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.488 1.515 . . . . 72.319999999999993 109.88 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 110.05 -4.38 30.25 Favored Glycine 0 CA--C 1.528 0.847 0 C-N-CA 125.425 1.488 . . . . 62.140000000000001 112.511 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -133.05 -5.76 3.08 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.046 1.338 . . . . 73.319999999999993 113.275 -171.463 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -146.33 130.07 17.08 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.507 0.67 . . . . 52.539999999999999 110.602 169.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.39 161.13 25.88 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 126.262 1.825 . . . . 74.409999999999997 107.616 164.498 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -58.54 -45.13 89.56 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.973 0.892 . . . . 71.310000000000002 109.35 175.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -70.52 -27.89 64.53 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.689 0.796 . . . . 74.120000000000005 112.373 179.294 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 47.6 m -68.28 -36.19 79.0 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.665 0.786 . . . . 73.349999999999994 110.209 175.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 10.4 mt -69.65 -60.83 2.05 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 CA-C-N 119.937 1.244 . . . . 62.439999999999998 108.566 169.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.55 -18.5 65.4 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 114.173 1.175 . . . . 73.120000000000005 114.173 -164.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -91.91 -31.27 15.73 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 119.208 0.913 . . . . 64.329999999999998 110.419 178.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -64.34 -66.86 0.49 Allowed 'General case' 0 CA--C 1.514 -0.419 0 CA-C-N 119.21 0.914 . . . . 71.519999999999996 111.028 -173.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 5.3 ptt? -66.66 -14.91 63.06 Favored 'General case' 0 N--CA 1.462 0.162 0 N-CA-C 113.592 0.96 . . . . 71.420000000000002 113.592 -162.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 37.4 t -45.67 -49.2 4.29 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 C-N-CA 127.019 2.128 . . . . 75.120000000000005 111.794 166.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -82.0 -21.26 37.16 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 119.502 1.046 . . . . 72.510000000000005 111.838 -169.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 7.0 mp -66.47 -7.37 19.19 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 126.855 2.062 . . . . 75.239999999999995 111.454 -168.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 30.3 mtp180 -54.39 -42.17 70.08 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 122.95 0.5 . . . . 71.340000000000003 110.408 168.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.3 -52.59 8.93 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.617 0.767 . . . . 71.120000000000005 110.293 174.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.0 m -52.84 -29.59 28.77 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.048 0.939 . . . . 74.530000000000001 112.039 -177.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.18 -50.87 68.25 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 125.647 1.579 . . . . 73.540000000000006 114.135 177.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 9.3 ptt180 -75.47 -41.56 55.29 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 109.566 -0.531 . . . . 74.230000000000004 109.566 178.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -48.78 -55.87 10.28 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 126.687 1.995 . . . . 61.32 111.711 177.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -64.28 -25.39 68.03 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.792 0.724 . . . . 74.25 112.523 -174.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.8 mm -77.36 -44.58 30.26 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.254 0 O-C-N 120.707 -1.246 . . . . 72.230000000000004 109.452 176.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 91.8 mt -71.67 -10.46 13.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 C-N-CA 124.844 1.258 . . . . 75.510000000000005 110.501 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 10.7 t -86.72 -56.14 3.54 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.926 1.29 . . . . 63.130000000000003 108.65 170.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 66.8 mt-10 -101.61 56.87 0.83 Allowed 'General case' 0 C--O 1.236 0.385 0 N-CA-C 106.881 -1.525 . . . . 65.430000000000007 106.881 -168.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 83.6 mt . . . . . 0 C--O 1.25 1.107 0 C-N-CA 123.816 0.847 . . . . 73.439999999999998 109.038 -172.202 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . 0.327 1.1 p-80 . . . . . 0 CA--C 1.546 0.801 0 N-CA-C 113.637 0.976 . . . . 73.400000000000006 113.637 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 44.75 90.38 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.358 1.863 . . . . 70.439999999999998 113.988 177.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 60.69 -3.54 0.14 Allowed 'General case' 0 C--O 1.237 0.397 0 C-N-CA 128.2 2.6 . . . . 74.540000000000006 115.786 -166.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -60.56 -13.73 15.8 Favored 'General case' 0 C--O 1.218 -0.594 0 O-C-N 120.488 -1.382 . . . . 74.340000000000003 112.507 159.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -48.6 -41.05 29.61 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.868 1.213 . . . . 72.510000000000005 112.198 163.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -82.54 -41.83 19.15 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 118.401 0.546 . . . . 61.409999999999997 111.217 174.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -72.41 -44.63 62.18 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.245 1.018 . . . . 63.539999999999999 112.704 -167.507 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -120.08 105.62 11.19 Favored 'General case' 0 CA--C 1.517 -0.316 0 C-N-CA 127.088 2.155 . . . . 62.43 105.59 -175.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.36 -14.52 56.81 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 113.087 0.773 . . . . 51.200000000000003 113.087 -172.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -64.11 -35.72 81.67 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.952 0.901 . . . . 71.209999999999994 109.683 175.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.8 mt -70.85 -37.69 73.13 Favored 'General case' 0 C--O 1.234 0.265 0 O-C-N 120.881 -1.137 . . . . 74.409999999999997 111.086 174.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -60.01 -50.5 73.51 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 118.946 -0.55 . . . . 74.120000000000005 110.153 172.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -52.61 -56.91 12.08 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 126.103 1.761 . . . . 74.209999999999994 109.68 -178.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -45.12 -49.14 12.02 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 124.731 1.212 . . . . 74.340000000000003 111.407 -179.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -76.82 -40.18 48.83 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.055 0.761 . . . . 62.119999999999997 113.055 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -66.78 -19.03 65.66 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.063 -1.023 . . . . 74.120000000000005 110.256 178.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -90.15 13.88 13.93 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 127.656 2.382 . . . . 72.430000000000007 112.289 170.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.6 mmt85 -108.77 -30.37 8.2 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 120.065 1.302 . . . . 71.510000000000005 112.411 172.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.3 ptt85 -57.43 -15.95 8.13 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 115.582 1.697 . . . . 65.510000000000005 115.582 -169.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -121.3 -15.09 8.2 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 126.218 1.807 . . . . 74.140000000000001 111.168 -178.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.62 -22.56 65.33 Favored 'General case' 0 N--CA 1.471 0.591 0 O-C-N 120.698 -1.251 . . . . 74.239999999999995 111.64 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -106.17 -14.17 15.22 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.575 1.55 . . . . 72.340000000000003 114.128 -171.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.52 -34.35 17.01 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 125.422 1.489 . . . . 73.329999999999998 113.355 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -61.81 -24.34 64.42 Favored Glycine 0 CA--C 1.526 0.732 0 CA-C-O 118.386 -1.23 . . . . 63.140000000000001 113.379 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -65.24 -31.0 71.93 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.687 2.243 . . . . 75.239999999999995 112.488 -177.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . 0.434 ' CD1' ' HE3' ' A' ' 88' ' ' LYS . 22.9 t90 -63.8 -72.37 0.14 Allowed 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 125.6 1.56 . . . . 73.239999999999995 108.492 175.02 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.47 -17.13 63.56 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 124.916 1.287 . . . . 71.329999999999998 113.917 -176.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -54.34 -57.41 11.37 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 119.352 0.978 . . . . 60.350000000000001 109.066 173.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.65 -38.25 93.49 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 111.347 -0.701 . . . . 75.109999999999999 111.347 -179.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.5 mp -61.22 -38.37 86.37 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.495 -1.003 . . . . 74.409999999999997 111.064 178.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 95.6 mt -89.14 5.84 42.76 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 127.04 2.136 . . . . 75.319999999999993 113.068 176.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 74.54 9.65 82.18 Favored Glycine 0 CA--C 1.534 1.226 0 C-N-CA 125.388 1.47 . . . . 74.230000000000004 114.424 177.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.9 mttt -85.82 137.96 32.4 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 119.341 1.57 . . . . 73.25 106.983 173.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 37.0 p -138.85 -178.0 5.13 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.664 -0.865 . . . . 75.230000000000004 108.664 168.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 47.47 -117.28 3.22 Favored Glycine 0 CA--C 1.524 0.619 0 C-N-CA 125.288 1.423 . . . . 60.43 112.941 174.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -82.65 -16.59 47.69 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.015 1.726 . . . . 75.140000000000001 112.686 -172.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -76.14 -48.8 19.27 Favored 'General case' 0 CA--C 1.512 -0.486 0 O-C-N 120.912 -1.118 . . . . 62.240000000000002 109.016 169.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -56.81 -42.99 80.51 Favored 'General case' 0 N--CA 1.445 -0.72 0 N-CA-C 108.748 -0.834 . . . . 62.240000000000002 108.748 175.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.3 ttm-85 -51.42 -47.72 62.91 Favored 'General case' 0 N--CA 1.437 -1.107 0 N-CA-C 112.96 0.726 . . . . 75.329999999999998 112.96 173.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.69 -49.25 66.69 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 118.091 0.405 . . . . 73.450000000000003 110.435 -178.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -52.34 -44.93 65.45 Favored 'General case' 0 N--CA 1.457 -0.093 0 C-N-CA 123.435 0.694 . . . . 72.230000000000004 110.696 175.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.46 -30.82 63.36 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 118.421 -0.8 . . . . 60.340000000000003 112.623 -174.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 18.0 mt -75.5 -3.89 36.63 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.2 1.0 . . . . 75.319999999999993 111.861 -175.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.6 t -133.3 49.27 2.31 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.589 1.156 . . . . 63.149999999999999 109.575 179.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 2.0 t -127.98 12.98 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 O-C-N 120.857 -1.152 . . . . 73.510000000000005 110.669 173.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 4.5 m -74.24 53.21 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 125.938 1.695 . . . . 74.450000000000003 112.144 176.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.1 t -79.76 60.82 3.52 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.275 1.43 . . . . 65.140000000000001 108.912 178.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.3 m . . . . . 0 C--O 1.238 0.497 0 N-CA-C 109.919 -0.4 . . . . 71.310000000000002 109.919 169.602 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.464 0.273 0 N-CA-C 112.431 0.53 . . . . 64.25 112.431 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 78.3 t -57.99 -43.62 85.25 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 123.823 0.849 . . . . 71.209999999999994 110.315 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -76.27 -32.51 58.85 Favored 'General case' 0 C--O 1.233 0.224 0 O-C-N 121.118 -0.989 . . . . 74.109999999999999 109.546 -179.084 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -50.56 -50.38 53.71 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 125.071 1.348 . . . . 73.209999999999994 112.089 -172.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -71.7 -23.6 61.67 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 119.301 0.955 . . . . 70.510000000000005 111.515 -171.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 9.5 mt -74.75 -61.31 1.92 Allowed 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.25 -1.019 . . . . 74.219999999999999 108.25 168.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.12 -37.6 64.5 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.293 1.037 . . . . 54.140000000000001 113.09 -173.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.18 -38.79 87.78 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 123.29 0.636 . . . . 74.209999999999994 111.491 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -74.52 -56.88 4.35 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 122.858 1.313 . . . . 73.230000000000004 108.43 175.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.4 tp -77.15 16.67 0.54 Allowed 'General case' 0 CA--C 1.534 0.329 1 C-N-CA 131.836 4.054 . . . . 64.209999999999994 113.963 -168.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 55.6 tt0 -52.4 122.33 8.6 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 127.14 2.176 . . . . 70.540000000000006 110.464 -174.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 102.27 -15.43 56.3 Favored Glycine 0 CA--C 1.53 1.01 0 C-N-CA 127.249 2.357 . . . . 73.140000000000001 113.034 178.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 35.3 mtmt -126.06 -5.46 6.75 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 119.276 1.538 . . . . 75.030000000000001 114.88 -158.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -154.74 126.43 7.52 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 120.57 1.532 . . . . 73.349999999999994 110.026 171.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.14 163.52 27.77 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.72 1.208 . . . . 74.319999999999993 110.573 -178.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 77.0 mt-10 -48.56 -59.22 3.68 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 124.642 1.177 . . . . 73.340000000000003 110.433 170.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -68.29 -20.73 64.78 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.813 -0.631 . . . . 64.140000000000001 112.114 -175.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 18.8 m -80.16 -40.71 26.77 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.788 1.635 . . . . 71.030000000000001 110.032 176.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 77.4 mt -59.71 -56.56 16.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 C-N-CA 124.788 1.235 . . . . 74.120000000000005 107.689 173.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.81 -47.3 80.57 Favored 'General case' 0 C--N 1.341 0.199 0 O-C-N 123.614 0.571 . . . . 74.540000000000006 110.998 -174.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.54 -43.27 89.2 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.273 0.629 . . . . 72.310000000000002 111.559 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.434 ' HE3' ' CD1' ' A' ' 36' ' ' TRP . 12.3 tptp -66.7 -39.03 87.89 Favored 'General case' 0 C--O 1.223 -0.29 0 O-C-N 121.265 -0.897 . . . . 74.019999999999996 111.216 -176.003 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 18.0 ptp -72.14 -31.4 65.94 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 119.073 -1.051 . . . . 63.5 112.369 -174.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 71.9 t -49.97 -47.15 23.69 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 123.47 0.708 . . . . 65.109999999999999 109.233 167.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -50.58 -45.41 57.2 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.136 1.374 . . . . 74.319999999999993 113.501 -163.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -75.6 11.89 1.18 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.213 1.19 . . . . 73.239999999999995 114.213 -173.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 3.3 tpt85 -49.91 -53.07 28.38 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.844 1.258 . . . . 72.400000000000006 111.3 -178.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -63.01 -50.28 71.31 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 123.823 0.849 . . . . 73.409999999999997 109.999 175.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.8 m -50.18 -45.65 53.66 Favored 'General case' 0 C--N 1.333 -0.125 0 C-N-CA 125.912 1.685 . . . . 74.319999999999993 110.147 -173.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -54.63 -40.65 69.15 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 124.305 1.042 . . . . 71.150000000000006 112.676 -177.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -81.68 -40.32 23.01 Favored 'General case' 0 C--N 1.341 0.202 0 CA-C-O 117.463 -1.256 . . . . 74.239999999999995 111.929 172.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -52.35 -41.78 63.34 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 119.391 0.996 . . . . 73.439999999999998 110.834 -179.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 -56.27 -50.14 72.21 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 118.966 0.803 . . . . 73.120000000000005 112.024 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 43.8 mm -68.07 -42.74 85.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 123.353 0.661 . . . . 73.430000000000007 110.26 -175.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 24.1 mt -66.38 -21.14 28.25 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 N-CA-C 109.036 -0.727 . . . . 74.439999999999998 109.036 177.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 33.8 t -89.54 -6.07 56.68 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.584 1.154 . . . . 70.019999999999996 111.783 177.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -122.72 35.79 4.8 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 125.818 1.647 . . . . 72.030000000000001 108.812 -171.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 21.8 mm . . . . . 0 C--O 1.252 1.19 0 N-CA-C 107.46 -1.311 . . . . 74.209999999999994 107.46 172.687 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.54 0.573 0 N-CA-C 108.514 -0.921 . . . . 64.049999999999997 108.514 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 64.6 95.17 0.05 Allowed 'General case' 0 C--O 1.235 0.341 0 C-N-CA 126.87 2.068 . . . . 73.049999999999997 111.063 174.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 57.71 0.21 0.1 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 127.729 2.412 . . . . 71.019999999999996 114.21 -166.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 18.5 mmtm -66.33 -16.73 64.29 Favored 'General case' 0 C--O 1.221 -0.433 0 O-C-N 120.194 -1.566 . . . . 73.439999999999998 112.988 -178.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -50.22 -28.33 7.4 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 125.612 1.565 . . . . 72.409999999999997 114.826 173.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.95 -15.67 63.71 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.632 0.604 . . . . 71.439999999999998 112.632 178.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 64.4 t-80 -130.28 141.57 50.6 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 126.138 1.775 . . . . 74.120000000000005 108.129 -164.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 59.51 -175.84 0.1 Allowed 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.839 1.256 . . . . 74.150000000000006 109.532 -160.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -119.37 -19.07 8.39 Favored 'General case' 0 C--O 1.225 -0.21 0 O-C-N 121.146 -0.971 . . . . 74.349999999999994 111.883 164.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.88 -41.86 83.4 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.613 0.765 . . . . 74.120000000000005 110.516 -170.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.0 mt -71.96 -46.4 57.54 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 108.672 -0.862 . . . . 71.25 108.672 -175.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -61.45 -43.84 98.16 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 124.538 1.135 . . . . 73.439999999999998 111.977 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -58.79 -36.9 75.19 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 124.185 0.994 . . . . 74.140000000000001 111.014 -177.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.06 -29.65 44.97 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.821 0.848 . . . . 72.340000000000003 111.498 178.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -74.53 -54.06 8.24 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 124.717 1.207 . . . . 74.150000000000006 112.049 178.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.8 tp10 -55.87 -32.97 64.15 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.588 -0.695 . . . . 72.329999999999998 109.886 174.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -75.34 8.56 2.66 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.513 1.125 . . . . 70.349999999999994 112.31 178.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.2 mmt180 -87.91 -23.71 23.84 Favored 'General case' 0 C--O 1.231 0.111 0 O-C-N 120.656 -1.278 . . . . 74.209999999999994 111.142 166.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.3 ptt180 -67.19 -23.0 65.71 Favored 'General case' 0 C--N 1.344 0.364 0 CA-C-N 120.976 1.716 . . . . 74.430000000000007 115.185 -149.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -110.45 -12.33 14.4 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-O 118.222 -0.894 . . . . 73.420000000000002 112.02 170.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.46 -55.01 31.74 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 125.057 1.343 . . . . 74.0 110.405 171.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -66.22 -9.61 33.84 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.859 1.059 . . . . 74.129999999999995 113.859 -172.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.7 tp -56.33 -31.93 64.2 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 126.946 2.098 . . . . 70.019999999999996 111.291 171.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.49 -31.71 81.68 Favored Glycine 0 CA--C 1.532 1.141 0 O-C-N 121.252 -0.905 . . . . 74.430000000000007 112.325 176.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -68.86 -26.99 65.42 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.797 1.298 . . . . 74.239999999999995 110.768 -178.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 20.6 t90 -68.6 -65.26 0.72 Allowed 'General case' 0 N--CA 1.462 0.144 0 C-N-CA 124.87 1.268 . . . . 74.340000000000003 109.152 173.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.18 -41.36 71.83 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 118.765 -0.636 . . . . 63.119999999999997 111.878 -174.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -44.87 -60.8 1.87 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.523 1.129 . . . . 65.010000000000005 112.92 -178.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.65 -30.4 77.52 Favored Glycine 0 CA--C 1.528 0.898 0 CA-C-N 118.577 0.626 . . . . 72.340000000000003 112.58 -175.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 56.9 mt -68.13 -41.51 81.58 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.131 0.972 . . . . 72.129999999999995 110.012 175.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.8 mp -69.96 -1.84 10.81 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 126.387 1.875 . . . . 72.329999999999998 113.72 168.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 74.5 4.22 69.08 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 125.54 1.543 . . . . 72.310000000000002 113.679 -179.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 53.1 mttm -76.12 128.75 35.61 Favored 'General case' 0 CA--C 1.524 -0.033 0 CA-C-N 119.875 1.838 . . . . 71.430000000000007 106.856 170.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 p -134.72 166.29 23.29 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 123.823 0.849 . . . . 71.230000000000004 109.066 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 55.21 -129.74 46.42 Favored Glycine 0 CA--C 1.525 0.663 0 C-N-CA 123.667 0.651 . . . . 74.439999999999998 112.057 176.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -61.1 -36.2 79.05 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 124.645 1.178 . . . . 72.430000000000007 111.005 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.42 -37.33 86.88 Favored 'General case' 0 N--CA 1.465 0.303 0 O-C-N 121.179 -0.95 . . . . 70.319999999999993 111.296 177.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.44 -43.43 63.8 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 123.112 0.565 . . . . 74.310000000000002 109.858 177.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.5 ptp180 -65.6 -46.09 80.66 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 109.279 -0.637 . . . . 65.430000000000007 109.279 -173.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.25 -36.6 84.19 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.681 1.192 . . . . 62.310000000000002 111.542 -178.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -65.23 -45.8 83.18 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.646 0.779 . . . . 74.409999999999997 110.588 173.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -69.36 -14.95 63.2 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 114.211 1.189 . . . . 71.019999999999996 114.211 -174.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 64.3 mt -58.44 -20.54 45.77 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 119.432 1.014 . . . . 73.439999999999998 112.759 -176.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.0 t -135.32 32.12 3.13 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.352 1.061 . . . . 71.400000000000006 110.586 -168.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 95.0 t -113.61 99.57 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 N-CA-C 106.446 -1.687 . . . . 74.310000000000002 106.446 177.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 9.6 p -156.12 135.88 3.99 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 N-CA-C 107.089 -1.449 . . . . 71.230000000000004 107.089 164.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.7 t 177.21 155.77 0.29 Allowed 'General case' 0 C--O 1.235 0.341 0 C-N-CA 128.353 2.661 . . . . 74.409999999999997 105.477 172.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.2 p . . . . . 0 C--O 1.237 0.402 0 CA-C-N 119.012 0.824 . . . . 73.099999999999994 108.966 167.401 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.546 0.823 0 N-CA-C 116.195 1.924 . . . . 70.329999999999998 116.195 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 2.1 p -70.12 -57.49 7.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 C-N-CA 126.923 2.089 . . . . 71.299999999999997 109.388 174.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -63.48 -18.54 63.89 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 124.949 1.3 . . . . 74.430000000000007 112.282 -179.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -44.91 -46.81 11.14 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 119.967 1.258 . . . . 74.310000000000002 112.431 -172.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.1 mppt? -78.85 -1.4 34.82 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.163 0.985 . . . . 74.140000000000001 112.918 -174.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 72.1 mt -104.51 -54.33 2.54 Favored 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 126.265 1.826 . . . . 70.420000000000002 108.285 168.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.33 -54.15 44.21 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 126.133 1.773 . . . . 72.319999999999993 111.352 -170.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -76.18 -19.31 58.56 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 111.881 0.326 . . . . 74.430000000000007 111.881 -177.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.37 -50.79 35.21 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 108.007 -1.109 . . . . 71.030000000000001 108.007 173.748 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 79.9 mt -80.62 43.35 0.66 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 129.144 2.978 . . . . 71.310000000000002 110.573 175.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -52.56 104.25 0.09 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.729 1.611 . . . . 74.230000000000004 109.76 177.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 69.03 14.15 67.79 Favored Glycine 0 CA--C 1.533 1.179 0 CA-C-O 118.799 -1.001 . . . . 63.020000000000003 113.844 -177.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 25.0 mtmm -113.46 -11.19 13.13 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.287 1.543 . . . . 74.409999999999997 112.055 178.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -148.69 138.93 22.42 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.204 -1.035 . . . . 71.129999999999995 108.204 165.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.41 161.82 25.9 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 125.787 1.635 . . . . 72.439999999999998 109.407 176.386 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 85.0 mt-10 -59.83 -46.31 89.66 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.46 0.704 . . . . 74.439999999999998 110.091 175.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -74.01 -15.18 61.1 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 121.379 -0.826 . . . . 71.430000000000007 111.311 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.6 m -74.46 -32.88 62.74 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 117.785 -1.102 . . . . 61.43 109.975 171.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 11.7 mt -58.5 -60.31 2.47 Favored 'Isoleucine or valine' 0 C--O 1.239 0.516 0 CA-C-N 120.624 1.557 . . . . 74.400000000000006 108.874 177.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -53.37 -39.73 64.41 Favored 'General case' 0 C--N 1.343 0.314 0 O-C-N 124.679 1.237 . . . . 72.0 109.978 -178.68 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.25 -45.51 76.49 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 119.625 -0.226 . . . . 53.200000000000003 110.567 -176.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.36 -38.31 71.59 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.592 0.589 . . . . 74.340000000000003 112.592 -163.019 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 33.1 mtt -66.93 -0.73 3.31 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.251 -0.905 . . . . 72.230000000000004 112.684 176.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 46.6 t -120.58 -29.15 1.76 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 C-N-CA 126.482 1.913 . . . . 63.039999999999999 110.132 -178.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -55.67 -48.66 74.69 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.368 1.467 . . . . 74.430000000000007 109.007 175.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 15.3 mt -77.43 4.51 10.8 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.013 1.116 . . . . 54.310000000000002 114.013 -176.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 63.9 ttt180 -66.28 -20.64 66.16 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 120.654 -1.279 . . . . 70.109999999999999 113.543 -166.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -88.27 -46.19 9.42 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 119.658 1.117 . . . . 65.430000000000007 110.355 170.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 52.4 m -50.38 -36.19 31.51 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.261 1.024 . . . . 65.439999999999998 110.532 177.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -46.13 -49.58 16.54 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.22 1.008 . . . . 64.310000000000002 113.037 175.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.9 ptt-85 -79.88 -37.82 34.01 Favored 'General case' 0 C--N 1.342 0.259 0 CA-C-N 118.421 0.555 . . . . 64.450000000000003 110.911 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -56.72 -38.11 71.9 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 124.572 1.149 . . . . 73.329999999999998 110.426 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -57.38 -36.73 71.63 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 119.203 0.911 . . . . 74.409999999999997 112.441 -175.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.9 mm -72.62 -48.47 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 CA-C-N 120.196 1.362 . . . . 74.209999999999994 107.885 177.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 70.1 mt -61.02 -13.63 7.9 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 C-N-CA 126.031 1.732 . . . . 74.140000000000001 110.745 -177.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -120.79 10.69 11.0 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.972 1.309 . . . . 62.439999999999998 112.106 -178.18 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 84.4 mt-10 -121.76 22.39 10.5 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.703 1.201 . . . . 73.329999999999998 110.446 174.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 35.2 mm . . . . . 0 C--O 1.256 1.407 0 C-N-CA 128.66 2.784 . . . . 73.120000000000005 110.599 -170.526 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.54 0.579 0 N-CA-C 114.84 1.422 . . . . 72.519999999999996 114.84 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -81.17 -85.6 0.1 Allowed 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.125 -0.985 . . . . 73.120000000000005 108.868 171.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.97 -14.76 61.08 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.95 0.722 . . . . 75.340000000000003 112.95 -174.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 25.2 mmtm -64.04 -12.22 36.57 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 118.227 -0.892 . . . . 74.120000000000005 113.154 -179.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -62.23 -17.26 57.84 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 120.622 1.555 . . . . 74.510000000000005 113.578 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -93.59 17.46 11.65 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.901 0.88 . . . . 75.510000000000005 111.825 173.487 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -143.37 -64.91 0.39 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.806 1.643 . . . . 75.450000000000003 110.813 -174.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -86.59 123.29 31.61 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 124.52 1.128 . . . . 75.329999999999998 111.406 -166.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.0 -33.99 75.66 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.386 1.074 . . . . 74.209999999999994 110.894 178.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -59.82 -24.39 64.13 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.869 0.867 . . . . 75.519999999999996 111.32 -175.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 48.7 mt -84.65 -46.07 11.86 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 124.992 1.317 . . . . 72.239999999999995 109.398 -179.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -50.6 -51.39 48.89 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.62 1.568 . . . . 73.129999999999995 108.68 176.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.79 -46.91 88.68 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 124.297 1.039 . . . . 74.310000000000002 111.606 -178.004 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -66.52 -39.26 88.54 Favored 'General case' 0 N--CA 1.44 -0.938 0 O-C-N 119.632 -1.917 . . . . 73.120000000000005 109.628 -177.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.8 -44.79 95.24 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 118.068 0.394 . . . . 74.340000000000003 111.894 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.3 tm-20 -53.61 -38.47 64.02 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.388 0.613 . . . . 75.010000000000005 110.307 173.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -78.24 1.76 20.52 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.945 0.898 . . . . 75.239999999999995 113.38 -175.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.4 mmt-85 -80.23 -19.08 47.74 Favored 'General case' 0 N--CA 1.464 0.245 0 O-C-N 120.268 -1.52 . . . . 72.450000000000003 110.95 164.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 45.2 mtp180 -52.95 -41.94 64.99 Favored 'General case' 0 C--N 1.342 0.279 0 N-CA-C 114.587 1.328 . . . . 72.030000000000001 114.587 -169.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -95.23 -31.02 13.69 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 123.813 0.695 . . . . 75.040000000000006 111.671 -177.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -44.6 -52.57 7.99 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.047 1.339 . . . . 75.310000000000002 111.536 -178.182 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.98 -5.08 44.59 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 114.805 1.409 . . . . 74.430000000000007 114.805 -169.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 25.7 tp -71.52 -32.52 68.29 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 127.141 2.176 . . . . 72.200000000000003 110.508 171.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -57.19 -48.59 78.78 Favored Glycine 0 C--N 1.34 0.793 0 N-CA-C 110.568 -1.013 . . . . 64.209999999999994 110.568 173.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -63.88 -30.13 71.24 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 124.807 1.243 . . . . 72.040000000000006 112.803 -170.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 9.1 t90 -63.89 -71.6 0.17 Allowed 'General case' 0 C--O 1.231 0.117 0 N-CA-C 107.446 -1.316 . . . . 73.329999999999998 107.446 171.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.1 -32.35 34.77 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 125.496 1.518 . . . . 74.400000000000006 112.394 -173.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -45.17 -52.95 8.75 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 119.383 0.992 . . . . 73.430000000000007 111.53 174.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.58 -42.22 97.64 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 111.63 -0.588 . . . . 73.209999999999994 111.63 -178.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.6 mp -61.68 -46.29 90.35 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 125.365 1.466 . . . . 75.239999999999995 109.988 177.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.2 mp -63.2 -28.49 70.08 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.89 0.876 . . . . 62.299999999999997 110.478 175.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 104.21 20.38 10.49 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 126.237 1.875 . . . . 63.32 112.181 176.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 39.7 mttm -89.97 133.26 34.9 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 107.461 -1.311 . . . . 74.430000000000007 107.461 169.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.6 p -132.71 162.28 31.84 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 123.577 0.751 . . . . 73.040000000000006 109.479 165.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.51 -135.75 22.51 Favored Glycine 0 N--CA 1.448 -0.508 0 N-CA-C 110.322 -1.111 . . . . 33.149999999999999 110.322 175.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -66.22 -27.22 67.81 Favored 'General case' 0 C--O 1.226 -0.175 0 O-C-N 122.297 -0.531 . . . . 60.310000000000002 112.389 -177.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -56.61 -50.08 73.04 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.997 1.319 . . . . 75.239999999999995 109.123 174.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.13 -40.14 71.6 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 125.44 1.496 . . . . 74.409999999999997 110.299 -177.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.7 ttt85 -59.84 -49.96 75.68 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 123.334 0.654 . . . . 60.340000000000003 109.596 177.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.62 -44.78 95.92 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.153 0.981 . . . . 55.240000000000002 110.684 -178.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 88.6 t80 -57.08 -39.02 74.15 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.498 1.119 . . . . 73.239999999999995 111.099 175.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.85 -4.19 30.24 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 120.59 -1.319 . . . . 63.399999999999999 113.229 178.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 12.9 mt -84.62 -0.07 52.01 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 120.547 1.522 . . . . 62.229999999999997 112.145 176.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 12.0 t -130.49 37.72 3.82 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 120.621 1.555 . . . . 55.420000000000002 112.054 -173.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 1.8 p -134.88 99.0 2.37 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 O-C-N 121.021 -1.049 . . . . 75.299999999999997 110.552 -175.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.2 p -159.59 109.36 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 124.147 0.979 . . . . 72.409999999999997 113.246 166.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.4 t -149.45 57.9 1.0 Allowed 'General case' 0 CA--C 1.554 1.098 0 O-C-N 121.202 -0.936 . . . . 64.219999999999999 111.246 177.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.4 t . . . . . 0 CA--C 1.542 0.641 0 O-C-N 120.218 -1.551 . . . . 64.129999999999995 110.026 -175.059 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.5 t0 . . . . . 0 N--CA 1.469 0.512 0 N-CA-C 112.868 0.692 . . . . 75.329999999999998 112.868 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.2 t -55.19 -59.44 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-N 118.761 0.71 . . . . 75.439999999999998 109.499 174.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -57.59 -36.51 71.83 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.497 0.719 . . . . 75.040000000000006 110.612 -178.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.6 tpt180 -58.88 -26.58 64.41 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 124.489 1.116 . . . . 72.120000000000005 112.439 -178.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.7 mmmt -99.41 -43.84 6.41 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 118.488 0.585 . . . . 75.329999999999998 109.505 175.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -57.44 -54.8 42.7 Favored 'General case' 0 C--O 1.223 -0.341 0 C-N-CA 124.857 1.263 . . . . 75.010000000000005 110.204 -174.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.09 -4.0 15.46 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 114.006 1.113 . . . . 72.439999999999998 114.006 -178.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -87.19 -57.47 2.95 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 108.399 -0.963 . . . . 74.200000000000003 108.399 166.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.05 -43.3 70.09 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 125.068 1.347 . . . . 74.439999999999998 110.653 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.3 tp -110.88 19.85 18.13 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 126.841 2.056 . . . . 75.439999999999998 111.512 -165.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 69.5 tt0 -48.64 118.9 2.76 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 126.007 1.723 . . . . 71.219999999999999 108.284 172.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 81.11 -0.58 87.21 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 125.517 1.532 . . . . 75.120000000000005 114.78 178.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 11.3 mtpp -119.54 1.88 11.18 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 118.899 1.35 . . . . 75.239999999999995 111.785 -172.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -148.68 -163.08 1.7 Allowed 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 125.654 1.582 . . . . 75.230000000000004 107.194 168.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -145.65 158.2 43.88 Favored 'General case' 0 CA--C 1.51 -0.562 0 C-N-CA 125.898 1.679 . . . . 60.340000000000003 108.05 -175.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -59.85 -42.52 93.83 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 118.577 0.626 . . . . 71.450000000000003 111.596 -178.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.92 -39.41 72.72 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.021 0.373 . . . . 75.430000000000007 111.128 176.723 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 53.7 m -59.81 -48.18 82.71 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.197 0.999 . . . . 75.200000000000003 110.819 177.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 64.6 mt -63.34 -50.41 78.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 108.447 -0.945 . . . . 73.129999999999995 108.447 -177.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.97 -40.44 97.73 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 120.703 -0.399 . . . . 75.239999999999995 110.071 -176.479 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.8 -54.82 41.82 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 118.156 -0.926 . . . . 71.030000000000001 110.37 176.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.21 -56.58 12.1 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 118.937 0.789 . . . . 74.310000000000002 111.698 -176.737 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 8.9 ptp -66.09 -26.88 67.68 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 119.468 -0.893 . . . . 61.119999999999997 111.603 -173.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 59.7 t -78.9 -51.99 16.07 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 O-C-N 121.089 -1.007 . . . . 75.340000000000003 110.432 176.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -61.1 -31.46 71.15 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.594 1.158 . . . . 73.310000000000002 112.305 -162.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 18.1 mt -75.63 1.1 15.36 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.57 1.548 . . . . 74.140000000000001 112.894 -177.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 30.4 ttt180 -50.89 -45.81 60.3 Favored 'General case' 0 C--N 1.34 0.195 0 C-N-CA 124.433 1.093 . . . . 74.340000000000003 111.008 177.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -56.21 -61.61 2.28 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.707 0.803 . . . . 71.049999999999997 110.961 174.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 10.9 m -49.26 -37.35 23.26 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 127.265 2.226 . . . . 75.219999999999999 111.993 -175.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -51.08 -30.7 16.66 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.623 1.169 . . . . 72.329999999999998 113.469 -178.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 34.2 ttp180 -69.2 -60.3 2.44 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 108.582 -0.896 . . . . 75.409999999999997 108.582 174.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 11.8 mp0 -55.52 -35.1 65.28 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 118.002 -0.999 . . . . 75.150000000000006 110.651 -173.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -50.63 -45.77 57.89 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-O 118.409 -0.805 . . . . 72.340000000000003 112.483 -178.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 45.7 mm -63.77 -46.37 94.66 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-N 119.33 0.968 . . . . 72.540000000000006 109.72 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 32.4 mt -70.11 -12.03 15.62 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 124.614 1.166 . . . . 75.109999999999999 109.452 179.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 13.1 t -108.21 10.2 27.93 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.93 1.692 . . . . 73.540000000000006 109.154 179.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -112.81 12.53 19.54 Favored 'General case' 0 C--O 1.232 0.162 0 O-C-N 119.93 -1.732 . . . . 72.329999999999998 109.941 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 31.8 mt . . . . . 0 C--O 1.251 1.163 0 N-CA-C 107.704 -1.221 . . . . 72.450000000000003 107.704 -178.619 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . 0.441 ' CD2' ' H ' ' A' ' 11' ' ' HIS . 0.2 OUTLIER . . . . . 0 N--CA 1.473 0.678 0 N-CA-C 116.256 1.947 . . . . 74.200000000000003 116.256 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.472 ' C ' ' H ' ' A' ' 14' ' ' LYS . 31.1 mt-10 -61.96 119.58 9.12 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.984 0.914 . . . . 73.219999999999999 110.679 -177.54 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 56.06 -22.4 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 130.447 3.499 . . . . 75.409999999999997 116.883 -174.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.472 ' H ' ' C ' ' A' ' 12' ' ' GLU . 32.6 mmtt -50.01 -28.86 7.59 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 128.754 2.822 . . . . 75.200000000000003 113.37 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.49 -25.31 64.34 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 113.014 0.746 . . . . 72.129999999999995 113.014 -176.076 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.39 -8.13 43.82 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.152 0.797 . . . . 71.219999999999999 113.152 176.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 13.3 t-80 -145.06 -171.39 3.64 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 125.96 1.704 . . . . 74.430000000000007 108.03 -160.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 58.3 -164.19 0.19 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.228 1.411 . . . . 60.299999999999997 110.365 170.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -143.44 -39.18 0.32 Allowed 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.847 1.259 . . . . 74.209999999999994 110.756 167.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -54.67 -43.67 72.62 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 119.554 1.07 . . . . 64.239999999999995 111.586 -172.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 80.4 mt -75.1 -33.89 61.68 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 123.872 0.869 . . . . 74.439999999999998 112.444 177.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -69.93 -36.8 75.62 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.343 1.457 . . . . 74.310000000000002 110.698 -177.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -46.13 -35.96 5.47 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 128.458 2.703 . . . . 75.209999999999994 113.76 -173.06 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.09 -53.44 57.78 Favored 'General case' 0 C--O 1.225 -0.212 0 O-C-N 120.652 -1.28 . . . . 73.299999999999997 111.138 175.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.74 -39.41 84.25 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 118.985 0.811 . . . . 73.030000000000001 111.884 178.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -50.94 -37.57 45.15 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.73 1.212 . . . . 74.5 110.814 -176.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.442 ' C ' ' H ' ' A' ' 29' ' ' ARG . . . -110.08 -85.34 0.55 Allowed 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.607 -0.886 . . . . 74.540000000000006 108.607 178.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 50.37 -12.95 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 129.128 2.971 . . . . 74.219999999999999 117.414 -173.375 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.442 ' H ' ' C ' ' A' ' 27' ' ' ALA . 30.7 mtm180 -44.45 -48.59 9.99 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 126.958 2.103 . . . . 75.510000000000005 113.186 -158.651 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -100.25 -24.3 14.59 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 122.456 0.302 . . . . 62.119999999999997 111.257 -177.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -7.89 1.06 Allowed 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 126.949 2.1 . . . . 75.150000000000006 114.225 -173.126 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -120.72 -15.16 8.45 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 119.872 1.215 . . . . 62.399999999999999 112.919 -178.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 12.3 tp -60.56 -21.14 62.23 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 127.707 2.403 . . . . 74.129999999999995 111.891 172.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -70.22 -42.29 66.87 Favored Glycine 0 C--O 1.224 -0.499 0 N-CA-C 110.48 -1.048 . . . . 71.049999999999997 110.48 175.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -61.82 -39.35 91.47 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.548 1.174 . . . . 71.420000000000002 110.663 179.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 36.1 t90 -55.03 -63.47 1.14 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.627 0.771 . . . . 75.140000000000001 109.375 172.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.83 -29.4 69.86 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.069 0.948 . . . . 75.450000000000003 113.337 -173.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -55.59 -54.46 43.82 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 124.317 1.047 . . . . 72.25 110.136 -177.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -67.37 -5.83 37.67 Favored Glycine 0 CA--C 1.532 1.117 0 CA-C-O 119.032 -0.871 . . . . 73.239999999999995 113.687 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 35.8 mt -90.93 -37.06 13.76 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 119.339 1.57 . . . . 75.209999999999994 110.42 171.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 47.2 mt -91.36 8.79 34.43 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.58 1.952 . . . . 73.230000000000004 113.163 -173.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 75.65 5.25 78.13 Favored Glycine 0 CA--C 1.527 0.786 0 CA-C-O 119.274 -0.737 . . . . 71.040000000000006 113.0 -177.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.1 mttm -78.91 119.66 22.41 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 119.072 1.436 . . . . 64.040000000000006 107.125 -179.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 67.1 p -135.29 175.95 9.12 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 107.789 -1.189 . . . . 74.409999999999997 107.789 159.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 58.12 -145.25 41.26 Favored Glycine 0 CA--C 1.532 1.096 0 N-CA-C 111.571 -0.612 . . . . 74.319999999999993 111.571 -172.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -58.0 -31.32 66.84 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.312 1.045 . . . . 72.340000000000003 111.348 -172.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -63.57 -42.86 98.29 Favored 'General case' 0 C--O 1.225 -0.224 0 C-N-CA 123.8 0.84 . . . . 73.030000000000001 110.966 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.3 -41.54 69.81 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.856 -0.794 . . . . 74.409999999999997 108.856 177.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.8 ptt-85 -73.07 -41.64 63.91 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 119.368 -0.933 . . . . 75.129999999999995 108.928 -169.088 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.18 -42.33 99.36 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 123.517 0.727 . . . . 74.129999999999995 110.958 176.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -58.1 -46.09 86.1 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.3 0.5 . . . . 75.329999999999998 110.318 173.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.97 -12.93 5.15 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.541 1.136 . . . . 75.230000000000004 113.226 176.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 56.3 mt -101.6 1.44 37.82 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.759 1.624 . . . . 75.349999999999994 112.63 -177.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.8 t -125.23 -9.77 7.02 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 119.501 1.046 . . . . 75.230000000000004 112.502 176.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 12.3 m -70.71 84.39 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 C-N-CA 126.13 1.772 . . . . 75.25 111.756 175.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 2.9 p -139.99 132.98 35.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 O-C-N 121.167 -0.958 . . . . 64.530000000000001 111.804 151.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.1 t -148.47 -164.86 2.12 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 106.058 -1.83 . . . . 74.310000000000002 106.058 162.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.543 0.677 0 C-N-CA 125.435 1.494 . . . . 75.129999999999995 112.303 -178.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 38.2 t70 . . . . . 0 CA--C 1.529 0.173 0 CA-C-O 118.91 -0.567 . . . . 72.319999999999993 109.665 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.3 p -60.22 -44.93 96.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-N 119.543 1.065 . . . . 72.439999999999998 111.198 179.178 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -62.08 -21.07 64.65 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 121.062 -1.024 . . . . 63.509999999999998 113.492 177.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -53.56 -38.85 64.25 Favored 'General case' 0 C--N 1.343 0.287 0 CA-C-N 119.124 0.875 . . . . 73.239999999999995 110.949 -174.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -66.96 -31.62 72.31 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.612 -0.514 . . . . 73.519999999999996 109.612 -171.12 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -78.2 -51.18 10.59 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-O 118.487 -0.768 . . . . 74.439999999999998 109.12 169.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.58 -40.83 72.53 Favored 'General case' 0 C--N 1.334 -0.107 0 C-N-CA 125.074 1.35 . . . . 74.25 113.214 -171.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.81 -17.07 62.18 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.355 1.062 . . . . 73.420000000000002 112.503 179.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -97.95 -55.02 2.91 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 108.782 -0.821 . . . . 74.519999999999996 108.782 -178.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.7 mt -78.71 40.4 0.38 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 127.43 2.292 . . . . 74.409999999999997 111.055 170.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -57.97 113.07 1.72 Allowed 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.836 1.254 . . . . 73.239999999999995 108.312 175.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 75.31 12.05 83.81 Favored Glycine 0 CA--C 1.528 0.884 0 C-N-CA 124.708 1.147 . . . . 61.509999999999998 112.949 -178.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -133.02 -8.63 3.05 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.013 1.325 . . . . 75.430000000000007 112.153 -172.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -157.69 114.83 2.98 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.883 1.273 . . . . 73.140000000000001 108.25 163.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -67.44 170.65 7.1 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 124.72 1.208 . . . . 74.099999999999994 110.912 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -47.42 -55.74 8.36 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.123 1.769 . . . . 75.439999999999998 110.12 166.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -69.84 -30.48 67.99 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 122.967 0.507 . . . . 75.439999999999998 111.119 -176.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 30.5 m -65.09 -53.63 42.43 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 109.268 -0.642 . . . . 71.5 109.268 176.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 41.2 mt -61.74 -52.46 60.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 CA-C-N 119.575 1.079 . . . . 75.530000000000001 109.017 -178.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.04 -23.41 67.43 Favored 'General case' 0 C--N 1.34 0.157 0 N-CA-C 111.849 0.314 . . . . 75.120000000000005 111.849 -175.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.42 -54.73 5.21 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 108.717 -0.845 . . . . 75.230000000000004 108.717 174.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.9 tppm? -54.56 -57.1 12.73 Favored 'General case' 0 CA--C 1.512 -0.518 0 C-N-CA 125.948 1.699 . . . . 73.120000000000005 112.136 -171.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 5.2 ptm -59.56 -26.93 65.79 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 120.067 -0.653 . . . . 71.329999999999998 111.237 -175.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 59.7 t -88.25 -27.08 5.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 125.625 1.57 . . . . 74.140000000000001 111.832 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -55.52 -57.82 10.34 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 126.342 1.857 . . . . 73.099999999999994 108.053 172.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.2 pp -80.8 11.58 3.81 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.912 1.685 . . . . 73.219999999999999 113.275 -172.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -53.37 -50.99 63.91 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 120.945 -1.097 . . . . 74.219999999999999 110.971 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.99 -45.41 85.73 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.232 0.539 . . . . 75.439999999999998 110.694 175.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.9 m -50.92 -35.92 35.72 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.625 1.57 . . . . 71.109999999999999 111.517 -178.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -47.79 -45.57 29.61 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.26 1.424 . . . . 74.219999999999999 113.547 177.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -78.86 -43.44 25.08 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.807 1.185 . . . . 75.230000000000004 111.038 174.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.14 -31.91 67.65 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 124.434 1.094 . . . . 75.030000000000001 112.538 -175.131 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -61.73 -24.48 66.83 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.338 0.972 . . . . 72.310000000000002 112.448 177.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 26.7 mm -81.77 -38.38 15.92 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 C-N-CA 124.106 0.962 . . . . 63.039999999999999 110.03 175.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 23.0 mm -59.41 -27.17 36.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 123.733 0.813 . . . . 74.010000000000005 109.648 174.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.63 -17.41 61.67 Favored 'General case' 0 N--CA 1.44 -0.928 0 C-N-CA 125.889 1.675 . . . . 74.209999999999994 112.021 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -139.37 62.23 1.53 Allowed 'General case' 0 C--O 1.237 0.422 0 N-CA-C 106.403 -1.702 . . . . 60.0 106.403 -175.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 95.8 mt . . . . . 0 C--O 1.255 1.383 0 N-CA-C 107.089 -1.448 . . . . 71.439999999999998 107.089 162.582 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.541 0.603 0 N-CA-C 113.882 1.068 . . . . 74.099999999999994 113.882 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -50.1 109.26 0.28 Allowed 'General case' 0 C--O 1.238 0.451 0 C-N-CA 126.635 1.974 . . . . 74.200000000000003 109.708 175.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 48.43 33.58 4.06 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 126.969 2.108 . . . . 75.319999999999993 113.759 -175.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.427 ' HZ1' ' CG ' ' A' ' 18' ' ' ASP . 26.2 mttt -114.4 -10.3 12.65 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.346 1.059 . . . . 71.230000000000004 113.175 174.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -66.15 -21.51 66.34 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 119.311 0.959 . . . . 75.530000000000001 112.863 -171.222 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -122.67 72.55 1.08 Allowed 'General case' 0 C--O 1.232 0.155 0 N-CA-C 107.261 -1.385 . . . . 63.310000000000002 107.261 162.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -164.44 -46.98 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.031 0.932 . . . . 74.219999999999999 110.48 173.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.427 ' CG ' ' HZ1' ' A' ' 14' ' ' LYS . 0.4 OUTLIER -100.58 161.27 13.71 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 121.52 -0.737 . . . . 64.530000000000001 111.488 -167.933 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -93.8 -38.67 11.14 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.199 0.999 . . . . 74.200000000000003 109.576 162.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -44.76 -62.14 1.32 Allowed 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.295 1.438 . . . . 73.540000000000006 111.041 -175.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 13.4 mt -84.31 -29.5 26.32 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 125.38 1.472 . . . . 61.109999999999999 110.735 -172.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 51.4 t30 -69.55 -21.45 63.63 Favored 'General case' 0 C--O 1.216 -0.689 0 CA-C-O 117.88 -1.057 . . . . 73.540000000000006 111.837 176.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -48.2 -55.24 10.94 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 120.214 1.37 . . . . 74.519999999999996 111.174 -170.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.5 pttm -56.44 -53.3 59.04 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 121.131 -0.981 . . . . 75.319999999999993 111.242 173.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.84 -11.51 27.92 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.306 1.042 . . . . 75.200000000000003 113.684 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -87.84 -14.45 39.47 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 120.545 -1.347 . . . . 75.540000000000006 110.469 176.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -153.81 92.12 1.53 Allowed 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.355 1.062 . . . . 72.400000000000006 110.416 178.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.62 -17.51 9.26 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-O 118.389 -0.815 . . . . 64.310000000000002 111.903 169.16 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.74 -35.79 33.27 Favored 'General case' 0 C--N 1.342 0.257 0 CA-C-N 119.974 1.261 . . . . 75.140000000000001 113.344 -173.495 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -83.53 -22.02 32.54 Favored 'General case' 0 C--O 1.223 -0.309 0 CA-C-O 118.028 -0.987 . . . . 75.540000000000006 113.629 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.02 -54.76 29.28 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 120.541 1.518 . . . . 73.239999999999995 109.778 166.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.0 mp -68.73 -24.77 64.51 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.596 0.758 . . . . 73.510000000000005 110.443 -167.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 mt -46.14 -38.51 8.28 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.664 1.185 . . . . 74.319999999999993 111.569 167.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -69.54 -40.17 78.46 Favored Glycine 0 C--N 1.34 0.774 0 O-C-N 121.419 -0.8 . . . . 73.129999999999995 112.465 177.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -64.2 -30.02 71.1 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 118.537 1.168 . . . . 74.420000000000002 111.667 -177.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 20.5 t90 -61.51 -77.24 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 108.421 -0.955 . . . . 75.099999999999994 108.421 166.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.72 -30.76 63.84 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.015 1.326 . . . . 75.209999999999994 113.867 -166.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.39 -54.99 24.77 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 123.943 0.897 . . . . 75.430000000000007 109.743 171.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -55.1 -45.45 81.94 Favored Glycine 0 CA--C 1.522 0.476 0 C-N-CA 124.195 0.902 . . . . 52.119999999999997 111.746 -178.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 9.0 mp -54.68 -41.89 70.75 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 125.695 1.598 . . . . 72.329999999999998 110.937 177.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 51.5 mt -87.87 6.03 37.49 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 126.303 1.841 . . . . 75.540000000000006 112.177 -178.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 73.51 15.47 79.14 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-O 119.108 -0.829 . . . . 50.009999999999998 112.83 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 52.2 mttt -89.07 127.3 35.69 Favored 'General case' 0 CA--C 1.519 -0.231 0 N-CA-C 106.443 -1.688 . . . . 72.239999999999995 106.443 174.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.3 p -141.28 169.72 17.08 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.684 -0.858 . . . . 74.400000000000006 108.684 177.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 55.94 -130.2 48.53 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 110.23 -1.148 . . . . 75.530000000000001 110.23 179.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.88 -29.16 66.3 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 112.174 0.435 . . . . 74.319999999999993 112.174 -174.355 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.62 -33.38 75.79 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 121.234 -0.916 . . . . 74.329999999999998 110.031 177.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.36 -40.44 62.13 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.488 0.715 . . . . 75.540000000000006 109.718 177.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.0 ptp180 -67.23 -44.24 79.98 Favored 'General case' 0 C--O 1.227 -0.124 0 N-CA-C 109.765 -0.458 . . . . 72.510000000000005 109.765 -178.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.59 -43.79 84.89 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 125.983 1.713 . . . . 75.510000000000005 110.131 176.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -60.85 -47.95 84.04 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 122.78 0.432 . . . . 74.530000000000001 111.299 173.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.46 -16.14 44.22 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.352 -0.842 . . . . 75.430000000000007 112.932 -176.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 50.1 mt -61.87 -11.37 12.55 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 119.462 1.028 . . . . 75.519999999999996 113.732 178.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 8.9 t -132.52 -3.17 3.37 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 120.351 1.432 . . . . 75.329999999999998 112.831 -172.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 6.0 p -80.05 11.45 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.932 0 O-C-N 120.668 -1.27 . . . . 71.340000000000003 113.107 -171.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 2.1 p -115.8 120.7 65.56 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.173 0 O-C-N 120.666 -1.271 . . . . 74.400000000000006 110.605 -164.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 5.9 t -161.98 -178.35 6.38 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 130.372 3.469 . . . . 63.140000000000001 105.615 -176.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.5 m . . . . . 0 CA--C 1.532 0.278 0 O-C-N 120.244 -1.535 . . . . 72.530000000000001 110.384 170.498 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 t70 . . . . . 0 C--O 1.233 0.192 0 CA-C-O 120.311 0.101 . . . . 62.409999999999997 110.848 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 54.9 t -83.51 -35.82 11.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 109.05 -0.722 . . . . 73.140000000000001 109.05 177.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -58.85 -44.62 91.02 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-O 117.958 -1.02 . . . . 75.230000000000004 109.308 169.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.409 ' CZ ' ' HE3' ' A' ' 71' ' ' LYS . 34.2 ttp85 -45.68 -58.47 3.42 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.684 0.794 . . . . 75.519999999999996 111.57 -177.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.409 ' HE3' ' CZ ' ' A' ' 70' ' ' ARG . 1.0 OUTLIER -69.83 -40.1 76.07 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 118.38 -0.819 . . . . 75.239999999999995 111.44 -175.831 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 38.6 mt -64.88 -48.06 75.62 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-N 119.2 0.909 . . . . 72.109999999999999 110.695 -179.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.73 -28.71 67.06 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 124.961 1.304 . . . . 74.540000000000006 111.816 -179.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.99 -47.88 67.31 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 118.899 0.772 . . . . 62.210000000000001 110.659 172.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.55 -55.26 18.74 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 107.738 -1.208 . . . . 71.299999999999997 107.738 -178.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 87.0 mt -87.18 34.57 0.69 Allowed 'General case' 0 C--O 1.233 0.222 0 C-N-CA 127.416 2.286 . . . . 74.239999999999995 111.907 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -53.24 115.37 1.86 Allowed 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 107.251 -1.388 . . . . 75.319999999999993 107.251 171.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 87.37 4.24 80.87 Favored Glycine 0 CA--C 1.532 1.102 0 C-N-CA 124.929 1.252 . . . . 60.509999999999998 114.163 176.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 28.9 mtmm -133.64 5.34 3.68 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 125.134 1.374 . . . . 73.519999999999996 112.416 -174.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -144.62 177.73 8.48 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.052 1.341 . . . . 74.230000000000004 108.91 170.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -143.51 164.74 29.5 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 126.754 2.022 . . . . 75.400000000000006 107.319 177.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -58.93 -54.81 42.95 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 124.085 0.954 . . . . 71.540000000000006 110.666 176.264 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -71.96 -11.77 60.93 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 122.978 0.511 . . . . 74.140000000000001 111.943 -178.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 54.3 m -84.09 -52.07 6.58 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 108.498 -0.927 . . . . 72.239999999999995 108.498 174.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 71.8 mt -55.77 -46.65 79.86 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 120.23 1.377 . . . . 75.420000000000002 109.068 178.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.46 -28.92 60.95 Favored 'General case' 0 C--N 1.344 0.347 0 N-CA-C 112.55 0.574 . . . . 75.150000000000006 112.55 -177.527 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.3 -44.47 12.83 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 124.121 0.969 . . . . 73.310000000000002 109.952 176.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 6.3 tptt -66.59 -48.82 68.36 Favored 'General case' 0 CA--C 1.521 -0.149 0 C-N-CA 125.98 1.712 . . . . 74.340000000000003 111.738 -166.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.44 -29.02 69.66 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.13 0.877 . . . . 72.430000000000007 111.183 -178.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 57.1 t -72.92 -31.12 34.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 123.805 0.842 . . . . 73.230000000000004 110.562 174.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.06 -53.75 54.08 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 126.981 2.112 . . . . 72.109999999999999 112.946 -162.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -67.24 22.82 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 127.988 2.515 . . . . 63.509999999999998 113.88 -171.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 6.7 ppt_? -65.3 -25.68 67.73 Favored 'General case' 0 N--CA 1.466 0.368 0 O-C-N 120.139 -1.601 . . . . 74.430000000000007 113.58 -169.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.85 -47.19 9.25 Favored 'General case' 0 C--N 1.332 -0.172 0 O-C-N 121.026 -1.047 . . . . 74.109999999999999 109.044 178.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.8 m -55.14 -29.66 58.22 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.79 1.236 . . . . 65.400000000000006 110.891 175.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -56.59 -45.54 81.34 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.826 1.25 . . . . 63.420000000000002 112.49 173.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 26.1 ttt-85 -63.36 -51.83 64.29 Favored 'General case' 0 CA--C 1.517 -0.292 0 O-C-N 120.828 -1.17 . . . . 74.519999999999996 108.663 175.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.62 -55.41 32.38 Favored 'General case' 0 N--CA 1.444 -0.754 0 O-C-N 125.022 1.451 . . . . 74.319999999999993 110.669 -168.478 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -57.51 -42.28 82.5 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-O 118.732 -0.652 . . . . 74.430000000000007 112.427 -174.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 39.4 mm -64.25 -39.75 86.62 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-N 119.903 1.229 . . . . 75.129999999999995 110.541 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 61.8 mt -71.37 -11.74 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 O-C-N 121.5 -0.75 . . . . 74.230000000000004 109.355 178.173 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.16 4.91 34.57 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.26 1.424 . . . . 74.200000000000003 111.579 176.009 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 80.5 mt-10 -124.52 29.18 6.37 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 125.198 1.399 . . . . 75.430000000000007 108.791 -174.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.6 mm . . . . . 0 C--O 1.251 1.163 0 N-CA-C 105.54 -2.022 . . . . 74.239999999999995 105.54 169.532 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . 0.32 0.1 OUTLIER . . . . . 0 N--CA 1.475 0.784 0 N-CA-C 113.467 0.914 . . . . 73.510000000000005 113.467 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.9 114.1 14.14 Favored 'General case' 0 N--CA 1.444 -0.759 0 O-C-N 119.751 -1.843 . . . . 73.129999999999995 108.061 -171.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 60.81 31.67 20.07 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.896 2.078 . . . . 70.310000000000002 114.862 -174.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -100.11 -25.33 14.32 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 115.429 1.64 . . . . 74.129999999999995 115.429 -177.392 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -74.99 0.32 16.25 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 114.705 1.372 . . . . 74.549999999999997 114.705 -166.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -113.11 25.47 11.34 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.577 1.081 . . . . 65.510000000000005 110.085 173.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -151.38 174.65 13.09 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 124.925 1.29 . . . . 74.439999999999998 108.656 -179.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 60.85 -160.11 0.31 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.635 1.174 . . . . 74.319999999999993 108.852 171.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -137.11 -35.81 0.68 Allowed 'General case' 0 C--N 1.332 -0.173 0 O-C-N 120.375 -1.453 . . . . 74.439999999999998 111.237 161.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -47.83 -54.44 12.45 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.245 1.018 . . . . 74.430000000000007 112.712 -170.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.4 mt -77.74 -29.91 51.33 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.852 -0.53 . . . . 62.409999999999997 111.739 -172.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -63.52 -49.48 73.34 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 108.974 -0.75 . . . . 74.340000000000003 108.974 174.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -55.7 -39.5 71.12 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.949 0.899 . . . . 72.430000000000007 110.934 -178.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -44.8 -48.36 10.95 Favored 'General case' 0 C--N 1.344 0.336 0 C-N-CA 124.281 1.032 . . . . 61.229999999999997 111.777 173.664 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.72 -49.15 71.99 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.565 1.146 . . . . 74.129999999999995 111.441 -178.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -71.0 -18.09 62.61 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 121.975 -0.453 . . . . 71.510000000000005 110.982 -176.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -113.37 55.06 0.72 Allowed 'General case' 0 C--O 1.237 0.41 0 C-N-CA 125.265 1.426 . . . . 74.200000000000003 109.025 -176.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.4 mmt-85 -121.97 -7.66 8.91 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 126.048 1.739 . . . . 71.409999999999997 112.261 172.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 36.8 mtm-85 -53.38 -53.85 45.24 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 119.599 1.091 . . . . 73.140000000000001 112.192 -168.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -82.34 -15.23 53.6 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.501 -0.75 . . . . 74.430000000000007 112.604 -167.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.83 -14.21 59.65 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 119.033 0.833 . . . . 74.430000000000007 112.808 -169.013 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -127.83 3.65 6.02 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.973 2.109 . . . . 71.430000000000007 112.027 -171.334 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 56.7 tp -56.41 -30.13 62.41 Favored 'General case' 0 N--CA 1.461 0.1 0 C-N-CA 128.607 2.763 . . . . 74.5 111.807 174.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -45.8 -46.81 13.81 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 124.791 1.186 . . . . 71.430000000000007 113.016 170.154 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -63.0 -22.49 66.89 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.768 1.227 . . . . 71.230000000000004 111.938 -172.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 5.8 t90 -64.07 -72.66 0.14 Allowed 'General case' 0 C--N 1.343 0.307 0 N-CA-C 107.913 -1.143 . . . . 74.219999999999999 107.913 168.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.93 -29.2 62.89 Favored 'General case' 0 C--O 1.221 -0.441 0 C-N-CA 126.314 1.846 . . . . 61.310000000000002 112.193 -171.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -47.36 -49.27 24.86 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.987 0.812 . . . . 70.439999999999998 111.52 -179.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.46 -35.9 91.75 Favored Glycine 0 CA--C 1.534 1.242 0 CA-C-N 118.352 0.523 . . . . 62.219999999999999 112.869 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.2 mp -64.98 -39.29 93.26 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.649 1.58 . . . . 71.430000000000007 109.339 178.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.9 mp -73.04 -9.68 58.98 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 127.324 2.25 . . . . 71.219999999999999 112.977 172.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 71.44 29.7 67.76 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 125.806 1.67 . . . . 75.209999999999994 112.188 -176.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -111.22 139.06 46.91 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 119.551 1.676 . . . . 73.219999999999999 107.228 170.746 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.1 p -135.73 175.87 9.2 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 107.254 -1.387 . . . . 75.319999999999993 107.254 168.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 60.48 -126.74 41.99 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.487 -1.045 . . . . 72.430000000000007 110.487 173.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -78.29 -34.69 48.65 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 123.974 0.91 . . . . 75.409999999999997 110.512 -170.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.79 -35.2 79.82 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.773 0.829 . . . . 74.129999999999995 109.621 173.309 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.32 -42.06 69.08 Favored 'General case' 0 C--N 1.339 0.109 0 O-C-N 121.961 -0.462 . . . . 64.510000000000005 111.15 170.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.0 ttm180 -55.79 -47.43 77.12 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.436 0.694 . . . . 65.400000000000006 111.603 -176.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.76 -50.6 73.19 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.357 0.526 . . . . 73.129999999999995 110.203 -178.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -53.31 -42.78 67.0 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.693 1.197 . . . . 72.329999999999998 111.477 173.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.25 -24.62 65.03 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 124.071 0.948 . . . . 72.319999999999993 113.519 -178.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 43.9 mt -84.68 -14.8 47.42 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 118.05 -0.976 . . . . 74.219999999999999 111.977 -171.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 11.7 t -102.77 -28.14 12.27 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 119.989 1.268 . . . . 74.120000000000005 112.273 -173.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 1.6 p -72.43 96.57 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.325 0 C-N-CA 127.31 2.244 . . . . 73.430000000000007 109.892 172.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 11.0 p -148.97 152.42 12.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 C-N-CA 125.421 1.488 . . . . 73.510000000000005 108.701 152.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -149.24 -85.91 0.09 Allowed 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 118.219 -0.896 . . . . 74.140000000000001 108.826 155.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.9 t . . . . . 0 C--O 1.226 -0.133 0 CA-C-N 120.012 1.278 . . . . 65.120000000000005 108.367 179.733 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 117.886 -1.054 . . . . 74.230000000000004 111.125 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 14.1 p -63.06 -32.46 56.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 121.115 1.779 . . . . 74.430000000000007 110.646 178.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -78.1 -18.12 56.08 Favored 'General case' 0 C--O 1.221 -0.408 0 N-CA-C 116.084 1.883 . . . . 70.230000000000004 116.084 176.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 22.1 ttt180 -55.36 -57.37 12.14 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 122.375 2.352 . . . . 72.109999999999999 114.286 -169.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -74.57 3.33 7.9 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 122.989 0.516 . . . . 65.540000000000006 111.559 -174.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 18.1 tp -112.78 -63.94 1.37 Allowed 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 127.872 2.469 . . . . 74.510000000000005 108.465 -174.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -51.29 -40.37 58.81 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 127.02 2.128 . . . . 73.129999999999995 111.418 177.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -76.27 -27.01 56.5 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 112.87 0.692 . . . . 74.400000000000006 112.87 -179.203 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.55 -9.22 59.5 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.693 0.797 . . . . 72.430000000000007 110.492 172.252 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 69.0 mt -116.48 34.99 4.75 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 128.723 2.809 . . . . 73.319999999999993 110.916 177.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -54.55 110.93 0.7 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.157 1.383 . . . . 54.030000000000001 108.618 176.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 86.2 2.64 85.51 Favored Glycine 0 CA--C 1.529 0.956 0 C-N-CA 125.439 1.495 . . . . 43.119999999999997 114.957 -179.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -127.24 1.25 6.41 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 118.871 1.336 . . . . 74.329999999999998 112.193 -165.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -147.64 -172.85 4.13 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.733 1.213 . . . . 72.219999999999999 109.498 172.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -146.84 170.38 17.16 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 126.976 2.11 . . . . 73.109999999999999 105.799 165.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -55.13 -47.55 74.89 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.227 1.011 . . . . 61.210000000000001 110.356 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -82.88 -24.21 33.28 Favored 'General case' 0 CA--C 1.534 0.354 0 O-C-N 121.333 -0.854 . . . . 70.510000000000005 111.339 -177.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 79.5 m -64.29 -39.13 93.3 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 120.737 -1.227 . . . . 72.319999999999993 108.909 172.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 96.8 mt -61.15 -50.33 80.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 O-C-N 121.116 -0.99 . . . . 72.120000000000005 109.345 173.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.53 -32.26 73.83 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 118.966 -1.094 . . . . 71.120000000000005 111.087 -174.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.09 -53.05 60.87 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 109.203 -0.666 . . . . 73.519999999999996 109.203 172.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.66 -44.88 95.94 Favored 'General case' 0 N--CA 1.463 0.178 0 O-C-N 120.956 -1.09 . . . . 74.140000000000001 113.366 -173.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 59.7 mtt -59.92 -20.97 60.36 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 118.662 0.665 . . . . 71.430000000000007 111.828 178.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 66.4 t -98.3 -25.51 4.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 125.028 1.331 . . . . 74.439999999999998 110.542 -176.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -60.19 -54.03 50.63 Favored 'General case' 0 N--CA 1.463 0.201 0 O-C-N 120.75 -1.219 . . . . 74.299999999999997 108.56 173.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 4.0 pp -73.97 7.01 2.88 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.45 1.1 . . . . 73.420000000000002 112.85 -178.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 21.5 ttt-85 -56.24 -50.46 71.24 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 120.011 -1.681 . . . . 73.420000000000002 112.692 -176.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.34 -31.91 72.98 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 119.409 1.004 . . . . 73.5 112.388 -178.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 73.7 m -47.42 -36.64 10.15 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.284 1.434 . . . . 64.519999999999996 110.147 178.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -53.94 -46.65 71.61 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 124.983 1.313 . . . . 71.310000000000002 113.192 -175.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptt-85 -82.72 -34.78 27.15 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 120.541 -0.464 . . . . 65.329999999999998 111.364 178.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -59.29 -41.24 88.5 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.242 1.017 . . . . 71.219999999999999 109.634 -179.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 60.8 mm-40 -50.18 -49.92 50.91 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 126.463 1.905 . . . . 74.099999999999994 112.645 174.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 21.6 mm -59.61 -48.31 87.85 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-N 118.925 0.784 . . . . 74.099999999999994 109.047 178.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 97.7 mt -68.38 -5.16 4.01 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 C-N-CA 126.846 2.058 . . . . 72.540000000000006 110.888 -178.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -103.74 -17.86 14.92 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 125.419 1.488 . . . . 73.099999999999994 111.381 175.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -132.55 46.0 2.68 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 125.026 1.331 . . . . 70.400000000000006 109.324 -168.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 24.5 mt . . . . . 0 C--O 1.249 1.027 0 C-N-CA 130.277 3.431 . . . . 73.400000000000006 108.197 -176.455 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.539 0.547 0 N-CA-C 115.719 1.748 . . . . 73.209999999999994 115.719 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -45.0 -42.75 8.56 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 115.921 1.823 . . . . 72.239999999999995 115.921 -162.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -129.12 -1.16 5.17 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.969 1.308 . . . . 62.43 112.096 169.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.1 mtpt -63.57 -19.97 65.26 Favored 'General case' 0 C--O 1.223 -0.295 0 O-C-N 121.016 -1.052 . . . . 71.099999999999994 113.634 -171.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -49.22 -33.24 12.18 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 127.415 2.286 . . . . 73.299999999999997 114.559 -173.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.59 -20.67 63.63 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.154 0.582 . . . . 74.5 112.287 -178.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -113.98 -169.18 1.47 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 129.95 3.3 . . . . 74.299999999999997 105.915 178.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 57.94 -169.99 0.11 Allowed 'General case' 0 C--O 1.239 0.515 0 C-N-CA 124.516 1.126 . . . . 73.319999999999993 110.644 177.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -143.34 -48.06 0.3 Allowed 'General case' 0 C--N 1.333 -0.146 0 O-C-N 120.4 -1.437 . . . . 72.439999999999998 110.71 171.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 64.3 tt0 -60.55 -32.24 71.31 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.079 0.552 . . . . 72.140000000000001 110.937 -171.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 72.3 mt -71.81 -41.2 68.53 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.225 -0.922 . . . . 73.409999999999997 110.491 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -63.57 -42.72 98.29 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.3 1.04 . . . . 72.120000000000005 110.514 173.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -54.53 -41.55 69.83 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.001 0.92 . . . . 75.400000000000006 109.884 174.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.36 -16.66 6.01 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 117.267 -1.349 . . . . 72.400000000000006 114.1 175.452 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -97.01 -32.01 12.22 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 121.145 1.793 . . . . 72.140000000000001 113.642 173.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.0 tp10 -46.1 -43.09 14.5 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.805 1.642 . . . . 70.099999999999994 112.035 -176.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -91.42 26.3 2.31 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.046 1.338 . . . . 61.399999999999999 112.277 -167.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 2.8 mmt180 -112.23 2.73 16.75 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 120.569 -1.332 . . . . 73.430000000000007 111.924 177.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 19.3 mtt-85 -63.53 -23.92 67.59 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.332 1.423 . . . . 73.540000000000006 112.295 -175.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.422 ' C ' ' H ' ' A' ' 32' ' ' LEU . 4.0 m120 -135.11 -16.17 1.92 Allowed 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 117.067 -1.444 . . . . 74.200000000000003 114.559 173.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.07 6.88 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 128.112 2.565 . . . . 72.540000000000006 114.578 -173.117 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.422 ' H ' ' C ' ' A' ' 30' ' ' ASN . 0.3 OUTLIER -137.35 -1.7 2.08 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 127.456 2.302 . . . . 71.200000000000003 110.693 -166.956 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 52.3 tp -66.8 -30.75 71.03 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 127.104 2.162 . . . . 72.230000000000004 110.824 170.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -65.69 -43.8 93.62 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.924 -0.87 . . . . 62.5 110.924 170.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -65.08 -23.85 67.28 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 118.376 1.088 . . . . 71.519999999999996 111.996 -173.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 22.5 t90 -60.15 -69.28 0.22 Allowed 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 124.415 1.086 . . . . 74.230000000000004 108.97 168.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.0 -40.45 80.75 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 122.954 0.502 . . . . 72.409999999999997 111.699 -177.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.26 -54.72 27.7 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.669 1.187 . . . . 73.219999999999999 109.908 173.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -64.08 -36.44 93.25 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-N 117.866 0.303 . . . . 31.210000000000001 112.389 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 38.2 mt -62.63 -38.98 92.37 Favored 'General case' 0 C--O 1.233 0.225 0 O-C-N 120.766 -1.432 . . . . 74.299999999999997 110.696 176.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 92.5 mt -88.16 6.87 34.51 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 126.951 2.1 . . . . 63.140000000000001 113.282 -178.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 81.82 12.95 80.63 Favored Glycine 0 CA--C 1.531 1.093 0 CA-C-N 119.839 1.2 . . . . 72.099999999999994 113.996 171.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -90.83 149.47 21.95 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 126.026 1.73 . . . . 74.140000000000001 109.888 172.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.0 p -148.72 175.71 10.98 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 126.863 2.065 . . . . 71.5 110.054 178.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 58.08 -135.51 51.74 Favored Glycine 0 CA--C 1.525 0.667 0 C-N-CA 124.322 0.963 . . . . 71.099999999999994 111.72 172.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -51.62 -46.41 63.62 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.934 1.294 . . . . 73.340000000000003 111.163 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.8 -38.35 87.78 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.325 -0.852 . . . . 72.540000000000006 110.385 -173.647 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.0 -45.09 52.05 Favored 'General case' 0 N--CA 1.455 -0.22 0 O-C-N 121.887 -0.508 . . . . 63.439999999999998 111.075 171.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 52.0 mtm-85 -59.07 -55.23 37.69 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 118.058 -0.972 . . . . 73.430000000000007 112.633 -172.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.18 -34.39 77.92 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 118.331 -0.842 . . . . 53.340000000000003 110.196 -172.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -61.82 -45.47 93.69 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-O 121.835 0.826 . . . . 74.430000000000007 109.858 173.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.18 -26.61 68.44 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 120.563 -1.336 . . . . 74.5 113.277 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 41.3 mt -84.22 -12.82 54.16 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.757 1.223 . . . . 75.319999999999993 111.158 177.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 40.9 p -105.27 3.37 29.91 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 119.609 1.095 . . . . 75.400000000000006 111.699 175.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.2 t -118.1 98.68 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 C-N-CA 126.039 1.736 . . . . 72.239999999999995 108.191 -173.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 1.9 t -129.65 66.66 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 N-CA-C 107.658 -1.238 . . . . 74.230000000000004 107.658 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.278 6.6 t 51.28 -164.67 0.05 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.199 1.8 . . . . 74.430000000000007 111.425 -178.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.239 0.532 0 C-N-CA 129.253 3.021 . . . . 74.230000000000004 103.411 156.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.5 t70 . . . . . 0 N--CA 1.467 0.38 0 CA-C-O 118.94 -0.553 . . . . 61.43 110.362 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 7.1 p -61.74 -45.7 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 CA-C-N 119.091 0.859 . . . . 73.450000000000003 110.276 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.91 -23.05 67.11 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 115.037 1.495 . . . . 75.409999999999997 115.037 170.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 75.7 ttt-85 -63.12 -54.29 40.2 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 121.172 1.806 . . . . 70.430000000000007 110.604 -178.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -71.74 9.35 0.9 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.995 0.918 . . . . 72.319999999999993 111.567 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 69.0 mt -132.86 -5.07 3.16 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 124.794 1.238 . . . . 73.430000000000007 114.185 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -100.75 -79.65 0.5 Allowed 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.86 1.264 . . . . 74.310000000000002 108.053 173.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.02 -45.73 91.82 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 118.422 0.556 . . . . 73.450000000000003 110.339 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.77 -29.51 66.85 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.078 0.551 . . . . 74.519999999999996 110.858 -175.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.4 tp -111.7 19.35 18.14 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 127.085 2.154 . . . . 73.219999999999999 111.213 -166.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -44.56 126.82 5.69 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 127.075 2.15 . . . . 65.430000000000007 111.635 -169.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 86.54 -12.21 61.7 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 126.231 1.872 . . . . 74.230000000000004 113.579 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 32.2 mtmm -117.31 10.63 13.76 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.689 1.195 . . . . 73.540000000000006 110.445 -175.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -147.03 175.03 11.0 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 126.39 1.876 . . . . 71.340000000000003 110.02 177.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -150.14 172.38 15.38 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 105.617 -1.994 . . . . 63.539999999999999 105.617 154.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -55.67 -52.03 65.25 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 124.672 1.189 . . . . 73.120000000000005 109.38 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -66.42 -29.98 70.25 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.821 0.848 . . . . 71.409999999999997 111.036 -178.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 99.0 m -70.19 -44.48 68.6 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 118.541 -0.742 . . . . 74.549999999999997 109.193 -179.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 69.7 mt -55.15 -46.48 77.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 CA-C-N 119.829 1.195 . . . . 74.540000000000006 109.616 -175.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.98 -47.97 76.7 Favored 'General case' 0 C--N 1.347 0.496 0 CA-C-O 121.595 0.712 . . . . 74.430000000000007 109.568 -179.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -88.01 29.38 0.94 Allowed 'General case' 0 N--CA 1.443 -0.808 0 C-N-CA 125.552 1.541 . . . . 74.140000000000001 111.025 -176.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.31 -48.51 2.88 Favored 'General case' 0 CA--C 1.513 -0.466 0 O-C-N 121.111 -0.993 . . . . 62.539999999999999 109.132 158.349 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 27.0 mtm -57.49 -42.64 83.09 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 117.771 0.26 . . . . 74.450000000000003 111.052 -176.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 27.1 t -79.81 -31.88 13.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 124.347 1.059 . . . . 74.329999999999998 111.957 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -62.18 -24.81 67.41 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.883 1.273 . . . . 71.549999999999997 112.604 -170.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 20.8 mt -86.84 -1.05 57.48 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 114.941 1.46 . . . . 73.420000000000002 114.941 -165.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 73.6 mtp180 -56.45 -50.01 72.94 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 120.306 -1.496 . . . . 71.510000000000005 112.844 -171.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.02 -20.39 59.64 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 120.031 1.287 . . . . 73.129999999999995 112.105 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.6 m -56.5 -25.35 51.12 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.064 0.847 . . . . 74.420000000000002 110.373 176.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.13 -51.34 69.71 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 114.556 1.317 . . . . 74.430000000000007 114.556 176.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -74.93 -38.22 61.83 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 108.994 -0.743 . . . . 72.420000000000002 108.994 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.2 -53.68 54.28 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 124.955 1.302 . . . . 73.140000000000001 109.454 -175.739 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -58.29 -44.58 88.55 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-O 118.839 -0.601 . . . . 74.219999999999999 112.529 -174.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 16.9 mm -65.2 -42.02 93.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 119.079 0.854 . . . . 73.200000000000003 109.003 -178.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 98.0 mt -69.74 -15.71 19.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 N-CA-C 109.479 -0.563 . . . . 74.310000000000002 109.479 177.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -85.78 -11.0 54.62 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 126.012 1.725 . . . . 62.310000000000002 111.225 174.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 66.6 mt-10 -129.77 42.03 3.34 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 128.177 2.591 . . . . 74.510000000000005 108.925 -166.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 92.7 mt . . . . . 0 C--O 1.255 1.372 0 N-CA-C 108.697 -0.853 . . . . 73.5 108.697 -177.145 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.535 0.391 0 N-CA-C 113.325 0.861 . . . . 71.049999999999997 113.325 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -46.38 -42.46 15.02 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 128.87 2.868 . . . . 73.219999999999999 112.75 -172.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.07 13.82 13.03 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.8 1.24 . . . . 71.109999999999999 111.329 178.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.409 ' HZ3' ' CG ' ' A' ' 18' ' ' ASP . 19.0 mttm -108.25 -13.24 14.94 Favored 'General case' 0 C--O 1.225 -0.199 0 C-N-CA 124.596 1.159 . . . . 72.129999999999995 112.398 176.227 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -64.35 -27.02 68.73 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 120.494 1.497 . . . . 74.030000000000001 110.86 170.288 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -86.94 26.24 1.18 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.698 1.599 . . . . 63.210000000000001 112.36 173.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -167.54 -167.94 0.96 Allowed 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 119.465 1.03 . . . . 74.030000000000001 109.965 -178.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.409 ' CG ' ' HZ3' ' A' ' 14' ' ' LYS . 1.5 m-20 57.8 -160.7 0.24 Allowed 'General case' 0 C--O 1.238 0.474 0 C-N-CA 125.765 1.626 . . . . 72.239999999999995 110.499 165.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -140.19 -32.86 0.59 Allowed 'General case' 0 C--O 1.219 -0.532 0 O-C-N 120.985 -1.072 . . . . 72.329999999999998 111.029 160.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -49.31 -41.66 38.99 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 125.274 1.43 . . . . 73.530000000000001 111.985 -168.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 67.9 mt -91.62 -37.28 13.17 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 119.048 -0.501 . . . . 75.120000000000005 110.785 -176.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 27.0 t30 -53.33 -45.18 68.97 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 119.106 0.867 . . . . 72.329999999999998 110.539 170.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -60.87 -39.77 90.45 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 125.801 1.641 . . . . 75.140000000000001 110.499 -178.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -45.78 -44.92 14.36 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 121.181 -0.949 . . . . 75.019999999999996 110.964 171.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -75.31 -62.19 1.65 Allowed 'General case' 0 C--O 1.235 0.312 0 C-N-CA 126.208 1.803 . . . . 74.329999999999998 112.915 177.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -61.51 -16.54 48.48 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.741 1.216 . . . . 71.420000000000002 111.713 -173.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -119.49 37.39 4.18 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.331 1.852 . . . . 75.319999999999993 111.366 -177.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.13 6.12 4.2 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 121.289 -0.882 . . . . 64.329999999999998 112.634 168.387 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.2 ptt85 -63.36 -19.05 64.31 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 120.566 -1.334 . . . . 75.129999999999995 113.27 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -78.72 -20.36 50.24 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 119.803 1.183 . . . . 75.120000000000005 112.142 175.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.49 -19.06 63.75 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 120.323 1.419 . . . . 75.230000000000004 112.65 -168.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.19 2.14 9.18 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.709 2.004 . . . . 74.030000000000001 111.684 -168.495 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.5 mt -60.96 -28.8 69.24 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.702 1.201 . . . . 64.430000000000007 111.336 171.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -61.24 -37.2 93.61 Favored Glycine 0 C--O 1.223 -0.533 0 N-CA-C 111.317 -0.713 . . . . 75.400000000000006 111.317 -178.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -62.28 -33.51 74.78 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.419 1.088 . . . . 72.400000000000006 110.227 -170.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 10.2 t90 -62.65 -65.09 0.74 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.689 1.596 . . . . 74.319999999999993 110.044 170.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.26 -21.09 66.69 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.412 0.685 . . . . 72.329999999999998 112.481 -171.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -70.77 -55.3 8.9 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 125.024 1.33 . . . . 72.019999999999996 109.257 168.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -49.26 -45.07 35.16 Favored Glycine 0 CA--C 1.527 0.842 0 C-N-CA 124.231 0.919 . . . . 54.5 112.042 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 16.1 mt -61.06 -32.74 72.37 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.496 1.118 . . . . 75.219999999999999 113.89 179.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 95.7 mt -85.66 -3.45 58.89 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.365 1.066 . . . . 73.030000000000001 112.446 176.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.11 19.69 56.87 Favored Glycine 0 CA--C 1.526 0.763 0 CA-C-O 118.424 -1.209 . . . . 74.120000000000005 113.374 -175.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 14.3 mmtp -101.53 119.18 38.37 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 125.81 1.644 . . . . 75.400000000000006 108.655 177.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.8 p -152.6 135.56 15.57 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.433 0.693 . . . . 75.340000000000003 110.827 -179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 87.59 -148.85 21.39 Favored Glycine 0 CA--C 1.533 1.2 0 N-CA-C 110.894 -0.883 . . . . 75.310000000000002 110.894 -164.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -63.96 -22.11 66.78 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.937 1.458 . . . . 73.019999999999996 114.937 -161.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.76 -51.29 23.44 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 108.253 -1.018 . . . . 74.230000000000004 108.253 175.31 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -56.51 -40.19 74.6 Favored 'General case' 0 C--N 1.344 0.334 0 O-C-N 121.69 -0.631 . . . . 73.230000000000004 109.886 171.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.02 -25.58 67.74 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.756 1.223 . . . . 75.319999999999993 113.002 179.623 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.05 -51.66 11.83 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 119.533 1.06 . . . . 75.030000000000001 109.663 169.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -60.15 -29.08 68.42 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.266 1.026 . . . . 64.349999999999994 112.822 -177.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.0 -18.97 49.92 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 120.461 -1.399 . . . . 55.420000000000002 112.513 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 22.0 mt -90.74 -15.38 30.33 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.126 0.97 . . . . 75.030000000000001 111.651 -168.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.8 t -95.92 -29.26 14.28 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.64 1.176 . . . . 63.340000000000003 111.411 -178.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 5.3 p -70.8 8.53 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 126.202 1.801 . . . . 73.420000000000002 114.374 -166.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 5.2 m -104.14 49.12 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 O-C-N 119.196 -2.19 . . . . 75.319999999999993 112.004 -163.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.4 t -58.74 -50.48 73.76 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 109.797 -0.446 . . . . 74.299999999999997 109.797 172.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.0 t . . . . . 0 CA--C 1.533 0.317 0 C-N-CA 124.539 1.136 . . . . 74.310000000000002 108.784 -167.56 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . 0.268 5.1 t70 . . . . . 0 CA--C 1.518 -0.278 0 CA-C-O 118.974 -0.536 . . . . 74.409999999999997 111.725 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 30.1 t -47.76 -63.57 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 125.448 1.499 . . . . 74.409999999999997 108.476 170.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -79.37 -5.23 54.12 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 115.011 1.486 . . . . 75.140000000000001 115.011 -179.382 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.2 ptt180 -54.07 -19.85 5.55 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 115.486 1.661 . . . . 74.299999999999997 115.486 -172.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -113.21 -10.84 13.33 Favored 'General case' 0 CA--C 1.516 -0.345 0 C-N-CA 124.034 0.934 . . . . 74.239999999999995 112.648 177.339 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 17.9 tp -94.34 -58.43 2.21 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.881 1.273 . . . . 75.420000000000002 108.086 -175.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.32 -49.14 70.38 Favored 'General case' 0 C--O 1.223 -0.291 0 C-N-CA 124.897 1.279 . . . . 73.209999999999994 109.529 170.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.9 -20.58 65.94 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 114.314 1.227 . . . . 53.399999999999999 114.314 -178.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.08 -52.75 8.26 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 106.954 -1.498 . . . . 75.200000000000003 106.954 170.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 90.5 mt -80.39 39.67 0.47 Allowed 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 127.264 2.225 . . . . 73.340000000000003 110.785 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 62.0 tt0 -55.67 113.26 1.39 Allowed 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 126.579 1.952 . . . . 75.010000000000005 107.504 173.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 80.19 6.95 88.95 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 124.491 1.043 . . . . 53.140000000000001 114.58 -177.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 27.2 mtmm -130.43 -2.58 4.36 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 118.779 1.29 . . . . 75.040000000000006 113.443 -176.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -151.33 106.68 3.33 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 119.993 1.269 . . . . 74.040000000000006 110.379 175.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -64.53 166.48 8.43 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 108.458 -0.942 . . . . 72.400000000000006 108.458 167.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -55.46 -39.47 70.39 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 120.85 -1.156 . . . . 71.209999999999994 110.47 177.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -75.73 -16.73 60.1 Favored 'General case' 0 CA--C 1.53 0.188 0 O-C-N 121.483 -0.761 . . . . 75.230000000000004 111.276 -177.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 96.3 m -68.75 -43.81 75.04 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 118.64 0.655 . . . . 75.439999999999998 109.625 170.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.1 mt -62.29 -57.08 13.7 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-N 119.9 1.227 . . . . 75.299999999999997 108.82 -176.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.96 -44.58 67.22 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 118.274 0.488 . . . . 75.040000000000006 111.528 178.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.28 -52.67 64.64 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 108.922 -0.77 . . . . 73.120000000000005 108.922 -177.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -63.85 -43.76 95.17 Favored 'General case' 0 CA--C 1.518 -0.285 0 C-N-CA 123.748 0.819 . . . . 75.019999999999996 112.869 -174.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 10.0 mtt -58.29 -42.92 87.65 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 118.887 0.767 . . . . 73.420000000000002 110.757 177.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 60.0 t -68.68 -40.24 81.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 124.086 0.954 . . . . 74.0 110.39 179.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -58.26 -52.5 65.34 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 119.655 1.116 . . . . 72.310000000000002 110.947 -173.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 22.3 mt -67.97 1.68 2.53 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.509 1.924 . . . . 74.140000000000001 112.765 -168.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -67.83 -19.39 65.05 Favored 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 125.307 1.443 . . . . 72.200000000000003 112.112 -176.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -76.81 -56.27 4.75 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 119.994 1.27 . . . . 75.409999999999997 109.293 172.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 55.3 m -51.21 -36.85 43.57 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.21 1.404 . . . . 64.129999999999995 110.566 177.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.33 -50.82 68.64 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.693 0.797 . . . . 75.040000000000006 113.033 175.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -76.87 -35.7 57.28 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 118.522 0.601 . . . . 74.019999999999996 110.645 -179.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -61.47 -37.99 85.62 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 124.955 1.302 . . . . 73.329999999999998 111.817 179.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -63.37 -20.76 65.81 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 119.235 0.925 . . . . 73.219999999999999 112.854 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 41.9 mm -79.34 -29.49 13.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 CA-C-N 119.328 0.967 . . . . 73.019999999999996 110.605 174.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 15.9 mm -61.14 -23.78 31.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 N-CA-C 108.641 -0.874 . . . . 75.049999999999997 108.641 167.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -93.76 9.65 36.25 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.523 0.729 . . . . 74.409999999999997 111.779 176.601 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 88.3 mt-10 -132.29 37.49 3.54 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.582 1.953 . . . . 75.25 108.886 -179.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 96.9 mt . . . . . 0 C--O 1.254 1.339 0 C-N-CA 125.779 1.631 . . . . 75.310000000000002 109.331 166.456 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.536 0.431 0 N-CA-C 115.444 1.646 . . . . 74.420000000000002 115.444 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.471 ' HG3' ' H ' ' A' ' 13' ' ' ALA . 7.0 pt-20 -44.94 -78.75 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.951 2.101 . . . . 74.120000000000005 113.306 -168.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.471 ' H ' ' HG3' ' A' ' 12' ' ' GLU . . . -81.56 -2.57 50.46 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.627 0.771 . . . . 73.129999999999995 112.655 -179.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 31.4 mttm -75.6 -11.04 59.93 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.115 0.966 . . . . 74.140000000000001 112.329 176.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -61.56 -27.04 68.34 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 120.536 1.516 . . . . 75.439999999999998 112.571 -174.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -86.86 16.0 5.3 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.583 1.553 . . . . 62.219999999999999 113.033 174.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 50.9 m-70 -140.69 -65.55 0.45 Allowed 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.077 1.751 . . . . 74.400000000000006 109.966 -173.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -84.24 84.78 7.5 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 126.047 1.739 . . . . 74.409999999999997 107.427 -172.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.87 -26.07 57.94 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 114.811 -1.086 . . . . 75.239999999999995 110.912 175.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.01 -34.19 77.84 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.505 1.122 . . . . 64.129999999999995 111.592 174.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 82.0 mt -77.51 -36.96 52.04 Favored 'General case' 0 C--O 1.232 0.184 0 O-C-N 120.215 -1.553 . . . . 73.299999999999997 109.451 173.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -66.52 -29.74 69.9 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 121.244 -0.91 . . . . 74.400000000000006 111.062 176.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -58.62 -45.9 88.22 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.809 1.244 . . . . 64.099999999999994 110.879 172.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.31 -30.92 13.07 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.773 0.829 . . . . 73.239999999999995 112.247 174.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.18 -24.65 34.86 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 113.73 1.011 . . . . 75.439999999999998 113.73 -174.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -79.84 -16.57 55.19 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 119.352 0.978 . . . . 71.040000000000006 110.972 173.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -74.26 -160.12 0.09 Allowed 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 126.389 1.876 . . . . 71.109999999999999 108.932 166.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.4 mmt180 59.7 -29.65 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 128.973 2.909 . . . . 72.239999999999995 115.818 -176.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.1 ptt180 -50.9 -12.86 0.12 Allowed 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 130.89 3.676 . . . . 75.420000000000002 116.114 -174.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 25.4 m120 -113.4 -23.57 9.79 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 119.574 1.079 . . . . 62.509999999999998 112.275 178.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.9 -44.45 91.23 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 120.9 1.682 . . . . 74.420000000000002 110.301 173.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -79.69 -13.39 59.51 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 113.451 0.908 . . . . 71.420000000000002 113.451 -171.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 15.7 mt -62.02 -24.99 67.39 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.642 0.777 . . . . 74.209999999999994 111.681 173.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -57.55 -39.44 90.88 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.899 -0.88 . . . . 72.549999999999997 110.899 176.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -65.36 -35.05 79.81 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.631 1.215 . . . . 72.420000000000002 111.108 -179.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 56.4 t90 -66.19 -61.88 1.78 Allowed 'General case' 0 C--N 1.342 0.242 0 C-N-CA 123.738 0.815 . . . . 71.140000000000001 108.969 178.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.08 -39.95 83.71 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 119.123 -0.465 . . . . 74.409999999999997 110.985 -178.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.0 -50.31 73.09 Favored 'General case' 0 C--N 1.339 0.15 0 CA-C-N 118.981 0.81 . . . . 53.219999999999999 110.889 172.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -52.28 -50.4 46.86 Favored Glycine 0 C--N 1.335 0.504 0 C-N-CA 124.977 1.275 . . . . 71.329999999999998 110.96 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 91.4 mt -58.53 -51.34 70.28 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 123.816 0.846 . . . . 73.230000000000004 109.764 175.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 32.1 mt -66.19 -6.11 12.45 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 115.406 1.632 . . . . 74.549999999999997 115.406 -176.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 80.61 12.48 82.86 Favored Glycine 0 CA--C 1.529 0.929 0 CA-C-N 119.078 0.854 . . . . 72.349999999999994 112.626 -177.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 57.8 mttt -87.86 129.1 35.31 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 118.834 1.317 . . . . 72.439999999999998 108.4 170.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 61.2 p -144.53 160.43 41.14 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.825 0.85 . . . . 70.319999999999993 108.764 167.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.82 -145.33 32.41 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 110.488 -1.045 . . . . 64.540000000000006 110.488 -175.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -57.36 -35.23 69.69 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.741 1.217 . . . . 54.310000000000002 110.583 -178.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -54.21 -43.56 70.89 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.309 1.044 . . . . 64.439999999999998 111.24 175.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -77.59 -42.56 34.71 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 121.997 -0.439 . . . . 72.349999999999994 109.924 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.3 ptt180 -63.29 -46.07 88.46 Favored 'General case' 0 C--O 1.225 -0.186 0 N-CA-C 109.511 -0.551 . . . . 74.439999999999998 109.511 -174.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.59 -44.16 96.57 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 126.13 1.772 . . . . 62.439999999999998 110.212 -176.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 17.1 t80 -60.78 -55.5 32.34 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.281 0.632 . . . . 74.430000000000007 109.445 171.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.81 -5.52 2.08 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 125.416 1.486 . . . . 61.409999999999997 114.045 -176.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 45.5 mt -65.11 -34.38 78.27 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 120.708 -1.245 . . . . 72.450000000000003 110.369 169.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 13.8 t -133.98 73.45 1.5 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 122.51 1.147 . . . . 54.340000000000003 109.943 -165.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.6 m -136.03 12.98 0.97 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 126.023 1.729 . . . . 71.329999999999998 111.688 -178.143 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 16.0 t -82.78 90.23 2.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 O-C-N 120.626 -1.296 . . . . 75.340000000000003 109.99 -171.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 5.3 t -147.51 131.6 17.3 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 126.171 1.788 . . . . 74.450000000000003 106.554 176.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.6 p . . . . . 0 CA--C 1.521 -0.143 0 C-N-CA 124.113 0.965 . . . . 62.119999999999997 108.402 176.895 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.473 0.676 0 CA-C-O 122.328 1.061 . . . . 75.530000000000001 113.602 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 1.6 p -131.31 -57.67 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 C-N-CA 127.83 2.452 . . . . 75.209999999999994 107.655 179.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 46.9 t80 -55.78 -44.02 77.33 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 119.526 1.057 . . . . 75.349999999999994 109.56 172.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.3 ttt180 -62.1 -11.75 15.72 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 114.824 1.416 . . . . 75.310000000000002 114.824 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 55.8 mmtt -105.63 -48.79 3.57 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 120.04 1.291 . . . . 75.510000000000005 109.368 175.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 13.8 mt -70.72 -27.83 64.27 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 118.48 -0.771 . . . . 74.530000000000001 110.956 -172.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.05 -53.25 21.36 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-N 119.434 1.015 . . . . 62.520000000000003 108.529 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.92 -20.96 66.72 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 117.955 -1.021 . . . . 74.109999999999999 113.05 174.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.88 -56.78 6.15 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 103.741 -2.689 . . . . 63.539999999999999 103.741 170.187 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 97.2 mt -77.6 31.56 0.16 Allowed 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 127.135 2.174 . . . . 74.549999999999997 112.141 -174.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -57.06 105.15 0.2 Allowed 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 126.779 2.032 . . . . 64.349999999999994 109.306 174.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 101.84 -1.36 52.04 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 126.153 1.835 . . . . 65.230000000000004 114.788 -177.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 28.9 mtmm -133.24 10.96 4.17 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 126.027 1.731 . . . . 74.329999999999998 113.088 -177.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -151.33 176.04 11.64 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 121.842 0.83 . . . . 63.109999999999999 111.683 175.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -140.65 163.68 32.22 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 127.582 2.353 . . . . 71.519999999999996 105.599 172.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -46.05 -61.78 1.61 Allowed 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 126.109 1.763 . . . . 62.310000000000002 110.358 169.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -67.57 -38.11 83.61 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.188 0.595 . . . . 75.510000000000005 111.821 -176.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 28.5 m -55.57 -46.39 77.2 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.802 0.841 . . . . 74.349999999999994 110.895 174.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 7.5 mt -70.28 -56.84 9.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 120.181 1.355 . . . . 72.439999999999998 110.301 173.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.87 -17.65 61.82 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 119.676 1.126 . . . . 75.25 113.153 -170.272 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -88.99 -32.86 17.42 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 119.541 1.064 . . . . 75.430000000000007 112.823 171.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 57.7 tptt -63.64 -70.27 0.23 Allowed 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.718 1.207 . . . . 74.530000000000001 112.178 -169.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -31.64 71.26 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 112.806 0.669 . . . . 75.129999999999995 112.806 -167.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 74.2 t -58.74 -38.76 73.95 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 C-N-CA 124.925 1.29 . . . . 74.230000000000004 109.428 176.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -73.4 -21.4 60.5 Favored 'General case' 0 C--O 1.232 0.181 0 O-C-N 121.67 -0.644 . . . . 72.439999999999998 111.336 -172.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 89.0 mt -72.25 8.17 1.44 Allowed 'General case' 0 C--O 1.227 -0.127 0 C-N-CA 123.785 0.834 . . . . 64.430000000000007 111.661 -170.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 38.1 ttp85 -57.88 -44.52 86.75 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 121.224 -0.923 . . . . 73.409999999999997 110.015 174.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.52 -50.24 74.68 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-N 118.466 0.576 . . . . 62.350000000000001 110.851 171.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -58.3 -36.91 74.04 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.609 -0.682 . . . . 73.450000000000003 110.713 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -71.23 -48.82 49.0 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.718 1.207 . . . . 74.140000000000001 111.754 -177.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -63.2 -30.22 71.41 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 117.723 0.238 . . . . 75.450000000000003 110.659 177.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -57.66 -53.56 56.75 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 125.565 1.546 . . . . 71.019999999999996 111.048 170.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -57.2 -16.76 8.87 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 114.037 1.125 . . . . 73.150000000000006 114.037 -174.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 50.0 mm -71.23 -61.86 1.52 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 118.927 0.785 . . . . 73.400000000000006 110.168 168.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 84.5 mt -67.71 -19.36 24.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 124.478 1.111 . . . . 72.239999999999995 110.48 -173.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -69.55 -16.38 63.41 Favored 'General case' 0 N--CA 1.429 -1.517 0 C-N-CA 124.247 1.019 . . . . 73.109999999999999 111.839 172.053 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -145.7 67.84 1.21 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-N 119.899 1.227 . . . . 64.239999999999995 109.867 -173.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 15.2 mm . . . . . 0 C--O 1.252 1.185 0 C-N-CA 125.249 1.42 . . . . 74.230000000000004 108.74 173.876 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.543 0.682 0 N-CA-C 115.249 1.574 . . . . 74.420000000000002 115.249 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -62.34 129.58 41.36 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 108.823 -0.806 . . . . 73.150000000000006 108.823 -177.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 57.26 -8.63 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 127.889 2.476 . . . . 73.109999999999999 115.535 -169.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -77.33 -25.13 50.85 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 119.93 1.241 . . . . 72.150000000000006 112.066 174.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.39 -17.6 59.53 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 114.18 1.178 . . . . 74.329999999999998 114.18 -169.614 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -126.28 40.29 3.76 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 125.622 1.569 . . . . 73.340000000000003 108.847 173.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -149.37 -75.54 0.16 Allowed 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 107.79 -1.189 . . . . 74.439999999999998 107.79 179.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.57 117.77 9.23 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 124.804 1.241 . . . . 74.25 108.631 -178.178 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.74 -31.13 72.2 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 124.168 0.987 . . . . 72.420000000000002 111.669 -173.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -60.74 -62.55 1.77 Allowed 'General case' 0 C--O 1.231 0.095 0 C-N-CA 125.717 1.607 . . . . 71.129999999999995 112.163 -177.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 36.0 mt -72.03 -32.81 67.49 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 121.788 -0.57 . . . . 64.230000000000004 109.481 -169.218 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 58.0 t-20 -53.57 -59.93 3.96 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 126.36 1.864 . . . . 74.109999999999999 108.744 169.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -56.22 -45.6 79.86 Favored 'General case' 0 CA--C 1.517 -0.298 0 C-N-CA 123.665 0.786 . . . . 73.319999999999993 111.483 179.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.37 -31.4 33.61 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 119.234 0.924 . . . . 74.340000000000003 112.268 -177.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -91.58 -53.97 4.09 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 125.274 1.43 . . . . 72.239999999999995 111.868 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -58.29 -25.12 61.46 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.73 -0.606 . . . . 74.310000000000002 110.962 179.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -106.88 7.54 30.16 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 125.094 1.358 . . . . 71.239999999999995 112.401 -177.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.47 -14.98 3.46 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 120.744 -1.223 . . . . 74.099999999999994 113.124 174.597 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 49.5 mtm180 -62.42 16.56 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 131.344 3.858 . . . . 74.340000000000003 116.113 -166.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.624 HD22 ' N ' ' A' ' 58' ' ' SER . 1.0 OUTLIER -124.61 -70.05 0.77 Allowed 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 119.719 1.145 . . . . 72.109999999999999 108.819 165.336 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.34 -19.83 56.98 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.467 1.284 . . . . 73.319999999999993 114.467 -165.828 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.18 -19.93 66.21 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 113.039 0.755 . . . . 74.5 113.039 174.291 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 20.9 tp -72.49 -27.53 62.33 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 126.436 1.894 . . . . 73.400000000000006 110.905 171.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.25 -53.66 38.12 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 108.469 -1.852 . . . . 50.229999999999997 108.469 164.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -63.59 -7.13 6.39 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.231 1.412 . . . . 71.239999999999995 113.791 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 22.6 t90 -86.02 -79.4 0.25 Allowed 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 107.37 -1.344 . . . . 75.430000000000007 107.37 165.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.37 -21.86 62.62 Favored 'General case' 0 C--O 1.225 -0.193 0 C-N-CA 124.804 1.242 . . . . 74.420000000000002 114.099 -167.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -54.09 -53.49 52.51 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.861 1.209 . . . . 75.209999999999994 109.866 176.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -54.74 -48.78 64.44 Favored Glycine 0 CA--C 1.524 0.644 0 C-N-CA 124.254 0.931 . . . . 63.340000000000003 111.771 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.0 mp -52.9 -39.56 62.85 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.523 1.529 . . . . 71.209999999999994 111.78 175.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 67.8 mt -86.8 1.44 52.3 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.704 1.602 . . . . 75.129999999999995 112.881 -177.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.79 29.64 25.81 Favored Glycine 0 CA--C 1.526 0.771 0 C-N-CA 124.391 0.996 . . . . 53.130000000000003 112.864 177.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.9 mttt -128.76 122.0 29.62 Favored 'General case' 0 CA--C 1.523 -0.092 0 C-N-CA 125.642 1.577 . . . . 64.340000000000003 108.566 -168.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.4 p -138.26 179.59 6.36 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 124.077 0.951 . . . . 64.540000000000006 109.387 175.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 52.46 -131.0 38.77 Favored Glycine 0 CA--C 1.523 0.579 0 C-N-CA 124.613 1.102 . . . . 74.409999999999997 111.414 178.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -61.8 -28.77 69.69 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 113.258 0.836 . . . . 61.530000000000001 113.258 -176.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -68.63 -47.56 66.31 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 122.61 1.195 . . . . 72.319999999999993 110.424 179.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.72 -36.54 81.25 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 114.721 -1.127 . . . . 64.409999999999997 111.079 172.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.5 ttm-85 -53.34 -52.28 59.72 Favored 'General case' 0 N--CA 1.444 -0.755 0 C-N-CA 123.712 0.805 . . . . 73.140000000000001 111.43 175.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.74 -45.04 94.55 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.413 0.551 . . . . 73.319999999999993 111.042 -177.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -54.23 -45.89 72.4 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.054 0.941 . . . . 74.310000000000002 110.051 175.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.97 -13.09 30.6 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 114.106 1.15 . . . . 71.200000000000003 114.106 179.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 18.3 mt -94.14 -14.58 25.52 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 120.905 -1.122 . . . . 73.5 110.773 179.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 12.5 t -110.24 29.06 8.02 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.067 1.747 . . . . 73.510000000000005 109.721 172.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 58.5 t -134.07 75.76 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 N-CA-C 107.337 -1.357 . . . . 54.409999999999997 107.337 170.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 1.6 t -137.36 168.19 21.63 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 C-N-CA 125.047 1.339 . . . . 73.400000000000006 107.744 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER 67.2 -36.13 0.27 Allowed 'General case' 0 CA--C 1.553 1.078 1 C-N-CA 135.327 5.451 . . . . 61.530000000000001 116.186 -175.767 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.624 ' N ' HD22 ' A' ' 30' ' ' ASN . 95.0 p . . . . . 0 C--N 1.345 0.383 0 C-N-CA 129.038 2.935 . . . . 73.129999999999995 111.985 -168.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.464 0.231 0 N-CA-C 109.904 -0.406 . . . . 72.530000000000001 109.904 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.3 p -67.0 -44.1 88.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 118.393 0.542 . . . . 70.5 110.648 -177.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -61.72 -33.34 73.87 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 121.493 -0.754 . . . . 74.530000000000001 111.231 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 17.5 tpp180 -51.82 -50.76 60.2 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 124.804 1.242 . . . . 73.519999999999996 111.341 -171.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.91 -26.8 22.53 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 119.455 -0.307 . . . . 74.230000000000004 111.073 -177.751 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -52.44 -61.41 2.29 Favored 'General case' 0 CA--C 1.52 -0.197 0 C-N-CA 123.974 0.91 . . . . 70.310000000000002 108.839 177.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.72 -36.45 80.97 Favored 'General case' 0 N--CA 1.456 -0.165 0 O-C-N 123.889 0.743 . . . . 71.329999999999998 111.931 -171.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.39 -45.13 85.24 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.03 0.443 . . . . 74.239999999999995 110.534 178.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -65.81 -48.13 72.73 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 122.131 0.967 . . . . 71.219999999999999 109.65 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 11.8 tp -87.2 10.34 17.24 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 127.35 2.26 . . . . 72.230000000000004 113.26 -169.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -47.54 111.13 0.38 Allowed 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 127.313 2.245 . . . . 72.099999999999994 110.446 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 106.1 -2.26 38.0 Favored Glycine 0 CA--C 1.524 0.629 0 C-N-CA 125.768 1.652 . . . . 74.400000000000006 113.599 177.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.35 -0.13 5.68 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 119.722 1.761 . . . . 71.340000000000003 112.475 -179.329 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -147.89 176.35 10.22 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 125.065 1.346 . . . . 71.030000000000001 108.88 176.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -141.57 170.8 15.05 Favored 'General case' 0 CA--C 1.511 -0.521 0 C-N-CA 125.464 1.506 . . . . 65.299999999999997 107.88 174.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -65.47 -52.76 50.71 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 125.59 1.556 . . . . 70.030000000000001 108.63 -177.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -67.38 -29.95 69.61 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.463 0.705 . . . . 74.540000000000006 110.34 178.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 5.0 m -65.46 -57.8 7.39 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.419 0.688 . . . . 73.209999999999994 110.271 173.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 21.1 mt -60.29 -53.05 54.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 CA-C-N 120.511 1.505 . . . . 72.519999999999996 109.269 -171.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -55.1 -37.58 67.02 Favored 'General case' 0 C--N 1.342 0.265 0 O-C-N 123.999 0.812 . . . . 71.219999999999999 110.858 -178.626 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -71.19 -47.91 54.75 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-O 118.375 -0.821 . . . . 64.129999999999995 109.285 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -50.51 -60.97 2.48 Favored 'General case' 0 CA--C 1.516 -0.345 0 C-N-CA 125.051 1.34 . . . . 73.219999999999999 109.295 -177.517 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . 0.282 0.0 OUTLIER -59.16 -38.35 79.53 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 120.271 -0.572 . . . . 73.439999999999998 111.928 -165.747 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 32.0 t -70.29 -53.16 24.32 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 125.249 1.42 . . . . 71.109999999999999 110.558 174.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -63.69 -26.15 68.53 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 120.178 -1.576 . . . . 65.239999999999995 111.769 -168.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 44.9 mt -64.6 8.95 0.09 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.856 1.662 . . . . 74.239999999999995 113.753 177.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -45.0 -64.11 0.78 Allowed 'General case' 0 C--N 1.34 0.195 0 C-N-CA 127.588 2.355 . . . . 73.209999999999994 113.13 -177.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.25 -20.2 28.81 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 118.966 0.803 . . . . 62.439999999999998 111.41 178.245 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.2 m -57.56 -30.04 64.91 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 120.858 -1.151 . . . . 74.519999999999996 110.242 174.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -54.18 -36.39 63.35 Favored 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 124.929 1.292 . . . . 62.299999999999997 114.253 170.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 18.5 ptt180 -90.78 -24.41 20.34 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 117.606 -1.188 . . . . 70.400000000000006 111.671 179.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -56.4 -59.28 5.2 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 119.044 0.838 . . . . 72.439999999999998 109.108 169.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -58.07 -20.63 40.94 Favored 'General case' 0 C--O 1.223 -0.315 0 N-CA-C 114.636 1.347 . . . . 74.5 114.636 -168.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 8.4 mm -89.19 -35.36 7.58 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 O-C-N 120.696 -1.253 . . . . 74.439999999999998 110.016 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 97.0 mt -66.96 -30.32 49.22 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 N-CA-C 108.579 -0.897 . . . . 73.109999999999999 108.579 168.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 2.2 t -71.69 -43.0 66.75 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.067 1.347 . . . . 74.319999999999993 109.413 178.175 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -129.49 70.2 1.42 Allowed 'General case' 0 C--O 1.234 0.288 0 C-N-CA 125.778 1.631 . . . . 73.340000000000003 107.508 -169.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 76.7 mt . . . . . 0 C--O 1.248 0.975 0 C-N-CA 126.533 1.933 . . . . 75.530000000000001 110.76 -176.007 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.464 0.259 0 N-CA-C 115.432 1.641 . . . . 73.540000000000006 115.432 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -53.78 121.37 7.75 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.647 1.112 . . . . 75.319999999999993 109.12 174.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 48.51 -0.23 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 129.577 3.151 . . . . 64.319999999999993 117.248 -176.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.3 mmtt -76.59 -6.77 53.36 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 125.58 1.552 . . . . 73.409999999999997 112.808 -173.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -58.85 -36.0 73.87 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 119.449 1.022 . . . . 72.319999999999993 111.809 177.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.79 16.75 0.08 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.59 1.956 . . . . 75.400000000000006 113.399 178.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 44.8 t-80 -152.15 -73.49 0.14 Allowed 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 123.508 0.723 . . . . 75.510000000000005 109.94 -163.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -83.73 145.39 28.76 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 123.811 0.844 . . . . 72.530000000000001 108.841 -170.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.41 -50.57 9.29 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-O 117.945 -1.026 . . . . 75.329999999999998 109.771 175.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -44.94 -42.85 8.51 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 126.489 1.915 . . . . 75.329999999999998 113.392 -178.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 82.8 mt -76.38 -28.9 56.93 Favored 'General case' 0 C--N 1.33 -0.274 0 O-C-N 120.908 -1.12 . . . . 75.140000000000001 111.004 -174.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -80.03 -28.81 39.28 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.716 2.006 . . . . 75.099999999999994 111.212 171.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -56.63 -48.67 77.01 Favored 'General case' 0 C--O 1.226 -0.142 0 C-N-CA 126.929 2.092 . . . . 74.439999999999998 109.696 -171.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.45 -41.71 63.53 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 118.526 -0.75 . . . . 73.400000000000006 112.537 175.481 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.15 -54.27 43.56 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 124.515 1.126 . . . . 60.109999999999999 111.153 178.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -66.19 -11.26 48.51 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 112.647 0.61 . . . . 72.340000000000003 112.647 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -121.3 32.59 5.86 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.42 1.488 . . . . 60.329999999999998 111.335 -177.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -120.01 17.5 12.5 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.057 1.343 . . . . 73.540000000000006 112.86 178.304 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 71.7 mtm-85 -71.23 -48.82 48.94 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 120.296 -1.503 . . . . 74.109999999999999 111.825 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 30.3 m120 -62.19 -27.63 69.11 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 114.642 1.349 . . . . 74.120000000000005 114.642 -163.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.11 -34.61 66.2 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 119.322 0.964 . . . . 75.140000000000001 113.29 172.672 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -75.14 -33.23 61.51 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 123.613 0.765 . . . . 74.549999999999997 108.995 -177.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -62.64 -33.44 75.02 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 108.625 -0.879 . . . . 75.420000000000002 108.625 169.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -67.81 -14.36 65.23 Favored Glycine 0 CA--C 1.538 1.524 0 CA-C-O 117.709 -1.606 . . . . 63.119999999999997 113.685 170.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -91.52 -18.69 23.73 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 121.291 2.545 . . . . 74.450000000000003 111.255 169.026 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 10.6 t90 -76.62 -79.23 0.11 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.148 1.379 . . . . 64.349999999999994 110.518 -176.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -50.69 -29.84 12.24 Favored 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 127.472 2.309 . . . . 74.340000000000003 112.722 -171.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -44.57 -52.87 7.65 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 126.64 1.976 . . . . 74.150000000000006 110.616 173.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -53.45 -48.73 59.47 Favored Glycine 0 C--N 1.337 0.625 0 N-CA-C 110.479 -1.048 . . . . 71.230000000000004 110.479 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.42 ' H ' ' CD1' ' A' ' 40' ' ' LEU . 2.2 mp -61.79 -46.48 89.36 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 126.728 2.011 . . . . 73.129999999999995 108.621 -177.37 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.0 mp -62.97 -18.28 63.04 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.083 1.353 . . . . 63.32 112.899 175.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 106.08 -1.91 38.07 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 127.065 2.269 . . . . 74.450000000000003 112.8 177.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 44.4 mttm -75.1 143.53 43.32 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 118.466 1.133 . . . . 71.319999999999993 108.65 178.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.1 p -142.16 178.53 7.48 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 124.043 0.937 . . . . 73.319999999999993 109.326 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 55.08 -119.89 15.23 Favored Glycine 0 N--CA 1.442 -0.922 0 C-N-CA 124.63 1.109 . . . . 64.319999999999993 110.544 168.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -82.86 -22.52 34.03 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 123.568 0.747 . . . . 73.420000000000002 112.768 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -72.43 -41.51 66.11 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.003 -1.06 . . . . 60.210000000000001 110.372 -176.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.8 -46.71 88.36 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.647 -0.872 . . . . 73.329999999999998 108.647 168.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -59.17 -33.63 71.15 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 118.419 -0.801 . . . . 74.430000000000007 112.895 179.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.56 -51.23 29.9 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 124.704 1.202 . . . . 72.420000000000002 109.849 175.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -56.77 -30.28 63.47 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.5 1.12 . . . . 75.239999999999995 111.857 176.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.45 1.09 2.48 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 120.468 -1.395 . . . . 75.239999999999995 114.32 175.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.0 mt -108.81 1.49 20.99 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 125.263 1.425 . . . . 75.319999999999993 110.147 179.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 77.4 p -129.9 18.79 5.58 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.165 0.893 . . . . 72.530000000000001 112.163 -168.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 5.4 t -132.97 102.68 5.23 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 C-N-CA 125.06 1.344 . . . . 75.310000000000002 109.08 177.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 4.2 p -146.78 128.15 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 O-C-N 120.884 -1.135 . . . . 75.549999999999997 110.058 175.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 5.5 t -170.55 87.13 0.12 Allowed 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 106.663 -1.606 . . . . 72.450000000000003 106.663 178.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.1 t . . . . . 0 CA--C 1.54 0.573 0 C-N-CA 126.76 2.024 . . . . 74.200000000000003 108.173 -172.994 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.473 0.696 0 N-CA-C 111.459 0.17 . . . . 74.310000000000002 111.459 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 48.2 t -84.38 -48.88 16.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 C-N-CA 124.17 0.988 . . . . 63.299999999999997 109.939 -177.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.43 -22.11 60.98 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 118.868 0.758 . . . . 75.430000000000007 112.889 -179.001 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.0 ttt180 -44.6 -43.14 7.94 Favored 'General case' 0 CA--C 1.516 -0.352 0 C-N-CA 128.429 2.692 . . . . 73.420000000000002 112.021 172.114 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -74.0 -15.79 61.09 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 118.403 -0.808 . . . . 75.109999999999999 111.98 -171.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 70.0 mt -96.32 -53.93 3.45 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.55 -0.907 . . . . 71.510000000000005 108.55 167.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -52.62 -40.47 62.78 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.753 1.621 . . . . 74.439999999999998 113.109 -169.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.35 -48.18 62.11 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.847 0.459 . . . . 74.140000000000001 111.159 177.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -67.24 -28.77 68.33 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 120.852 -1.155 . . . . 63.25 111.262 -176.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 14.2 tp -103.78 13.43 33.02 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 128.063 2.545 . . . . 75.409999999999997 111.824 -172.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -59.34 111.84 1.52 Allowed 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 126.268 1.827 . . . . 64.549999999999997 109.462 -177.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 105.49 -3.61 39.9 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 126.084 1.802 . . . . 75.049999999999997 113.077 -174.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 14.3 mtmm -134.16 -0.4 3.03 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 118.959 1.38 . . . . 72.030000000000001 112.474 -177.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -144.93 172.15 13.44 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 119.028 0.831 . . . . 75.239999999999995 110.506 168.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -132.83 161.45 34.12 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 125.845 1.658 . . . . 71.019999999999996 107.478 -178.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -64.73 -49.74 69.67 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.117 -0.947 . . . . 75.239999999999995 110.066 -164.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -71.64 -34.94 70.21 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 122.695 0.398 . . . . 75.519999999999996 110.042 177.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 52.3 m -57.24 -45.71 83.69 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.004 0.922 . . . . 74.340000000000003 111.062 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 79.8 mt -58.5 -48.58 85.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 CA-C-N 119.589 1.086 . . . . 74.540000000000006 110.404 179.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.64 -44.75 93.39 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 118.943 0.792 . . . . 71.329999999999998 110.667 -175.587 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.7 -38.08 89.76 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.198 0.599 . . . . 75.239999999999995 111.567 179.046 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.36 -47.04 76.36 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.319 0.648 . . . . 75.019999999999996 110.744 -177.078 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 10.5 mtt -61.84 -30.59 70.94 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 120.992 0.425 . . . . 74.530000000000001 111.853 -178.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 92.1 t -86.6 -25.44 6.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 124.915 1.286 . . . . 74.230000000000004 110.207 -171.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 90.2 mt-10 -56.99 -45.02 83.26 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.459 1.104 . . . . 55.509999999999998 110.459 175.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 4.2 pp -101.28 18.69 19.32 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 127.592 2.357 . . . . 74.040000000000006 112.688 -174.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.71 -31.08 72.14 Favored 'General case' 0 N--CA 1.469 0.493 0 O-C-N 119.92 -1.738 . . . . 75.400000000000006 113.945 -173.757 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -78.09 -37.2 46.99 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 119.665 1.12 . . . . 74.109999999999999 111.313 173.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 6.1 m -45.38 -47.56 13.51 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.435 1.894 . . . . 74.439999999999998 110.902 -172.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -64.75 -40.47 95.36 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 113.945 1.091 . . . . 72.420000000000002 113.945 -177.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 11.6 ptt180 -73.87 -33.13 63.93 Favored 'General case' 0 C--N 1.342 0.247 0 CA-C-O 117.436 -1.268 . . . . 74.209999999999994 110.59 -175.489 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -49.47 -55.69 12.36 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 118.314 -0.85 . . . . 63.310000000000002 109.034 171.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -53.12 -39.84 63.74 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-O 118.475 -0.774 . . . . 72.109999999999999 112.987 -173.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 8.5 mm -63.23 -46.41 95.85 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 120.04 1.291 . . . . 75.120000000000005 109.961 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 56.0 mt -67.03 -24.52 32.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 124.821 1.248 . . . . 75.329999999999998 109.095 179.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.13 -12.57 59.65 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.527 1.931 . . . . 74.329999999999998 111.53 176.23 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -121.36 24.07 10.12 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 125.587 1.555 . . . . 73.25 109.873 -163.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 33.0 mm . . . . . 0 C--O 1.255 1.346 0 N-CA-C 107.371 -1.344 . . . . 63.399999999999999 107.371 176.443 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 . . . . . 0 CA--C 1.547 0.845 0 N-CA-C 116.607 2.077 . . . . 71.439999999999998 116.607 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.436 ' C ' ' H ' ' A' ' 14' ' ' LYS . 46.0 mt-10 -77.37 117.53 18.95 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 119.481 -2.012 . . . . 73.219999999999999 109.369 -171.221 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.29 -15.94 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 128.335 2.654 . . . . 71.310000000000002 116.069 -164.123 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.436 ' H ' ' C ' ' A' ' 12' ' ' GLU . 30.4 mttm -74.27 2.91 8.12 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.873 2.069 . . . . 74.120000000000005 115.802 -173.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -80.71 1.56 29.68 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 119.513 -1.992 . . . . 74.340000000000003 112.307 175.388 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -120.86 -154.75 0.6 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.922 2.089 . . . . 64.230000000000004 105.568 159.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 65.92 -54.61 0.37 Allowed 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 129.167 2.987 . . . . 73.099999999999994 115.711 168.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -96.0 -175.44 3.4 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 127.747 2.419 . . . . 75.200000000000003 107.604 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -113.72 -39.98 3.9 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 117.747 -1.12 . . . . 73.420000000000002 110.515 166.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 77.8 mt-10 -45.55 -54.02 8.17 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.066 1.346 . . . . 73.430000000000007 112.521 -175.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.554 ' CD2' ' H ' ' A' ' 21' ' ' LEU . 0.6 OUTLIER -72.34 -33.93 67.67 Favored 'General case' 0 N--CA 1.436 -1.137 0 O-C-N 121.01 -1.056 . . . . 73.030000000000001 111.931 -177.262 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -72.34 -30.01 64.35 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 123.37 0.668 . . . . 74.030000000000001 110.697 177.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.22 -45.84 90.04 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.674 1.189 . . . . 75.140000000000001 109.644 177.38 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 13.3 mttp -53.06 -39.63 63.4 Favored 'General case' 0 N--CA 1.463 0.182 0 O-C-N 121.599 -0.688 . . . . 72.439999999999998 110.927 172.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -78.98 -28.64 43.53 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 114.098 1.147 . . . . 74.120000000000005 114.098 179.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -67.6 -40.61 84.75 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 108.436 -0.95 . . . . 74.0 108.436 178.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -109.06 54.99 0.64 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 122.004 0.907 . . . . 71.140000000000001 110.221 -156.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.5 ppt_? -151.71 -15.45 0.19 Allowed 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 114.215 1.191 . . . . 62.219999999999999 114.215 -177.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.13 -22.25 16.07 Favored 'General case' 0 C--O 1.231 0.088 0 O-C-N 120.69 -1.256 . . . . 73.200000000000003 114.031 -178.169 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -105.12 -25.32 12.55 Favored 'General case' 0 CA--C 1.518 -0.25 0 N-CA-C 113.99 1.107 . . . . 74.140000000000001 113.99 176.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.92 -22.4 64.33 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 118.919 0.782 . . . . 75.140000000000001 112.317 -169.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.4 -11.87 47.93 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 124.589 1.155 . . . . 73.030000000000001 113.678 -178.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 16.9 tp -72.88 -21.75 60.88 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.814 1.246 . . . . 75.230000000000004 112.243 -175.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -66.19 -37.59 93.1 Favored Glycine 0 CA--C 1.521 0.434 0 N-CA-C 110.898 -0.881 . . . . 75.439999999999998 110.898 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -54.73 -34.97 63.19 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 126.377 1.871 . . . . 73.340000000000003 111.568 178.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 28.3 t90 -70.26 -81.53 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.673 -0.862 . . . . 75.409999999999997 108.673 174.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -57.92 -24.7 58.99 Favored 'General case' 0 C--N 1.34 0.178 0 N-CA-C 114.311 1.226 . . . . 75.209999999999994 114.311 -167.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.01 -56.41 14.46 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 119.725 1.148 . . . . 75.120000000000005 109.954 176.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -53.45 -49.05 58.59 Favored Glycine 0 CA--C 1.527 0.79 0 CA-C-O 119.282 -0.732 . . . . 75.310000000000002 111.889 177.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 8.4 mp -52.41 -45.88 66.09 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.609 1.163 . . . . 74.329999999999998 110.892 179.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 84.8 mt -79.02 0.28 28.35 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 127.0 2.12 . . . . 74.310000000000002 112.862 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 71.41 3.07 52.33 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 124.691 1.138 . . . . 71.400000000000006 113.113 -175.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -63.48 127.72 32.6 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 106.178 -1.786 . . . . 75.030000000000001 106.178 175.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 37.7 p -136.37 171.79 13.97 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 107.98 -1.119 . . . . 61.240000000000002 107.98 175.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 51.14 -125.69 25.2 Favored Glycine 0 CA--C 1.524 0.634 0 C-N-CA 124.024 0.821 . . . . 63.240000000000002 112.632 172.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -61.89 -37.27 83.94 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.804 1.242 . . . . 73.219999999999999 111.704 -176.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.49 -43.03 73.97 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.686 0.795 . . . . 72.019999999999996 110.944 -177.399 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.77 -41.84 87.07 Favored 'General case' 0 C--O 1.227 -0.102 0 C-N-CA 123.577 0.751 . . . . 73.129999999999995 109.799 173.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 23.0 mtm180 -54.45 -57.3 11.84 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 118.87 -0.586 . . . . 75.319999999999993 109.531 176.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.58 -33.47 75.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 119.081 0.855 . . . . 74.310000000000002 111.49 -170.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 61.4 t80 -60.29 -55.24 36.11 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.284 1.034 . . . . 73.219999999999999 109.269 169.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.75 -36.7 81.77 Favored 'General case' 0 N--CA 1.462 0.128 0 C-N-CA 125.597 1.559 . . . . 72.400000000000006 113.604 -175.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.2 mt -59.69 -23.28 62.99 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 124.981 1.312 . . . . 75.310000000000002 111.149 -174.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.45 -82.22 0.62 Allowed 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 126.083 1.753 . . . . 74.340000000000003 107.585 178.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . 0.353 8.9 p 44.38 25.77 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 C-N-CA 128.315 2.646 . . . . 63.130000000000003 114.023 -171.308 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 3.6 m -100.79 125.68 54.62 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.855 0 O-C-N 119.042 -2.286 . . . . 73.299999999999997 110.688 178.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.8 t -153.57 -171.68 3.98 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 128.289 2.636 . . . . 55.240000000000002 105.379 170.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.8 m . . . . . 0 CA--C 1.536 0.419 0 C-N-CA 124.686 1.194 . . . . 73.140000000000001 108.724 -165.871 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.7 t0 . . . . . 0 CA--C 1.541 0.602 0 N-CA-C 111.633 0.234 . . . . 73.319999999999993 111.633 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 87.2 t -56.9 -49.02 80.41 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 O-C-N 119.901 -1.75 . . . . 60.229999999999997 110.579 169.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -65.88 -38.73 89.55 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 118.701 -0.666 . . . . 72.200000000000003 110.285 176.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.5 tpt180 -52.41 -56.51 14.55 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 118.349 0.522 . . . . 72.430000000000007 110.026 177.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? -63.28 -50.58 69.57 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 124.101 0.96 . . . . 64.209999999999994 109.459 -178.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 9.1 mt -56.15 -50.59 70.71 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-O 118.342 -0.837 . . . . 72.299999999999997 110.329 -176.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.07 -39.12 92.77 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 119.623 1.101 . . . . 75.040000000000006 112.419 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.36 -25.6 66.06 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 118.756 0.707 . . . . 72.420000000000002 111.498 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.05 -38.03 16.91 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 124.004 0.921 . . . . 71.230000000000004 111.035 174.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 94.3 mt -86.03 37.93 0.74 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.158 1.783 . . . . 71.420000000000002 109.84 175.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -61.65 102.33 0.25 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.472 1.909 . . . . 71.140000000000001 108.386 176.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 89.97 9.85 65.34 Favored Glycine 0 CA--C 1.523 0.569 0 C-N-CA 124.665 1.126 . . . . 72.230000000000004 112.876 -177.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -129.11 -10.95 4.74 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 119.475 1.637 . . . . 73.0 113.019 -173.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -149.27 171.37 16.61 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 119.207 0.912 . . . . 63.310000000000002 111.286 172.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -120.87 165.34 15.33 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 125.01 1.324 . . . . 62.210000000000001 109.973 -171.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -57.03 -26.69 60.73 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 126.842 2.057 . . . . 55.299999999999997 113.576 179.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -109.46 -22.47 12.0 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.885 0.874 . . . . 72.230000000000004 113.056 174.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.8 m -65.6 -37.88 87.87 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 120.562 -1.337 . . . . 54.399999999999999 113.132 -175.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 10.4 mt -69.69 -56.45 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 N-CA-C 107.627 -1.249 . . . . 74.140000000000001 107.627 179.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.51 -36.43 66.68 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 123.172 0.589 . . . . 73.319999999999993 110.979 -174.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.24 -38.89 78.7 Favored 'General case' 0 N--CA 1.443 -0.807 0 O-C-N 123.658 0.599 . . . . 73.310000000000002 110.858 179.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 6.3 tppt? -64.0 -49.66 71.56 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 119.448 1.022 . . . . 73.239999999999995 109.08 -161.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -43.88 97.16 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 113.119 0.785 . . . . 73.030000000000001 113.119 -177.811 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 58.6 t -65.04 -37.02 79.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 C-N-CA 123.985 0.914 . . . . 72.430000000000007 110.772 177.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -66.37 -26.49 67.29 Favored 'General case' 0 C--O 1.237 0.436 0 O-C-N 120.584 -1.322 . . . . 75.230000000000004 112.053 -175.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 45.3 mt -87.48 9.65 20.2 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.081 0.952 . . . . 75.209999999999994 112.322 -167.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 76.2 mtt85 -52.81 -46.62 67.78 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 120.88 1.673 . . . . 73.230000000000004 111.155 175.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -54.56 -66.23 0.44 Allowed 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 125.728 1.611 . . . . 73.030000000000001 109.12 177.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.6 m -48.01 -52.01 21.7 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 126.096 1.758 . . . . 72.400000000000006 110.766 -178.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.7 -36.14 73.75 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.874 1.27 . . . . 74.010000000000005 111.711 -177.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 14.8 ttp180 -59.4 -57.9 10.98 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 119.947 1.249 . . . . 71.040000000000006 108.45 173.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -65.82 -30.56 71.21 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-O 116.574 -1.679 . . . . 75.329999999999998 112.065 -169.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -48.85 -54.53 14.86 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-N 119.898 1.226 . . . . 75.430000000000007 110.237 174.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 18.8 mm -55.97 -47.1 80.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-N 119.684 1.129 . . . . 75.120000000000005 111.56 179.227 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 50.6 mt -66.66 -18.17 23.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 124.329 1.051 . . . . 64.340000000000003 109.569 -178.226 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 1.4 t -115.72 19.42 15.25 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.708 2.003 . . . . 73.420000000000002 110.058 -174.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -130.65 19.72 5.14 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.695 1.998 . . . . 72.329999999999998 110.341 177.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 33.3 mm . . . . . 0 C--O 1.247 0.943 0 CA-C-O 116.788 -1.577 . . . . 73.200000000000003 109.369 177.195 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.547 0.84 0 N-CA-C 114.125 1.157 . . . . 74.299999999999997 114.125 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.465 ' HG3' ' H ' ' A' ' 13' ' ' ALA . 6.1 pt-20 -70.08 -85.54 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.64 1.109 . . . . 65.099999999999994 111.444 -176.151 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.465 ' H ' ' HG3' ' A' ' 12' ' ' GLU . . . -72.1 -11.88 60.95 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.736 -1.228 . . . . 50.399999999999999 112.112 177.176 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 51.2 mmtt -57.68 -22.9 48.66 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 125.026 1.33 . . . . 74.540000000000006 113.528 -178.255 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -60.41 -18.79 53.09 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.561 0.744 . . . . 74.400000000000006 112.796 177.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -125.97 55.29 1.47 Allowed 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.258 1.023 . . . . 65.430000000000007 108.41 168.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -156.05 -55.62 0.09 Allowed 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 118.413 -0.803 . . . . 72.099999999999994 111.206 -179.027 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -117.19 122.6 44.5 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 119.093 0.86 . . . . 71.530000000000001 110.357 -165.018 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.41 -32.51 66.93 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 125.952 1.701 . . . . 64.129999999999995 112.893 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -63.28 -52.8 60.54 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 123.447 0.699 . . . . 72.230000000000004 111.439 -179.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 44.2 mt -71.97 -39.99 68.95 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 108.463 -0.939 . . . . 71.140000000000001 108.463 -176.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -47.11 -48.31 23.01 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 117.36 -1.305 . . . . 71.209999999999994 111.475 166.325 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -64.79 -48.39 74.63 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 120.419 1.463 . . . . 64.530000000000001 110.803 177.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -50.42 -42.37 53.75 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 121.514 -0.741 . . . . 74.209999999999994 110.798 175.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -90.65 -9.58 46.35 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 125.343 1.457 . . . . 62.100000000000001 114.615 -177.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.07 -41.37 82.02 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 119.723 1.147 . . . . 71.400000000000006 110.552 -174.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -117.48 -85.26 0.64 Allowed 'General case' 0 N--CA 1.442 -0.84 0 N-CA-C 106.266 -1.753 . . . . 72.510000000000005 106.266 -160.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.346 0.0 OUTLIER 48.56 -1.41 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 117.652 2.464 . . . . 72.400000000000006 117.652 171.099 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 -80.13 4.96 15.66 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 121.358 1.89 . . . . 73.299999999999997 112.111 -177.267 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -130.65 -26.98 2.18 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-O 117.31 -1.329 . . . . 73.129999999999995 111.044 178.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.83 -55.01 7.16 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 120.686 1.585 . . . . 74.430000000000007 108.894 175.368 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.01 -13.71 18.23 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 126.41 1.884 . . . . 74.310000000000002 115.266 -175.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 29.6 tp -71.38 -32.59 68.65 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 120.782 -1.199 . . . . 71.400000000000006 110.262 -172.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.01 -34.82 90.94 Favored Glycine 0 CA--C 1.529 0.948 0 N-CA-C 110.949 -0.861 . . . . 74.340000000000003 110.949 173.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.32 -19.14 65.82 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.754 1.277 . . . . 64.420000000000002 111.406 -173.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 19.9 t90 -74.4 -75.71 0.15 Allowed 'General case' 0 C--N 1.341 0.227 0 N-CA-C 107.946 -1.131 . . . . 71.140000000000001 107.946 169.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -54.7 -29.3 52.69 Favored 'General case' 0 C--O 1.222 -0.356 0 C-N-CA 125.139 1.375 . . . . 73.040000000000006 112.722 -171.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -45.08 -53.75 7.55 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.903 1.229 . . . . 70.450000000000003 111.222 169.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.4 -33.52 87.46 Favored Glycine 0 CA--C 1.532 1.109 0 O-C-N 121.95 -0.469 . . . . 74.450000000000003 112.01 -177.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.4 mp -66.12 -50.93 62.31 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.608 1.563 . . . . 71.439999999999998 109.588 173.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.7 mp -62.99 -28.45 70.1 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 125.498 1.519 . . . . 74.209999999999994 113.072 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 108.92 20.82 7.78 Favored Glycine 0 CA--C 1.527 0.802 0 C-N-CA 124.892 1.234 . . . . 72.120000000000005 112.878 -179.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.0 mttt -106.83 135.66 47.99 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 125.794 1.638 . . . . 74.25 107.944 178.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 17.5 p -138.29 154.22 49.03 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 124.458 1.103 . . . . 73.109999999999999 108.789 -176.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 49.94 -118.06 5.38 Favored Glycine 0 CA--C 1.523 0.555 0 N-CA-C 111.214 -0.754 . . . . 72.340000000000003 111.214 173.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -57.71 -36.86 72.58 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.765 1.626 . . . . 72.140000000000001 113.313 -177.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -68.01 -45.85 72.88 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 122.024 0.916 . . . . 75.239999999999995 109.851 177.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.92 -32.53 74.08 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.695 0.798 . . . . 70.319999999999993 110.475 177.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.7 ttm180 -54.88 -52.12 63.82 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 124.332 1.053 . . . . 74.140000000000001 111.266 178.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.47 -41.22 96.9 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-O 121.671 0.748 . . . . 74.230000000000004 110.988 -179.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -65.14 -37.65 88.09 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 121.252 0.549 . . . . 74.340000000000003 111.396 178.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.09 -1.47 5.99 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.169 1.387 . . . . 34.420000000000002 112.596 177.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 35.7 mt -106.83 7.96 30.49 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.895 1.678 . . . . 65.109999999999999 111.106 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.0 t -141.21 19.94 2.26 Favored 'General case' 0 CA--C 1.543 0.673 0 O-C-N 121.409 -0.807 . . . . 74.430000000000007 112.963 -174.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 25.8 t -130.84 73.49 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 O-C-N 120.445 -1.409 . . . . 73.430000000000007 107.884 178.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 79.9 t -142.15 124.72 14.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 C-N-CA 124.155 0.982 . . . . 74.010000000000005 108.959 175.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.7 t -155.2 -55.66 0.09 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 106.033 -1.839 . . . . 61.399999999999999 106.033 169.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.446 -0.64 0 CA-C-O 122.385 1.088 . . . . 72.420000000000002 109.871 -166.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 39.3 t0 . . . . . 0 CA--C 1.522 -0.12 0 N-CA-C 110.349 -0.241 . . . . 72.409999999999997 110.349 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 85.6 t -84.74 -39.66 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 O-C-N 121.528 -0.733 . . . . 73.040000000000006 111.199 -175.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -74.4 -25.15 59.29 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.503 -0.748 . . . . 72.340000000000003 111.553 179.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.7 ttm180 -44.88 -67.77 0.26 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.065 1.746 . . . . 74.049999999999997 112.848 -174.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.409 ' H ' ' CD ' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -55.13 -46.75 75.66 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 126.087 1.755 . . . . 72.340000000000003 110.115 -177.01 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.65 -57.44 11.94 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 125.267 1.427 . . . . 71.209999999999994 110.189 -177.392 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.59 -36.64 84.33 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.998 0.519 . . . . 74.430000000000007 110.906 -175.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.82 -47.07 85.02 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.828 0.451 . . . . 62.420000000000002 111.148 176.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.06 -48.85 78.39 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 124.906 1.283 . . . . 75.430000000000007 109.873 179.332 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 11.8 tp -100.84 14.65 31.05 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 125.819 1.647 . . . . 74.340000000000003 112.959 -159.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -47.01 119.81 2.74 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 127.315 2.246 . . . . 63.25 110.987 -174.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 86.53 -1.74 87.27 Favored Glycine 0 CA--C 1.524 0.614 0 C-N-CA 124.657 1.122 . . . . 74.349999999999994 113.571 175.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -124.73 0.47 8.09 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 118.675 1.237 . . . . 70.219999999999999 110.512 -174.579 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -148.98 176.14 10.69 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 125.86 1.664 . . . . 51.109999999999999 109.794 171.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -135.69 162.02 33.91 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 126.45 1.9 . . . . 74.239999999999995 107.14 -177.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.43 -55.29 30.29 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 124.926 1.29 . . . . 70.209999999999994 111.409 178.499 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -68.7 -31.45 70.56 Favored 'General case' 0 C--O 1.225 -0.201 0 O-C-N 121.529 -0.732 . . . . 74.239999999999995 111.008 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 77.0 m -66.23 -39.48 89.59 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 118.751 -0.643 . . . . 73.409999999999997 109.286 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 75.0 mt -65.62 -48.32 83.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-N 119.795 1.18 . . . . 74.420000000000002 108.89 175.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.6 ppt_? -63.43 -36.81 84.97 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 118.771 -0.633 . . . . 73.329999999999998 110.818 -175.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.49 -54.62 21.88 Favored 'General case' 0 N--CA 1.445 -0.72 0 C-N-CA 124.244 1.018 . . . . 70.409999999999997 109.312 174.442 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 10.7 tptt -50.07 -51.88 39.01 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 118.828 0.74 . . . . 74.099999999999994 110.62 -171.027 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 12.6 ptp -64.19 -29.56 70.66 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 120.049 -0.66 . . . . 72.319999999999993 112.27 -175.312 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 89.2 t -79.58 -28.34 12.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 124.159 0.984 . . . . 74.430000000000007 111.072 174.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -54.0 -51.58 63.48 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 121.217 1.826 . . . . 64.010000000000005 110.432 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.31 6.12 4.84 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.828 0.677 . . . . 65.299999999999997 112.828 -174.167 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 36.2 ttm180 -47.64 -41.12 21.48 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.306 1.442 . . . . 73.329999999999998 112.516 -174.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -96.96 -27.39 14.66 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 113.268 0.84 . . . . 73.439999999999998 113.268 173.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 44.5 m -59.33 -35.61 74.14 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 120.467 -1.395 . . . . 71.019999999999996 110.962 177.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -51.44 -45.01 62.5 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.189 0.996 . . . . 73.120000000000005 112.246 -177.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.47 -27.21 67.63 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-O 119.167 -0.444 . . . . 72.0 112.09 -178.065 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -80.11 -38.55 31.37 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 109.105 -0.702 . . . . 74.109999999999999 109.105 -178.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -55.94 -44.57 78.54 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-O 117.636 -1.173 . . . . 72.409999999999997 112.84 -176.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 20.0 mm -56.1 -49.27 76.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 120.234 1.379 . . . . 74.439999999999998 108.729 178.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 53.7 mt -69.93 -7.04 7.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 C-N-CA 125.245 1.418 . . . . 72.109999999999999 111.453 178.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 9.5 t -117.45 21.38 13.09 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.853 2.061 . . . . 74.340000000000003 110.767 178.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 -119.53 13.39 12.56 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.926 2.091 . . . . 72.439999999999998 108.604 176.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.255 1.363 0 N-CA-C 108.273 -1.01 . . . . 74.409999999999997 108.273 177.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 2.1 p80 . . . . . 0 CA--C 1.531 0.231 0 N-CA-C 107.942 -1.133 . . . . 75.099999999999994 107.942 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . 0.256 12.9 pt-20 49.69 81.72 0.06 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.911 1.685 . . . . 74.310000000000002 111.461 -176.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.42 39.64 14.9 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 126.288 1.835 . . . . 64.109999999999999 112.756 -177.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.3 mmtt -107.38 -9.46 16.01 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 125.166 1.386 . . . . 75.200000000000003 112.487 -178.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -51.15 -31.22 19.08 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.006 1.322 . . . . 75.120000000000005 113.817 176.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.33 -8.11 29.86 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.438 1.095 . . . . 75.099999999999994 113.169 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 18.0 t-80 -117.88 161.2 20.14 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 126.648 1.979 . . . . 71.340000000000003 107.63 -175.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 58.18 -158.07 0.29 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.405 1.082 . . . . 75.129999999999995 109.133 177.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -136.33 -34.11 0.79 Allowed 'General case' 0 C--O 1.223 -0.312 0 C-N-CA 124.277 1.031 . . . . 74.200000000000003 109.222 159.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -45.92 -40.36 10.07 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 125.074 1.35 . . . . 74.299999999999997 111.939 177.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 18.7 mt -66.16 -39.45 89.8 Favored 'General case' 0 C--N 1.331 -0.201 0 O-C-N 120.936 -1.102 . . . . 73.540000000000006 110.918 -175.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -76.76 -26.64 54.76 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.365 1.466 . . . . 72.299999999999997 110.611 174.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -55.36 -39.88 70.61 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.811 1.244 . . . . 72.310000000000002 111.229 -169.697 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.1 ptmt -54.38 -46.5 73.07 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 120.692 -1.255 . . . . 73.530000000000001 111.259 175.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.38 -58.71 5.22 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 125.693 1.597 . . . . 74.0 110.847 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -67.82 -3.45 9.6 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.06 0.763 . . . . 60.509999999999998 113.06 -176.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -116.38 11.41 14.97 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.675 1.99 . . . . 64.310000000000002 112.888 171.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.6 mmt-85 -74.84 -14.42 60.68 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 119.626 -1.921 . . . . 74.340000000000003 112.543 175.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -47.17 -72.41 0.05 Allowed 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 127.37 2.268 . . . . 74.109999999999999 112.819 -163.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -74.13 -5.91 44.55 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 120.76 1.618 . . . . 75.209999999999994 112.993 -177.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.14 -34.98 66.4 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 121.143 1.792 . . . . 74.439999999999998 111.624 -177.027 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.25 -11.76 58.47 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 112.464 0.542 . . . . 74.230000000000004 112.464 -175.674 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -66.93 -22.26 65.95 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 126.103 1.761 . . . . 74.120000000000005 114.239 -171.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -70.08 -31.75 69.38 Favored Glycine 0 C--O 1.224 -0.487 0 C-N-CA 120.608 -0.806 . . . . 74.0 111.301 -179.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 75.4 mt-10 -64.65 -33.58 76.26 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 124.035 0.934 . . . . 74.310000000000002 111.517 -172.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 9.0 t90 -58.07 -77.74 0.03 OUTLIER 'General case' 0 C--O 1.233 0.194 0 C-N-CA 124.518 1.127 . . . . 75.230000000000004 108.08 168.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -57.28 -29.18 63.64 Favored 'General case' 0 C--O 1.218 -0.565 0 C-N-CA 125.886 1.674 . . . . 74.439999999999998 112.745 -168.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -46.16 -54.56 8.45 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 120.321 1.419 . . . . 74.140000000000001 112.038 176.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -57.86 -40.42 93.05 Favored Glycine 0 CA--C 1.531 1.033 0 CA-C-N 118.707 0.685 . . . . 74.129999999999995 111.443 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.4 mp -63.06 -42.58 99.74 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.364 1.466 . . . . 74.120000000000005 110.362 178.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.5 mp -70.08 -0.58 7.93 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 127.899 2.479 . . . . 72.129999999999995 113.198 172.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 71.96 25.54 74.54 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 124.862 1.22 . . . . 71.140000000000001 112.523 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 45.1 mttt -107.98 148.51 29.6 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 125.329 1.452 . . . . 74.530000000000001 108.629 174.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.0 p -142.95 166.78 23.7 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-O 121.283 0.563 . . . . 71.239999999999995 110.767 171.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 67.13 -113.69 5.79 Favored Glycine 0 N--CA 1.444 -0.793 0 C-N-CA 124.881 1.229 . . . . 74.150000000000006 110.965 168.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -73.44 -41.85 62.71 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.207 -0.497 . . . . 71.340000000000003 111.304 -171.236 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.22 -36.37 82.87 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 110.158 -0.312 . . . . 74.209999999999994 110.158 178.19 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.54 -43.81 93.41 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 122.91 0.484 . . . . 73.349999999999994 110.86 173.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.7 ttt180 -65.27 -47.77 75.51 Favored 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 124.221 1.008 . . . . 74.209999999999994 108.959 179.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.83 -48.13 78.04 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 118.888 -0.577 . . . . 72.450000000000003 110.354 -176.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 45.4 t80 -50.6 -52.6 37.73 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 124.157 0.983 . . . . 74.310000000000002 110.03 172.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.56 -26.55 55.4 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 113.219 0.822 . . . . 74.439999999999998 113.219 178.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 16.3 mt -76.35 -16.95 59.63 Favored 'General case' 0 C--N 1.333 -0.148 0 O-C-N 120.63 -1.294 . . . . 73.200000000000003 111.486 -175.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.6 t -121.26 -8.09 9.25 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 119.965 1.257 . . . . 73.540000000000006 112.664 -172.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 4.7 p -73.19 3.04 1.02 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.095 0 N-CA-C 115.53 1.678 . . . . 63.299999999999997 115.53 -173.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 70.4 t -78.14 110.49 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 O-C-N 119.261 -2.149 . . . . 73.109999999999999 109.315 -168.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.7 p -79.82 -85.98 0.08 Allowed 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.611 1.165 . . . . 74.340000000000003 110.823 177.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.4 t . . . . . 0 CA--C 1.537 0.474 0 N-CA-C 107.053 -1.462 . . . . 72.430000000000007 107.053 -176.412 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . 0.299 44.0 m-20 . . . . . 0 CA--C 1.536 0.414 0 CA-C-O 118.004 -0.998 . . . . 55.039999999999999 112.277 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.4 t -48.96 -61.61 0.54 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 C-N-CA 125.628 1.571 . . . . 75.510000000000005 111.13 177.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -71.08 -42.35 69.48 Favored 'General case' 0 CA--C 1.527 0.061 0 C-N-CA 123.611 0.764 . . . . 72.530000000000001 110.647 177.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -51.84 -50.25 61.26 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.365 1.066 . . . . 64.340000000000003 110.334 -173.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -67.95 -37.8 82.02 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 118.874 -0.584 . . . . 72.209999999999994 110.672 -175.404 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.89 -52.46 56.4 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-N 119.062 0.846 . . . . 73.329999999999998 110.276 174.853 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.24 -21.06 65.99 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.629 1.104 . . . . 61.340000000000003 112.365 -177.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.99 -63.7 1.01 Allowed 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.892 0.877 . . . . 75.230000000000004 110.606 166.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.61 -21.71 66.6 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.859 0.863 . . . . 71.409999999999997 112.698 -174.049 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.3 tp -113.1 19.29 17.3 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.918 2.487 . . . . 75.120000000000005 110.79 -171.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -51.23 110.24 0.42 Allowed 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.586 1.954 . . . . 62.210000000000001 108.821 171.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 94.62 0.14 64.85 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 125.187 1.375 . . . . 72.109999999999999 114.319 178.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.6 7.45 5.28 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.956 1.702 . . . . 72.430000000000007 111.5 178.803 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -135.21 176.98 8.17 Favored 'General case' 0 C--O 1.233 0.234 0 O-C-N 120.87 -1.144 . . . . 52.409999999999997 111.116 177.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -138.24 168.62 19.36 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 114.168 -1.378 . . . . 73.420000000000002 107.659 158.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 87.5 mt-10 -66.09 -19.19 65.77 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 112.195 -2.275 . . . . 75.219999999999999 111.442 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -110.15 -8.93 14.72 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.022 0.828 . . . . 75.109999999999999 111.403 177.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.1 m -84.2 -41.36 17.06 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.641 -0.662 . . . . 72.239999999999995 110.678 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 79.5 mt -60.2 -44.63 95.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-N 119.727 1.149 . . . . 62.439999999999998 109.504 -179.018 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -58.71 -24.94 62.36 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 118.34 0.518 . . . . 75.299999999999997 112.218 178.208 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -94.12 -5.52 47.05 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 118.548 -0.739 . . . . 74.299999999999997 111.943 -178.721 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -93.23 -64.52 1.08 Allowed 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 120.046 1.293 . . . . 72.329999999999998 110.154 173.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 2.0 mtm -64.71 -29.09 70.07 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 119.597 -0.841 . . . . 75.540000000000006 111.62 -161.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 27.4 t -63.51 -47.53 91.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 125.106 1.362 . . . . 73.510000000000005 110.795 176.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -59.65 -45.99 90.35 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 119.301 0.955 . . . . 54.420000000000002 111.23 -170.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.3 mt -72.38 -0.74 13.21 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 125.126 1.37 . . . . 74.200000000000003 110.704 -167.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 45.3 ttt180 -51.17 -38.6 53.1 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 124.254 1.022 . . . . 75.420000000000002 110.764 164.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.01 -53.31 40.25 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.974 0.807 . . . . 75.109999999999999 110.711 176.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.0 m -54.7 -31.27 57.74 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.027 1.731 . . . . 72.010000000000005 111.283 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.7 -53.37 59.12 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.431 1.092 . . . . 74.299999999999997 112.313 -178.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -70.43 -37.55 74.41 Favored 'General case' 0 CA--C 1.519 -0.229 0 C-N-CA 120.053 -0.659 . . . . 71.140000000000001 110.991 179.232 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -59.0 -46.29 88.55 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-O 118.072 -0.966 . . . . 71.129999999999995 111.488 -174.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -59.62 -31.98 69.99 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 119.029 0.831 . . . . 63.020000000000003 112.791 -174.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 27.2 mm -73.39 -38.2 52.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 O-C-N 121.224 -0.922 . . . . 75.099999999999994 110.374 177.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 82.3 mt -74.76 -13.63 15.54 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 C-N-CA 124.187 0.995 . . . . 74.099999999999994 109.191 177.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 16.1 t -85.62 -40.82 15.81 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.213 1.405 . . . . 72.400000000000006 108.154 174.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -128.71 65.61 1.42 Allowed 'General case' 0 C--O 1.239 0.541 0 C-N-CA 124.745 1.218 . . . . 74.010000000000005 107.781 -169.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 5.1 mp . . . . . 0 C--O 1.253 1.286 0 N-CA-C 107.403 -1.332 . . . . 74.439999999999998 107.403 176.499 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.539 0.533 0 N-CA-C 114.39 1.256 . . . . 73.400000000000006 114.39 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -50.94 98.38 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 127.232 2.213 . . . . 72.510000000000005 110.676 179.469 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 53.05 11.85 0.25 Allowed 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 115.846 1.795 . . . . 72.430000000000007 115.846 -171.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 54.3 mttt -84.71 -4.04 58.84 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 124.691 1.197 . . . . 72.5 113.192 177.153 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -55.18 -30.36 59.74 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 120.927 1.694 . . . . 73.239999999999995 112.445 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -77.76 5.51 9.28 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.749 1.018 . . . . 70.5 113.749 179.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 10.2 t-80 -143.47 176.61 9.05 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.607 1.563 . . . . 64.219999999999999 109.472 -176.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 62.76 -171.8 0.16 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.87 1.668 . . . . 73.239999999999995 111.992 165.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -118.3 -35.82 3.71 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 124.713 1.205 . . . . 73.129999999999995 110.001 171.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.3 mp0 -45.08 -50.25 11.12 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 127.409 2.284 . . . . 74.439999999999998 112.327 -172.612 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.638 ' CD2' ' H ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER -75.23 -44.18 47.63 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 124.255 1.022 . . . . 74.420000000000002 111.568 -176.882 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -57.51 -44.97 85.44 Favored 'General case' 0 C--O 1.219 -0.527 0 C-N-CA 125.017 1.327 . . . . 73.209999999999994 109.988 178.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.72 -48.22 66.81 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.006 1.322 . . . . 73.239999999999995 110.249 -177.868 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 42.3 mttp -61.48 -57.65 11.32 Favored 'General case' 0 C--O 1.232 0.175 0 O-C-N 121.584 -0.697 . . . . 72.510000000000005 110.352 171.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -71.98 -16.16 62.07 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 114.248 1.203 . . . . 71.040000000000006 114.248 -165.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -62.48 -50.82 69.92 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 127.561 2.344 . . . . 74.030000000000001 108.783 167.027 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.57 16.95 17.4 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 114.333 1.234 . . . . 65.200000000000003 114.333 -145.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -109.86 -6.97 15.07 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 116.301 1.963 . . . . 73.129999999999995 116.301 -154.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.9 ptt180 -62.64 -16.62 57.71 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 121.375 1.898 . . . . 73.230000000000004 115.319 -170.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -116.95 -13.4 10.64 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 126.346 1.859 . . . . 70.109999999999999 112.636 173.248 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.1 -8.32 11.64 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 121.575 1.989 . . . . 74.219999999999999 113.625 -175.583 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -104.68 -3.2 23.98 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 126.457 1.903 . . . . 73.120000000000005 114.697 179.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 35.6 tp -68.71 -35.3 76.99 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 123.759 0.824 . . . . 74.120000000000005 111.043 -176.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -57.09 -42.87 93.36 Favored Glycine 0 C--O 1.221 -0.715 0 CA-C-O 118.78 -1.011 . . . . 53.219999999999999 110.72 166.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -64.77 -16.74 63.42 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 118.924 1.362 . . . . 74.329999999999998 112.369 -176.041 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 14.2 t90 -80.64 -63.7 1.35 Allowed 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.955 0.902 . . . . 74.129999999999995 109.137 164.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.7 -29.67 27.94 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.577 1.551 . . . . 63.119999999999997 114.189 -174.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.02 -61.51 2.22 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 125.927 1.691 . . . . 65.200000000000003 111.385 -177.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.85 -15.53 58.09 Favored Glycine 0 CA--C 1.531 1.082 0 CA-C-N 118.709 0.686 . . . . 71.040000000000006 113.153 -177.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 19.8 mt -76.69 -43.91 35.81 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.789 1.236 . . . . 72.200000000000003 109.215 173.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 24.2 mt -71.33 1.66 5.89 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.955 2.102 . . . . 70.200000000000003 112.001 165.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.05 0.5 44.02 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.763 1.649 . . . . 65.200000000000003 114.278 -177.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -65.51 127.52 32.17 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 125.386 1.474 . . . . 72.340000000000003 107.431 173.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.6 p -140.69 147.52 39.38 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.408 -0.59 . . . . 73.040000000000006 109.408 -179.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 82.27 -129.89 9.35 Favored Glycine 0 C--N 1.33 0.23 0 N-CA-C 111.17 -0.772 . . . . 74.319999999999993 111.17 172.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -70.04 -28.31 65.36 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.353 -0.61 . . . . 71.040000000000006 109.353 179.305 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -62.49 -41.29 98.7 Favored 'General case' 0 CA--C 1.514 -0.424 0 C-N-CA 125.181 1.392 . . . . 71.230000000000004 111.131 177.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.85 -57.26 7.35 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 107.385 -1.339 . . . . 72.409999999999997 107.385 172.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.07 -51.85 29.06 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 118.62 0.645 . . . . 74.200000000000003 112.116 -175.449 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.47 -38.65 90.64 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.009 1.323 . . . . 74.420000000000002 111.799 -179.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -62.73 -44.1 97.08 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.923 0.889 . . . . 74.420000000000002 110.289 174.392 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.4 -27.11 68.78 Favored 'General case' 0 CA--C 1.53 0.182 0 O-C-N 121.299 -0.875 . . . . 74.400000000000006 112.992 -176.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 9.2 mt -60.28 -49.02 79.27 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 119.031 0.832 . . . . 71.319999999999993 108.861 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.5 t -76.25 6.19 5.85 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 125.155 1.382 . . . . 74.329999999999998 112.04 179.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 98.6 t -119.48 94.04 2.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 C-N-CA 125.355 1.462 . . . . 73.109999999999999 108.41 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.5 p -140.93 157.46 22.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 106.533 -1.654 . . . . 73.010000000000005 106.533 155.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 13.4 t -171.49 -170.77 0.84 Allowed 'General case' 0 C--O 1.239 0.547 0 C-N-CA 126.233 1.813 . . . . 53.5 106.562 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 49.1 m . . . . . 0 CA--C 1.536 0.42 0 C-N-CA 125.224 1.41 . . . . 73.0 110.07 -177.674 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 41.0 t0 . . . . . 0 CA--C 1.537 0.471 0 N-CA-C 113.749 1.018 . . . . 45.43 113.749 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 67.5 t -106.33 -41.57 6.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 O-C-N 120.331 -1.481 . . . . 73.400000000000006 109.684 168.266 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -49.6 -37.59 28.36 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.282 1.033 . . . . 74.230000000000004 111.438 176.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.0 -28.25 16.3 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.647 1.579 . . . . 72.140000000000001 113.932 175.329 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -86.25 -41.6 14.48 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 108.529 -0.915 . . . . 62.100000000000001 108.529 -176.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.21 -52.82 11.26 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.407 0.683 . . . . 74.340000000000003 110.728 -178.722 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.34 -21.92 66.75 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 125.17 1.388 . . . . 74.010000000000005 111.356 -175.362 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.25 -41.84 96.77 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 118.461 0.573 . . . . 73.219999999999999 111.001 169.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.02 -53.33 15.15 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 107.954 -1.128 . . . . 70.239999999999995 107.954 177.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 65.5 mt -83.91 33.12 0.48 Allowed 'General case' 0 C--O 1.233 0.218 0 C-N-CA 125.551 1.54 . . . . 74.319999999999993 111.794 -179.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -67.64 121.06 15.08 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 106.429 -1.693 . . . . 74.329999999999998 106.429 175.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 85.44 -0.27 88.4 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 124.977 1.275 . . . . 74.120000000000005 113.756 -173.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -135.6 -5.28 2.25 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 118.744 1.272 . . . . 73.439999999999998 113.224 -161.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -164.07 122.4 1.85 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-N 119.99 1.268 . . . . 65.230000000000004 110.531 179.024 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.85 161.27 29.13 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.334 1.054 . . . . 64.0 108.896 175.196 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -49.08 -52.66 24.41 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 126.01 1.724 . . . . 73.329999999999998 108.664 165.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -66.78 -8.39 28.05 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.177 1.391 . . . . 72.120000000000005 112.225 -171.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 17.9 m -111.88 -44.18 3.5 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 126.512 1.925 . . . . 73.439999999999998 110.319 -179.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 74.5 mt -52.46 -56.46 6.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-N 119.654 1.115 . . . . 74.340000000000003 108.276 172.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -56.5 -29.95 62.43 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 123.515 0.726 . . . . 74.310000000000002 112.015 -175.125 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -84.16 -50.18 8.16 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 124.435 1.094 . . . . 65.239999999999995 109.242 -174.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.8 tppt? -60.17 -36.36 77.4 Favored 'General case' 0 N--CA 1.463 0.19 0 O-C-N 121.749 -0.594 . . . . 72.329999999999998 111.313 -173.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 28.7 mtt -54.26 -52.81 60.2 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.864 0.466 . . . . 71.040000000000006 109.775 173.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 79.3 t -61.78 -30.65 48.88 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 125.376 1.47 . . . . 74.0 110.854 -177.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 62.1 tt0 -69.5 -52.4 26.87 Favored 'General case' 0 CA--C 1.53 0.186 0 O-C-N 121.062 -1.024 . . . . 71.310000000000002 110.274 174.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 38.9 mt -67.52 -24.86 65.61 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.309 1.044 . . . . 73.420000000000002 110.44 -176.284 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 42.0 ttp180 -56.93 -33.39 66.93 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 124.955 1.302 . . . . 72.109999999999999 110.605 174.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -68.26 -47.88 66.53 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 118.533 -0.746 . . . . 74.239999999999995 111.11 177.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 31.0 m -56.0 -81.87 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 126.582 1.953 . . . . 71.329999999999998 110.098 -178.305 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 43.55 -75.03 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.306 1 C-N-CA 132.874 4.47 . . . . 74.409999999999997 113.983 165.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 20.0 ptt-85 -66.6 -40.24 88.77 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.235 -0.893 . . . . 74.230000000000004 109.727 -177.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -59.78 -36.16 76.13 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-O 117.973 -1.013 . . . . 71.140000000000001 110.589 -177.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -57.98 -42.18 84.56 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 118.981 0.81 . . . . 74.230000000000004 111.291 -177.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 24.1 mm -56.81 -45.49 83.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-N 119.775 1.171 . . . . 74.329999999999998 109.6 176.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 27.8 mt -74.15 -17.53 16.99 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 C-N-CA 124.379 1.072 . . . . 74.530000000000001 110.075 -177.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 21.0 t -87.38 -0.9 57.46 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.142 1.777 . . . . 74.120000000000005 110.578 172.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 78.8 mt-10 -132.12 42.61 3.12 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 126.325 1.85 . . . . 74.329999999999998 107.536 -166.143 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.0 mt . . . . . 0 C--O 1.251 1.18 0 N-CA-C 105.328 -2.101 . . . . 74.430000000000007 105.328 169.647 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.533 0.289 0 N-CA-C 112.809 0.67 . . . . 74.540000000000006 112.809 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . 0.285 5.1 pt-20 44.65 -84.98 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 128.998 2.919 . . . . 73.310000000000002 114.318 -178.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.91 -22.1 64.02 Favored 'General case' 0 N--CA 1.462 0.163 0 O-C-N 121.243 -0.911 . . . . 74.329999999999998 113.214 176.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 3.4 mptt -64.96 -19.52 66.0 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-O 117.034 -1.46 . . . . 75.129999999999995 113.798 171.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -54.29 -39.83 67.3 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 121.699 2.045 . . . . 64.140000000000001 112.278 -177.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.65 -11.47 45.1 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.451 1.1 . . . . 74.329999999999998 113.467 177.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 -104.24 164.05 11.99 Favored 'General case' 0 N--CA 1.445 -0.705 0 C-N-CA 126.732 2.013 . . . . 74.420000000000002 108.422 177.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 51.34 -154.93 0.15 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.402 1.081 . . . . 74.129999999999995 108.571 -176.02 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -133.99 -19.83 1.99 Allowed 'General case' 0 C--O 1.222 -0.363 0 C-N-CA 125.038 1.335 . . . . 72.129999999999995 109.086 148.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -44.21 -43.37 7.15 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 127.437 2.295 . . . . 61.329999999999998 111.959 177.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 11.9 mt -67.83 -44.15 77.91 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 125.649 1.58 . . . . 63.200000000000003 111.56 -176.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -83.88 -20.72 32.58 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 123.6 0.76 . . . . 74.420000000000002 111.813 -178.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.29 -55.13 19.9 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 124.257 1.023 . . . . 75.140000000000001 109.081 -169.606 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.7 pttp -45.01 -53.44 7.75 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 124.793 1.237 . . . . 75.420000000000002 113.36 176.369 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.83 -57.1 11.31 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.11 0.964 . . . . 72.519999999999996 110.335 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -78.16 13.42 1.48 Allowed 'General case' 0 C--O 1.242 0.684 0 C-N-CA 124.568 1.147 . . . . 74.420000000000002 112.76 -176.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.1 3.21 2.63 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 124.823 1.249 . . . . 75.430000000000007 112.656 -173.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.94 7.48 13.22 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.655 1.116 . . . . 74.230000000000004 113.994 -173.185 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 20.3 ptt-85 -60.19 -33.69 72.57 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 121.025 1.738 . . . . 72.230000000000004 109.874 177.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -70.63 -12.5 61.6 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 120.547 -1.346 . . . . 72.120000000000005 112.606 -179.762 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -81.71 -50.7 8.98 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 120.41 1.459 . . . . 75.239999999999995 109.516 -175.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.29 -13.37 62.35 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 115.633 -0.712 . . . . 75.439999999999998 112.452 -179.693 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 17.0 mt -58.36 -32.18 68.31 Favored 'General case' 0 N--CA 1.468 0.448 0 O-C-N 120.645 -1.284 . . . . 63.240000000000002 111.457 171.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -72.98 -6.56 68.22 Favored Glycine 0 CA--C 1.528 0.882 0 O-C-N 121.25 -0.906 . . . . 54.439999999999998 112.28 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -83.09 -20.52 34.72 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 120.94 -1.329 . . . . 73.340000000000003 111.822 171.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 36.7 t90 -74.68 -82.06 0.07 Allowed 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.336 1.054 . . . . 74.329999999999998 108.668 179.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.68 -17.25 21.0 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.211 1.404 . . . . 55.049999999999997 113.791 -171.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -51.66 -55.44 19.42 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.174 0.59 . . . . 71.340000000000003 110.363 172.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -62.26 -41.98 99.72 Favored Glycine 0 CA--C 1.527 0.814 0 N-CA-C 111.276 -0.73 . . . . 62.43 111.276 -175.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.0 mp -56.56 -34.11 66.8 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.57 1.548 . . . . 73.549999999999997 111.695 176.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 71.8 mt -94.54 4.37 53.94 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.766 2.027 . . . . 73.409999999999997 112.456 176.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 76.41 42.58 22.39 Favored Glycine 0 CA--C 1.527 0.833 0 O-C-N 120.849 -1.157 . . . . 74.209999999999994 113.109 176.314 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 30.5 mttm -127.34 132.66 50.18 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 126.358 1.863 . . . . 74.530000000000001 108.038 176.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 45.3 p -134.45 -179.1 5.37 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 124.797 1.239 . . . . 71.430000000000007 108.094 164.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 46.49 -123.08 6.92 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 125.398 1.475 . . . . 73.519999999999996 113.318 173.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -63.49 -31.42 72.58 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 117.405 0.602 . . . . 72.239999999999995 112.372 -174.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -77.07 -40.26 46.79 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.677 0.751 . . . . 75.349999999999994 110.846 -177.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.12 -33.3 74.2 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.846 -0.616 . . . . 75.140000000000001 110.272 168.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 7.0 ttm-85 -58.24 -55.95 28.4 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.417 -0.957 . . . . 75.450000000000003 108.417 173.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.68 -43.01 80.05 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.852 1.261 . . . . 74.310000000000002 111.103 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -60.67 -41.92 96.05 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.347 1.059 . . . . 75.129999999999995 111.344 175.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.97 -0.49 18.92 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 120.476 -1.39 . . . . 74.150000000000006 113.345 -178.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.4 mt -79.42 5.31 13.02 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 120.782 1.628 . . . . 74.409999999999997 112.331 177.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.31 -22.46 1.75 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.534 1.133 . . . . 64.319999999999993 112.466 -174.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 35.6 m -64.43 -12.08 11.66 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 N-CA-C 115.526 1.676 . . . . 74.530000000000001 115.526 -171.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 9.9 t -88.23 115.85 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 N-CA-C 107.935 -1.135 . . . . 73.540000000000006 107.935 -170.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.2 t -139.8 -53.69 0.54 Allowed 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 126.304 1.841 . . . . 73.25 106.359 -178.21 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.7 t . . . . . 0 CA--C 1.531 0.221 0 C-N-CA 125.264 1.426 . . . . 74.109999999999999 110.432 176.864 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 . . . . . 0 C--O 1.224 -0.258 0 CA-C-O 119.033 -0.508 . . . . 75.140000000000001 111.298 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.413 ' HA ' ' HE3' ' A' ' 71' ' ' LYS . 57.3 t -63.16 -36.74 77.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-N 119.255 0.934 . . . . 55.109999999999999 110.305 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -89.74 -19.1 25.17 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 123.797 0.839 . . . . 72.109999999999999 110.189 -179.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.5 -36.17 79.74 Favored 'General case' 0 CA--C 1.522 -0.133 0 N-CA-C 115.154 1.539 . . . . 74.540000000000006 115.154 -167.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.413 ' HE3' ' HA ' ' A' ' 68' ' ' VAL . 0.0 OUTLIER -68.74 -53.44 21.93 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 106.635 -1.617 . . . . 74.140000000000001 106.635 -175.508 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -47.6 -61.39 1.96 Allowed 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 126.102 1.761 . . . . 71.150000000000006 109.064 172.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.89 -42.98 76.77 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 124.154 0.909 . . . . 43.240000000000002 111.405 -171.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -75.53 -35.64 60.68 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.776 1.028 . . . . 75.209999999999994 113.776 -179.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -73.75 -44.07 57.28 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 120.904 -1.123 . . . . 63.520000000000003 109.419 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 12.6 tp -86.04 13.76 7.21 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 128.332 2.653 . . . . 73.209999999999994 110.681 -179.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -55.73 123.08 12.94 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 125.407 1.483 . . . . 74.25 108.43 -178.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 98.75 -11.43 62.72 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 124.787 1.184 . . . . 63.549999999999997 113.728 -174.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.5 mtmm -128.71 6.6 5.62 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 119.058 1.429 . . . . 74.140000000000001 112.534 -171.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -146.92 174.32 11.61 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.997 0.919 . . . . 75.519999999999996 109.735 170.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -130.35 156.8 44.1 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 125.329 1.452 . . . . 73.310000000000002 107.595 -178.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 68.3 mm-40 -66.26 -20.76 66.2 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 125.207 1.403 . . . . 74.140000000000001 112.425 -177.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 21.8 pt-20 -94.78 -22.77 17.86 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 120.929 -1.107 . . . . 54.210000000000001 112.371 170.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.5 m -79.38 -40.71 29.45 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.028 0.931 . . . . 63.210000000000001 110.583 -172.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 77.6 mt -56.65 -57.34 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 CA-C-N 119.524 1.056 . . . . 75.340000000000003 108.507 -177.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.87 -41.11 90.81 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-N 118.15 0.432 . . . . 73.540000000000006 112.123 -179.646 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.51 -44.78 85.31 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 122.967 0.507 . . . . 74.209999999999994 110.385 -179.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.73 -26.17 61.43 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.861 0.864 . . . . 75.510000000000005 112.465 -179.482 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 21.9 mtt -73.1 -41.2 64.3 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 119.014 0.825 . . . . 74.140000000000001 110.803 177.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 11.9 t -73.11 -31.19 33.99 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.137 0.975 . . . . 75.120000000000005 110.129 178.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -48.61 -57.71 5.8 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 126.074 1.75 . . . . 72.239999999999995 111.769 -174.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.93 25.3 0.12 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.767 1.627 . . . . 71.120000000000005 114.138 -179.41 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 3.4 mtt-85 -50.54 -48.28 57.35 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 125.61 1.564 . . . . 74.299999999999997 113.539 -177.408 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.17 -38.88 21.75 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 123.924 0.89 . . . . 75.329999999999998 109.939 177.374 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.8 m -50.8 -39.09 51.98 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.561 1.544 . . . . 75.310000000000002 110.817 -179.122 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.3 -38.63 77.43 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.14 -0.975 . . . . 73.540000000000006 113.591 178.352 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -86.24 -27.02 24.71 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.313 0.96 . . . . 75.519999999999996 112.156 175.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -66.84 -48.91 67.42 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.99 0.916 . . . . 75.530000000000001 111.78 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -59.59 -29.25 67.83 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 118.297 0.498 . . . . 64.239999999999995 111.918 -169.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 42.3 mm -67.39 -32.42 57.22 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 124.488 1.115 . . . . 74.5 112.351 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 51.3 mt -88.95 -21.85 6.76 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 N-CA-C 108.529 -0.915 . . . . 75.420000000000002 108.529 176.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 4.3 t -71.34 -37.31 71.71 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.973 -0.454 . . . . 62.140000000000001 109.804 172.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -135.53 76.04 1.59 Allowed 'General case' 0 C--O 1.236 0.367 0 C-N-CA 127.012 2.125 . . . . 74.439999999999998 105.549 -165.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 9.1 mt . . . . . 0 C--O 1.247 0.951 0 C-N-CA 127.602 2.361 . . . . 74.510000000000005 107.896 -177.416 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 1.9 p80 . . . . . 0 CA--C 1.539 0.539 0 CA-C-O 119.795 -0.145 . . . . 75.540000000000006 110.719 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -67.72 108.4 2.92 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 107.972 -1.121 . . . . 75.439999999999998 107.972 -174.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.15 14.33 5.41 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.242 1.417 . . . . 72.299999999999997 114.101 -179.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 13.3 mttt -85.15 -3.81 58.94 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.132 1.773 . . . . 72.519999999999996 113.44 176.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -68.46 -32.65 72.82 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 120.732 -1.23 . . . . 63.299999999999997 110.321 -165.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -79.91 14.24 1.87 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.043 1.737 . . . . 71.519999999999996 113.309 171.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -127.47 -21.41 3.83 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.983 1.265 . . . . 72.209999999999994 114.123 -164.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -152.58 168.13 26.58 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.745 1.157 . . . . 74.540000000000006 110.361 176.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -69.88 -46.0 66.43 Favored 'General case' 0 C--O 1.224 -0.281 0 O-C-N 121.608 -0.682 . . . . 73.420000000000002 111.295 171.169 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -45.61 -54.55 7.52 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.349 1.46 . . . . 64.120000000000005 112.119 -166.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.671 ' CD2' ' H ' ' A' ' 21' ' ' LEU . 0.1 OUTLIER -63.77 -39.48 94.37 Favored 'General case' 0 N--CA 1.436 -1.134 0 O-C-N 120.869 -1.144 . . . . 74.540000000000006 111.441 -175.542 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -61.65 -42.94 99.6 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.859 0.863 . . . . 73.200000000000003 110.872 174.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -55.24 -39.76 70.11 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.705 0.802 . . . . 74.230000000000004 109.95 172.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.07 -40.21 73.22 Favored 'General case' 0 C--N 1.342 0.247 0 O-C-N 120.625 -1.297 . . . . 73.109999999999999 112.351 173.351 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.26 -47.76 72.66 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 119.465 1.029 . . . . 73.519999999999996 111.716 174.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -58.23 -30.4 66.48 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 121.41 0.624 . . . . 75.5 110.578 177.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -99.09 25.2 6.98 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 126.677 1.991 . . . . 73.430000000000007 110.856 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.9 mmt-85 -114.4 -6.75 12.91 Favored 'General case' 0 N--CA 1.463 0.223 0 O-C-N 120.852 -1.155 . . . . 75.310000000000002 111.303 165.014 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 30.9 ptt-85 -60.6 -29.92 69.5 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 119.632 1.105 . . . . 75.340000000000003 112.197 -176.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -94.92 -13.32 25.51 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 123.864 0.865 . . . . 72.230000000000004 112.401 177.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -59.84 4.58 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 120.451 1.478 . . . . 74.530000000000001 110.032 178.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.5 mp -69.26 -25.53 64.32 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.51 -0.768 . . . . 74.450000000000003 109.91 -166.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 60.6 mt -51.96 -33.13 36.37 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.176 0.99 . . . . 74.349999999999994 112.69 173.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -75.24 -36.12 46.36 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 110.124 -1.191 . . . . 72.310000000000002 110.124 -179.113 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -69.17 -23.2 63.91 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.468 1.507 . . . . 72.25 111.486 -179.29 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 19.0 t90 -67.79 -78.52 0.06 Allowed 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.406 1.082 . . . . 75.310000000000002 108.477 166.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.5 -26.06 53.23 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 124.481 1.113 . . . . 61.020000000000003 113.242 -168.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -45.84 -54.22 8.46 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.309 0.958 . . . . 74.319999999999993 111.186 170.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.82 -44.12 97.33 Favored Glycine 0 CA--C 1.53 0.97 0 N-CA-C 111.558 -0.617 . . . . 54.109999999999999 111.558 -176.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.5 mp -58.47 -51.64 69.0 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 126.695 1.998 . . . . 73.329999999999998 110.61 176.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.4 mp -54.93 -42.19 71.97 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.678 1.191 . . . . 75.319999999999993 111.304 174.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 112.21 24.83 4.96 Favored Glycine 0 CA--C 1.519 0.307 0 C-N-CA 124.519 1.057 . . . . 64.109999999999999 112.225 -175.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 33.0 mttm -97.31 137.89 35.62 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 126.89 2.076 . . . . 75.450000000000003 107.249 172.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 36.4 p -139.42 167.91 21.03 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 123.806 0.842 . . . . 64.329999999999998 109.011 -178.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 54.04 -130.72 44.23 Favored Glycine 0 CA--C 1.521 0.469 0 C-N-CA 124.747 1.165 . . . . 75.239999999999995 110.81 173.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -71.39 -22.3 61.89 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 118.335 -0.84 . . . . 74.129999999999995 112.878 -179.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -64.16 -47.05 81.36 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.99 1.268 . . . . 74.409999999999997 110.599 175.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.54 -46.61 88.37 Favored 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 125.052 1.341 . . . . 64.340000000000003 109.76 173.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 6.3 ttm-85 -57.22 -50.5 72.68 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.624 0.77 . . . . 73.109999999999999 111.008 177.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.44 -29.51 70.19 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 126.535 1.934 . . . . 75.430000000000007 111.807 -178.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 82.5 t80 -73.31 -40.97 64.09 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.105 0.962 . . . . 75.409999999999997 109.516 171.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.16 7.18 0.61 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.55 1.14 . . . . 74.439999999999998 113.536 177.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 42.2 mt -88.28 -15.36 36.0 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.183 0.993 . . . . 72.219999999999999 111.863 172.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.9 t -125.01 3.65 8.0 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 119.211 0.914 . . . . 73.510000000000005 111.654 -169.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 5.9 p -62.7 -26.87 41.78 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 O-C-N 120.362 -1.461 . . . . 74.510000000000005 112.648 169.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 4.9 m -72.33 117.76 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.569 0 C-N-CA 127.017 2.127 . . . . 72.510000000000005 110.829 -173.482 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.438 HG22 ' H ' ' A' ' 58' ' ' SER . 0.7 OUTLIER -144.34 -85.69 0.13 Allowed 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 127.339 2.256 . . . . 72.430000000000007 107.106 175.217 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.438 ' H ' HG22 ' A' ' 57' ' ' THR . 10.0 m . . . . . 0 N--CA 1.452 -0.373 1 C-N-CA 131.726 4.01 . . . . 75.239999999999995 105.059 174.886 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 . . . . . 0 CA--C 1.542 0.635 0 N-CA-C 112.381 0.511 . . . . 63.109999999999999 112.381 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.8 p -93.78 -61.76 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 C-N-CA 124.663 1.185 . . . . 73.450000000000003 109.14 175.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -54.02 -30.82 49.09 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.435 1.494 . . . . 74.439999999999998 110.384 175.619 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.07 -32.87 16.72 Favored 'General case' 0 C--N 1.341 0.23 0 C-N-CA 126.57 1.948 . . . . 72.239999999999995 113.255 -171.765 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.8 mmtt -108.29 -32.97 7.25 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 118.327 -0.844 . . . . 75.209999999999994 110.946 175.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.36 -47.35 66.18 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.189 0.596 . . . . 75.409999999999997 110.7 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -57.01 -37.16 71.3 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 119.095 -0.478 . . . . 74.329999999999998 112.13 -178.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -80.23 -43.31 21.64 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.258 1.023 . . . . 74.140000000000001 111.532 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.15 -38.84 80.66 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 122.36 1.076 . . . . 72.439999999999998 109.194 178.319 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 9.2 tp -102.55 21.16 15.75 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 128.109 2.564 . . . . 74.329999999999998 111.071 -175.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 47.2 tt0 -52.48 114.95 1.54 Allowed 'General case' 0 C--O 1.233 0.234 0 C-N-CA 125.734 1.613 . . . . 63.130000000000003 109.919 -177.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.94 -3.66 81.03 Favored Glycine 0 CA--C 1.532 1.111 0 CA-C-O 118.432 -1.205 . . . . 71.340000000000003 113.112 175.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -118.59 3.74 11.73 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 126.701 2.001 . . . . 75.430000000000007 111.893 -172.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -142.68 173.18 11.77 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 126.765 2.026 . . . . 72.230000000000004 106.868 173.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -120.47 161.13 21.78 Favored 'General case' 0 C--O 1.24 0.554 0 N-CA-C 105.764 -1.939 . . . . 72.319999999999993 105.764 163.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -55.28 -53.65 53.45 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 123.589 0.756 . . . . 63.039999999999999 110.052 174.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -67.43 -19.25 65.35 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.41 -0.359 . . . . 75.209999999999994 110.655 -174.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 19.6 m -87.5 -39.7 14.94 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 124.788 1.235 . . . . 75.310000000000002 111.504 178.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 89.2 mt -56.79 -55.41 20.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-N 121.636 2.016 . . . . 75.439999999999998 108.377 171.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.65 -7.91 8.65 Favored 'General case' 0 N--CA 1.462 0.166 0 N-CA-C 112.553 0.575 . . . . 73.209999999999994 112.553 -179.107 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -122.5 42.26 3.21 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 125.567 1.547 . . . . 54.310000000000002 107.958 176.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -118.53 -41.27 2.83 Favored 'General case' 0 C--N 1.341 0.207 0 O-C-N 121.648 -0.658 . . . . 74.109999999999999 111.578 166.115 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -63.7 -44.51 93.45 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.28 0.632 . . . . 71.230000000000004 111.421 -175.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 42.2 t -67.76 -31.28 51.64 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 C-N-CA 125.332 1.453 . . . . 64.129999999999995 111.839 179.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.69 -60.36 3.78 Favored 'General case' 0 C--O 1.231 0.126 0 O-C-N 120.561 -1.337 . . . . 72.420000000000002 109.821 -169.266 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.88 16.9 1.68 Allowed 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 124.383 1.073 . . . . 75.530000000000001 112.103 -178.694 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 14.6 ttm180 -49.08 -44.78 42.29 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.451 1.101 . . . . 71.510000000000005 111.006 171.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.32 -58.62 7.52 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 118.713 -0.661 . . . . 73.310000000000002 109.961 175.095 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 5.8 m -52.57 -51.3 60.42 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.483 1.113 . . . . 74.5 110.538 -175.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -63.04 -23.68 67.56 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 113.682 0.994 . . . . 75.329999999999998 113.682 -176.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.2 -68.89 0.54 Allowed 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 106.064 -1.828 . . . . 71.530000000000001 106.064 165.679 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -44.97 -49.15 11.34 Favored 'General case' 0 CA--C 1.518 -0.278 0 C-N-CA 128.124 2.57 . . . . 71.519999999999996 113.197 -167.465 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -52.18 -35.72 49.71 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-O 117.919 -1.039 . . . . 75.530000000000001 112.27 -174.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 14.5 mm -57.94 -54.35 33.17 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 120.071 1.305 . . . . 75.519999999999996 111.056 -178.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 80.8 mt -62.63 -19.46 22.91 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 C-N-CA 123.67 0.788 . . . . 74.230000000000004 109.422 178.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.28 5.39 39.96 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 126.867 2.067 . . . . 71.129999999999995 113.153 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -121.26 11.82 10.87 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.94 1.696 . . . . 73.540000000000006 110.589 -175.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 35.2 mt . . . . . 0 C--O 1.248 1.007 0 C-N-CA 127.822 2.449 . . . . 73.400000000000006 110.733 -172.999 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.466 0.368 0 N-CA-C 115.069 1.507 . . . . 60.210000000000001 115.069 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.426 ' C ' ' H ' ' A' ' 14' ' ' LYS . 8.2 pt-20 -59.56 108.15 0.69 Allowed 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 127.666 2.386 . . . . 61.149999999999999 109.444 -173.489 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 55.8 -8.23 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 128.609 2.763 . . . . 70.019999999999996 115.806 -168.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.426 ' H ' ' C ' ' A' ' 12' ' ' GLU . 34.7 mttt -62.78 -23.29 67.15 Favored 'General case' 0 C--O 1.224 -0.254 0 C-N-CA 125.673 1.589 . . . . 73.409999999999997 113.137 -174.845 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -53.29 -29.36 32.92 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 119.651 1.114 . . . . 70.340000000000003 113.965 -176.01 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -97.83 2.62 49.53 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.715 0.806 . . . . 73.120000000000005 113.096 -178.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.4 m170 -125.45 -62.19 1.22 Allowed 'General case' 0 C--O 1.237 0.428 0 C-N-CA 125.929 1.692 . . . . 73.239999999999995 109.077 -170.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -85.93 112.14 20.89 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 106.793 -1.558 . . . . 74.010000000000005 106.793 174.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.53 -36.55 78.99 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-O 118.104 -0.951 . . . . 74.329999999999998 110.987 -175.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.448 ' H ' ' CD ' ' A' ' 20' ' ' GLU . 3.4 mp0 -54.5 -41.51 69.69 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.737 1.153 . . . . 65.129999999999995 111.368 -172.417 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.421 ' HA ' ' HE3' ' A' ' 24' ' ' LYS . 32.8 mt -64.01 -31.93 73.29 Favored 'General case' 0 C--O 1.233 0.234 0 O-C-N 121.599 -0.688 . . . . 72.349999999999994 111.989 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -84.83 -32.99 22.99 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 125.908 1.683 . . . . 74.040000000000006 110.861 176.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -55.14 -50.52 69.05 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 125.799 1.64 . . . . 74.319999999999993 109.183 -170.118 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.421 ' HE3' ' HA ' ' A' ' 21' ' ' LEU . 13.7 ptpt -52.05 -46.02 64.93 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.58 0.752 . . . . 74.439999999999998 111.992 175.247 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.21 -36.93 80.29 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 124.285 1.034 . . . . 63.439999999999998 111.016 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -71.49 -17.32 62.35 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.673 1.589 . . . . 64.129999999999995 111.201 176.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -123.97 25.58 7.89 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.573 1.949 . . . . 54.329999999999998 113.683 -169.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.321 0.0 OUTLIER -137.03 11.98 3.08 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 115.087 1.514 . . . . 74.010000000000005 115.087 177.421 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.8 ptt-85 -60.87 -18.71 57.77 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.955 1.465 . . . . 73.200000000000003 114.955 176.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -94.81 -24.02 17.24 Favored 'General case' 0 C--O 1.225 -0.217 0 CA-C-N 120.476 1.489 . . . . 72.140000000000001 110.671 172.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.39 -55.4 21.98 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 119.879 1.218 . . . . 73.209999999999994 111.132 -177.18 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.466 HD12 HE22 ' A' ' 99' ' ' GLN . 1.5 pt? -63.7 -20.7 65.93 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.07 -0.968 . . . . 72.329999999999998 113.307 -174.266 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.4 -38.33 90.65 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.37 1.468 . . . . 70.420000000000002 110.085 -176.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.48 -33.79 88.18 Favored Glycine 0 CA--C 1.527 0.82 0 CA-C-O 119.561 -0.577 . . . . 74.420000000000002 111.774 178.16 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -65.3 -38.33 89.87 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 117.866 0.833 . . . . 72.329999999999998 110.679 -177.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 28.8 t90 -60.51 -60.65 3.48 Favored 'General case' 0 C--O 1.228 -0.071 0 N-CA-C 108.291 -1.003 . . . . 74.030000000000001 108.291 177.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.05 -45.97 64.91 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 118.816 -0.611 . . . . 63.109999999999999 111.297 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -45.73 -57.5 4.21 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.209 1.004 . . . . 72.230000000000004 112.387 179.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.97 -32.08 80.84 Favored Glycine 0 CA--C 1.529 0.944 0 N-CA-C 112.069 -0.412 . . . . 75.299999999999997 112.069 -176.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 80.7 mt -71.07 -48.05 54.81 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 124.139 0.975 . . . . 74.409999999999997 110.66 178.212 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.6 mp -52.83 -31.66 40.23 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 124.859 1.263 . . . . 74.0 111.386 168.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 101.22 8.75 46.51 Favored Glycine 0 CA--C 1.526 0.781 0 C-N-CA 125.748 1.642 . . . . 55.240000000000002 112.394 -177.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.428 ' HE3' ' CD1' ' A' ' 51' ' ' TYR . 48.5 mttm -72.39 127.69 33.35 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 106.554 -1.647 . . . . 74.109999999999999 106.554 167.758 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 17.7 p -144.5 170.02 16.84 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.707 -0.849 . . . . 73.140000000000001 108.707 177.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.53 -131.84 15.19 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 109.205 -1.558 . . . . 73.049999999999997 109.205 -177.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -76.47 -30.8 57.45 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 118.843 -0.598 . . . . 64.120000000000005 111.003 177.347 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -57.6 -41.31 80.98 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 119.576 1.08 . . . . 72.329999999999998 111.585 -176.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.1 -46.52 90.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.645 -1.161 . . . . 73.239999999999995 111.387 174.405 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.8 ttt85 -57.48 -55.09 39.3 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 124.904 1.282 . . . . 71.409999999999997 109.165 178.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.65 -43.7 97.28 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 126.653 1.981 . . . . 72.109999999999999 111.376 -178.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.428 ' CD1' ' HE3' ' A' ' 43' ' ' LYS . 43.5 t80 -61.71 -44.39 97.02 Favored 'General case' 0 C--N 1.333 -0.13 0 O-C-N 121.709 -0.619 . . . . 74.409999999999997 109.995 174.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.53 -25.27 62.28 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 121.243 -0.91 . . . . 54.32 112.766 -175.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 37.7 mt -64.47 -21.04 66.54 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.766 1.227 . . . . 73.230000000000004 114.045 -173.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.9 t -100.71 -5.85 25.9 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.305 0.957 . . . . 74.299999999999997 111.009 -173.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 6.3 t -93.45 82.87 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 O-C-N 120.403 -1.436 . . . . 74.200000000000003 109.535 -164.112 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 3.7 m -132.93 87.8 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.96 0 C-N-CA 127.57 2.348 . . . . 65.409999999999997 110.156 -177.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.0 t -155.57 133.01 11.01 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 106.022 -1.844 . . . . 73.319999999999993 106.022 -169.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.2 t . . . . . 0 C--O 1.232 0.138 0 CA-C-N 120.327 1.421 . . . . 71.439999999999998 108.473 -172.743 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.0 t0 . . . . . 0 C--O 1.236 0.343 0 N-CA-C 113.01 0.744 . . . . 62.299999999999997 113.01 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.0 t -71.2 -62.33 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.219 0 C-N-CA 124.064 0.945 . . . . 70.319999999999993 108.662 177.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -60.12 -32.92 71.46 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-O 118.695 -0.669 . . . . 73.219999999999999 110.808 -165.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 25.7 ttp180 -48.42 -58.14 5.07 Favored 'General case' 0 CA--C 1.517 -0.311 0 C-N-CA 123.489 0.716 . . . . 74.230000000000004 110.955 172.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.5 mmtp -74.1 -43.6 57.02 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.884 -0.413 . . . . 62.299999999999997 109.884 -177.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.12 -58.72 7.4 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 124.071 0.948 . . . . 73.099999999999994 110.252 -171.266 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.19 -34.43 70.35 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 118.489 -0.767 . . . . 65.129999999999995 111.486 -175.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.62 -33.6 62.62 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 119.412 1.005 . . . . 64.120000000000005 112.299 176.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.49 -27.67 67.2 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.95 -1.094 . . . . 65.439999999999998 109.488 172.594 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.6 tp -120.48 22.85 11.12 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 127.013 2.125 . . . . 74.129999999999995 111.782 -165.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -48.45 114.18 0.91 Allowed 'General case' 0 C--O 1.233 0.199 0 C-N-CA 127.584 2.354 . . . . 72.040000000000006 108.829 173.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 77.54 6.22 86.56 Favored Glycine 0 CA--C 1.538 1.503 0 N-CA-C 114.636 0.614 . . . . 71.140000000000001 114.636 174.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 5.4 pttm -129.28 3.94 5.19 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 119.032 1.416 . . . . 72.239999999999995 113.556 -174.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -139.8 -162.44 1.34 Allowed 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.752 1.221 . . . . 74.230000000000004 108.426 164.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -136.17 147.19 47.58 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 125.595 1.558 . . . . 72.129999999999995 107.772 -176.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -69.16 -15.67 63.46 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.792 0.837 . . . . 65.409999999999997 113.239 -176.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -104.95 -2.08 25.01 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.57 1.148 . . . . 72.040000000000006 112.723 171.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.1 m -101.37 -35.9 9.06 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 121.059 -1.025 . . . . 74.420000000000002 112.982 -175.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 22.7 mt -55.09 -53.99 28.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 119.192 0.905 . . . . 72.109999999999999 109.342 -178.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -50.14 -51.36 43.93 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 124.026 0.931 . . . . 74.439999999999998 109.507 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -73.37 -9.13 58.38 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 124.404 1.082 . . . . 73.239999999999995 112.6 -172.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -84.79 -65.21 1.03 Allowed 'General case' 0 CA--C 1.519 -0.243 0 O-C-N 120.184 -1.573 . . . . 75.310000000000002 107.977 178.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 3.2 ptt? -61.74 -33.78 74.65 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 113.178 0.807 . . . . 73.439999999999998 113.178 -170.006 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 96.3 t -65.18 -49.19 80.41 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.223 0 C-N-CA 123.917 0.887 . . . . 74.329999999999998 109.497 176.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -62.06 -36.57 82.04 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 121.034 -1.041 . . . . 71.209999999999994 110.932 -173.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 83.2 mt -65.93 -6.11 11.43 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 125.424 1.489 . . . . 63.310000000000002 112.113 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -53.56 -51.82 61.69 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 120.191 1.359 . . . . 74.200000000000003 111.866 -178.009 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -78.95 -9.15 59.43 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.204 0.602 . . . . 74.200000000000003 112.563 -175.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 31.7 m -64.57 -38.21 90.22 Favored 'General case' 0 C--O 1.226 -0.165 0 O-C-N 120.827 -1.171 . . . . 62.439999999999998 110.108 -179.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.514 ' HA ' HE21 ' A' ' 99' ' ' GLN . . . -64.32 -27.06 68.77 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 120.834 -1.166 . . . . 62.039999999999999 113.276 -170.169 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 12.7 tpt85 -65.02 -53.96 37.87 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.53 1.132 . . . . 74.439999999999998 108.713 173.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -63.07 -56.18 19.17 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 124.385 1.074 . . . . 75.040000000000006 110.893 -177.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . 0.514 HE21 ' HA ' ' A' ' 96' ' ' ALA . 11.1 pt20 -63.67 -18.5 64.03 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.541 1.136 . . . . 72.319999999999993 113.27 -164.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 11.6 mm -87.09 -38.53 12.27 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.156 0 C-N-CA 125.767 1.627 . . . . 73.450000000000003 110.076 177.351 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 76.6 mt -71.84 -28.3 30.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 O-C-N 121.027 -1.046 . . . . 74.109999999999999 108.325 172.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 2.9 t -73.12 -43.72 61.28 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.57 0.748 . . . . 73.319999999999993 109.434 177.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -132.81 82.85 2.02 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 106.015 -1.846 . . . . 75.120000000000005 106.015 -174.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.497 HD13 ' H ' ' A' ' 104' ' ' ILE . 2.0 mp . . . . . 0 C--O 1.253 1.244 0 N-CA-C 106.626 -1.62 . . . . 71.150000000000006 106.626 173.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.206 -1.233 0 CA-C-O 117.748 -1.12 . . . . 73.129999999999995 113.362 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . 0.263 11.0 pt-20 43.99 58.36 3.69 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-N 121.088 1.767 . . . . 64.150000000000006 111.911 -177.422 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 55.84 12.21 0.83 Allowed 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 127.667 2.387 . . . . 70.120000000000005 116.219 -172.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 11.7 mmtt -70.61 -7.26 42.8 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 119.908 -1.745 . . . . 73.310000000000002 113.867 174.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.3 m-30 -59.71 -32.5 70.59 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 121.197 1.817 . . . . 70.430000000000007 111.122 176.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -73.95 15.6 0.29 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.642 1.177 . . . . 73.340000000000003 113.54 176.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -153.31 178.04 10.21 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 125.268 1.427 . . . . 73.420000000000002 109.774 -164.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 51.07 -162.46 0.07 Allowed 'General case' 0 C--O 1.236 0.362 0 C-N-CA 128.077 2.551 . . . . 70.239999999999995 111.974 168.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -145.46 8.98 1.19 Allowed 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 125.945 1.698 . . . . 73.030000000000001 110.971 169.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -72.14 -52.37 16.96 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-N 119.288 0.949 . . . . 65.150000000000006 109.725 169.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.724 ' CD2' ' H ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER -69.69 -46.02 66.99 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 124.658 1.183 . . . . 72.420000000000002 112.288 -169.578 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 39.4 t-20 -58.43 -41.43 85.01 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 124.218 1.007 . . . . 64.239999999999995 110.942 -175.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -47.98 -51.84 22.18 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.832 2.053 . . . . 74.230000000000004 111.748 177.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 3.7 mttp -55.51 -57.65 11.03 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 108.917 -0.772 . . . . 72.510000000000005 108.917 172.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.98 2.96 0.92 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.441 1.496 . . . . 74.129999999999995 113.983 -176.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -98.41 -28.47 13.62 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 120.504 -1.372 . . . . 72.25 110.388 171.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -128.87 34.7 4.43 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 120.714 -1.241 . . . . 62.109999999999999 113.451 -159.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.12 -6.29 7.22 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 115.262 1.578 . . . . 73.140000000000001 115.262 -172.356 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 76.5 mtt85 -53.89 -22.93 11.06 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 120.109 1.322 . . . . 72.230000000000004 113.535 176.529 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -95.17 -17.6 21.64 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 113.151 0.797 . . . . 71.510000000000005 113.151 177.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.6 ttt180 -56.03 -56.37 21.6 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.548 1.067 . . . . 71.329999999999998 110.784 -179.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -70.67 -16.28 62.79 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 114.085 1.142 . . . . 74.329999999999998 114.085 -176.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 12.4 mt -61.9 -25.9 67.84 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.564 1.074 . . . . 74.450000000000003 110.521 167.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.13 -37.42 92.83 Favored Glycine 0 N--CA 1.442 -0.947 0 CA-C-O 119.268 -0.74 . . . . 72.230000000000004 111.963 173.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -65.84 -27.64 68.39 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 118.544 1.172 . . . . 73.239999999999995 110.694 179.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 28.9 t90 -71.77 -62.14 1.53 Allowed 'General case' 0 CA--C 1.534 0.354 0 O-C-N 121.213 -0.929 . . . . 72.310000000000002 109.25 171.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -54.85 -48.95 72.23 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 113.692 0.997 . . . . 74.25 113.692 -176.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -47.58 -50.38 24.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 119.252 0.933 . . . . 72.340000000000003 111.731 175.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -65.34 -7.13 31.08 Favored Glycine 0 CA--C 1.534 1.265 0 C-N-CA 125.337 1.446 . . . . 72.109999999999999 114.611 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 18.3 mt -102.93 -45.85 4.84 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 126.316 1.846 . . . . 75.109999999999999 109.731 172.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.8 mp -62.33 -10.59 11.6 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 127.099 2.16 . . . . 71.329999999999998 114.805 -176.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 89.03 34.41 8.88 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 110.875 -0.89 . . . . 71.310000000000002 110.875 -179.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 16.2 mttm -117.45 143.98 45.48 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 106.755 -1.572 . . . . 73.510000000000005 106.755 172.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 10.2 p -141.92 172.18 13.04 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 107.128 -1.434 . . . . 75.430000000000007 107.128 167.13 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 60.73 -142.98 48.3 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 111.742 -0.543 . . . . 74.299999999999997 111.742 175.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -60.98 -32.02 71.59 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.05 0.389 . . . . 64.400000000000006 112.05 -177.105 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -59.92 -47.19 86.8 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 124.514 1.126 . . . . 73.5 111.199 177.404 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.59 -45.42 94.17 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.29 -0.868 . . . . 74.120000000000005 110.69 172.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.9 ttt180 -58.59 -50.29 74.34 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 123.995 0.918 . . . . 75.340000000000003 111.083 -176.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.19 -48.74 80.44 Favored 'General case' 0 C--O 1.233 0.184 0 C-N-CA 126.984 2.113 . . . . 73.430000000000007 111.412 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 72.3 t80 -63.67 -37.95 89.28 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.474 -0.766 . . . . 73.519999999999996 110.656 176.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.2 -14.25 61.59 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 120.858 -1.151 . . . . 75.439999999999998 112.741 177.259 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 22.8 mt -70.08 -31.98 69.82 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 120.169 1.35 . . . . 63.32 110.405 172.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 17.0 p -90.35 -20.06 23.3 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 120.929 -1.107 . . . . 54.109999999999999 111.247 -171.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 57.5 t -68.85 88.35 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 125.787 1.635 . . . . 73.530000000000001 108.615 168.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 20.1 t -134.83 138.97 48.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 106.773 -1.565 . . . . 74.120000000000005 106.773 148.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 66.3 p -154.47 167.99 28.19 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 128.437 2.695 . . . . 74.420000000000002 107.362 175.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 CA--C 1.531 0.243 0 C-N-CA 125.997 1.719 . . . . 71.049999999999997 106.726 169.625 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.453 -0.311 0 CA-C-O 118.316 -0.85 . . . . 62.450000000000003 110.907 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.5 p -79.13 -53.62 13.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 C-N-CA 123.559 0.744 . . . . 74.120000000000005 110.536 176.483 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -56.62 -35.42 68.28 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-O 118.745 -0.645 . . . . 73.319999999999993 109.855 -175.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -48.05 -59.27 3.5 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.078 0.951 . . . . 74.239999999999995 111.578 174.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -72.44 -37.93 68.44 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 118.819 -0.61 . . . . 73.340000000000003 110.058 -175.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.58 -47.27 70.27 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 119.152 0.887 . . . . 74.230000000000004 110.544 -176.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.69 -16.76 63.92 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.473 1.109 . . . . 72.319999999999993 111.121 179.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -77.28 -47.42 20.13 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.013 0.824 . . . . 60.109999999999999 110.843 168.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.95 -24.08 67.71 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.473 1.109 . . . . 73.219999999999999 111.203 177.467 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 79.3 mt -117.17 31.43 6.75 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 126.345 1.858 . . . . 74.450000000000003 111.478 177.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -55.78 117.92 4.09 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 107.211 -1.403 . . . . 72.120000000000005 107.211 168.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 95.63 -10.54 68.76 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 126.317 1.913 . . . . 73.540000000000006 113.713 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.2 mtpp -126.7 1.52 6.78 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 119.696 1.748 . . . . 72.25 113.756 -165.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -151.0 174.31 13.29 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 119.043 0.838 . . . . 73.239999999999995 110.356 172.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -140.47 168.82 18.89 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 127.26 2.224 . . . . 70.310000000000002 105.798 174.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -57.98 -46.16 85.62 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.007 0.923 . . . . 74.310000000000002 111.64 -171.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -76.35 -16.47 59.74 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-O 119.485 -0.293 . . . . 73.420000000000002 110.903 -174.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 95.1 m -70.14 -56.81 5.91 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 107.947 -1.131 . . . . 74.549999999999997 107.947 165.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 47.8 mt -60.38 -55.96 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 C-N-CA 124.482 1.113 . . . . 74.340000000000003 109.938 -171.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.69 -28.08 63.47 Favored 'General case' 0 N--CA 1.456 -0.126 0 O-C-N 122.076 -0.39 . . . . 73.439999999999998 111.524 -175.01 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.62 -46.88 13.76 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.794 0.837 . . . . 74.420000000000002 110.285 -179.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.52 -40.52 75.18 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 122.939 0.495 . . . . 74.219999999999999 110.329 -165.292 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 9.5 mtt -61.26 -43.86 98.18 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 119.143 -0.456 . . . . 71.319999999999993 110.845 -179.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 49.8 t -65.41 -34.89 73.53 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 125.18 1.392 . . . . 74.340000000000003 110.656 -176.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 -55.82 -54.65 41.9 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 108.748 -0.834 . . . . 74.519999999999996 108.748 178.072 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 42.6 mt -71.89 -1.97 16.24 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 126.563 1.945 . . . . 74.129999999999995 112.601 -172.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 27.5 ttp180 -57.13 -52.15 66.46 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 123.912 0.885 . . . . 74.25 110.625 -175.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.85 -49.79 73.51 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.355 1.062 . . . . 74.530000000000001 110.028 177.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.8 m -52.63 -49.99 64.05 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 129.563 3.145 . . . . 71.519999999999996 109.927 -174.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -53.3 -34.88 59.15 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.577 0.751 . . . . 72.430000000000007 111.637 -179.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 9.1 mtm180 -79.01 -45.58 19.93 Favored 'General case' 0 C--O 1.233 0.233 0 O-C-N 121.107 -0.995 . . . . 72.150000000000006 109.032 -177.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -60.35 -39.24 86.46 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 125.0 1.32 . . . . 72.150000000000006 111.164 178.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -56.54 -42.49 78.61 Favored 'General case' 0 C--O 1.221 -0.43 0 C-N-CA 124.577 1.151 . . . . 74.450000000000003 112.715 -177.033 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.5 mm -58.62 -44.9 90.6 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-N 119.996 1.271 . . . . 74.109999999999999 108.979 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 86.9 mt -73.46 -9.72 13.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 124.809 1.244 . . . . 73.219999999999999 110.056 -179.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -109.38 16.77 22.1 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.918 1.687 . . . . 45.350000000000001 109.705 177.105 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -122.63 18.11 10.37 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.51 1.924 . . . . 72.450000000000003 108.491 177.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 61.8 mt . . . . . 0 C--O 1.251 1.16 0 CA-C-O 115.859 -2.02 . . . . 74.329999999999998 106.593 173.951 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.3 ttm . . . . . 0 N--CA 1.473 0.709 0 CA-C-O 118.636 -0.697 . . . . 75.150000000000006 112.14 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 67.0 p -78.56 148.85 33.19 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 120.548 1.522 . . . . 72.140000000000001 111.887 -167.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -83.03 78.57 9.56 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 124.498 1.119 . . . . 74.430000000000007 108.354 170.35 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -160.8 162.08 32.21 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 123.483 0.713 . . . . 75.230000000000004 109.283 159.29 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -169.55 122.47 0.74 Allowed 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 129.298 3.039 . . . . 62.109999999999999 104.087 167.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -119.46 -22.05 7.17 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 119.817 1.19 . . . . 75.319999999999993 113.144 -175.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 2.0 ttt-85 59.65 -164.58 0.21 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.109 1.363 . . . . 73.140000000000001 114.679 160.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.5 164.51 4.41 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.155 0.982 . . . . 72.510000000000005 109.903 168.033 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.4 163.49 14.17 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.136 -0.977 . . . . 72.450000000000003 109.776 166.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -153.35 75.44 1.06 Allowed 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.202 1.401 . . . . 75.25 110.186 -178.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -75.9 14.64 0.64 Allowed 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 116.792 2.145 . . . . 74.349999999999994 116.792 -175.013 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -45.93 106.6 0.08 Allowed 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.017 1.727 . . . . 71.450000000000003 112.714 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 54.57 -5.32 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 128.525 2.73 . . . . 73.510000000000005 116.392 -171.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 48.7 mttt -58.0 -26.97 63.07 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 127.071 2.148 . . . . 73.430000000000007 113.952 -168.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -63.73 -9.42 14.21 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 114.106 1.15 . . . . 74.530000000000001 114.106 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -132.92 39.09 3.34 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 119.336 0.971 . . . . 62.420000000000002 110.143 173.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -146.44 -65.1 0.29 Allowed 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 107.057 -1.46 . . . . 65.109999999999999 107.057 169.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -67.04 158.05 31.99 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 127.052 2.141 . . . . 61.219999999999999 111.004 -172.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -89.04 -57.75 2.79 Favored 'General case' 0 C--O 1.223 -0.311 0 N-CA-C 108.811 -0.811 . . . . 73.540000000000006 108.811 163.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -49.58 -50.96 40.38 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.701 1.0 . . . . 74.409999999999997 113.701 -162.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 15.0 mt -76.43 -26.56 55.6 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 113.509 0.929 . . . . 75.129999999999995 113.509 -178.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -65.69 -51.35 60.11 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.975 1.31 . . . . 72.510000000000005 107.591 175.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -44.4 -49.24 9.76 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 128.936 2.895 . . . . 73.450000000000003 111.359 -171.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.1 pttp -53.7 -51.61 62.72 Favored 'General case' 0 C--O 1.233 0.234 0 O-C-N 121.258 -0.901 . . . . 62.539999999999999 111.984 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.85 -30.4 50.97 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 113.283 0.845 . . . . 61.450000000000003 113.283 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -53.56 -41.25 66.3 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.704 1.602 . . . . 73.150000000000006 108.692 176.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.18 -86.03 0.32 Allowed 'General case' 0 C--N 1.345 0.389 0 CA-C-O 118.674 -0.679 . . . . 62.240000000000002 109.273 178.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 48.61 -24.98 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.201 1 C-N-CA 132.121 4.168 . . . . 74.439999999999998 118.559 179.02 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.99 -36.81 13.37 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 128.516 2.726 . . . . 75.510000000000005 114.202 -167.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -107.67 -19.65 13.48 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.159 0.984 . . . . 72.530000000000001 110.155 -174.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.73 -32.16 71.44 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.973 1.309 . . . . 73.129999999999995 110.969 -176.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -90.17 -5.71 56.14 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.912 0.885 . . . . 75.239999999999995 112.76 -175.288 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 13.1 mt -81.19 -28.44 34.93 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 119.383 0.992 . . . . 60.340000000000003 113.464 -170.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -69.92 -34.32 71.18 Favored Glycine 0 C--O 1.223 -0.572 0 N-CA-C 109.089 -1.604 . . . . 62.219999999999999 109.089 169.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -65.2 -19.29 65.9 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 118.628 1.214 . . . . 62.43 112.295 176.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 32.1 t90 -77.13 -66.21 0.85 Allowed 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 125.594 1.558 . . . . 74.319999999999993 109.363 167.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.41 -31.18 61.65 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 118.407 -0.806 . . . . 61.119999999999997 112.805 -174.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -46.76 -63.29 1.06 Allowed 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 125.656 1.582 . . . . 75.120000000000005 110.567 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -55.63 -44.86 86.18 Favored Glycine 0 C--N 1.336 0.535 0 N-CA-C 111.235 -0.746 . . . . 55.030000000000001 111.235 -178.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 28.4 mt -62.85 -36.03 81.91 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.491 0.716 . . . . 73.439999999999998 111.814 -177.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 77.8 mt -82.7 1.17 39.96 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.114 1.766 . . . . 62.109999999999999 112.495 176.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 84.24 12.18 76.74 Favored Glycine 0 CA--C 1.527 0.797 0 C-N-CA 125.202 1.382 . . . . 74.450000000000003 113.915 177.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -87.78 133.07 33.94 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.852 1.261 . . . . 75.209999999999994 107.969 -177.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 33.0 p -140.84 167.84 21.22 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 125.966 1.706 . . . . 61.219999999999999 107.883 -179.025 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 56.19 -134.69 50.43 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 111.476 -0.65 . . . . 55.210000000000001 111.476 175.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -68.3 -26.96 65.9 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 117.59 0.695 . . . . 74.430000000000007 111.542 178.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.24 -35.56 77.57 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 123.606 0.762 . . . . 73.239999999999995 110.474 176.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.61 -48.02 24.05 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.178 -0.675 . . . . 63.229999999999997 109.178 173.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -62.49 -47.57 83.37 Favored 'General case' 0 C--O 1.226 -0.141 0 N-CA-C 109.846 -0.427 . . . . 73.25 109.846 -168.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.87 -42.83 84.96 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.454 1.102 . . . . 73.450000000000003 110.511 -177.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 31.6 t80 -58.32 -46.33 86.4 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 122.669 0.387 . . . . 72.109999999999999 110.274 175.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.17 -36.44 68.33 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 121.465 -0.772 . . . . 72.310000000000002 111.75 178.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 44.2 mt -75.17 10.14 1.68 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.292 1.437 . . . . 65.420000000000002 112.259 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.7 t -133.68 34.52 3.42 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 120.098 1.317 . . . . 72.430000000000007 111.248 169.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 81.4 t -132.18 85.33 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 O-C-N 121.081 -1.012 . . . . 72.120000000000005 108.853 177.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 16.4 t -151.1 122.54 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 124.615 1.166 . . . . 64.349999999999994 109.5 170.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 6.5 t -149.17 -38.97 0.15 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.202 1.001 . . . . 75.439999999999998 111.445 162.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.5 m 74.84 41.68 0.31 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.312 1.845 . . . . 73.239999999999995 112.958 -176.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -66.4 179.98 0.91 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.889 2.076 . . . . 64.409999999999997 112.872 179.145 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER 67.32 60.08 0.5 Allowed 'General case' 0 C--O 1.237 0.412 0 C-N-CA 126.761 2.024 . . . . 75.319999999999993 109.774 163.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -137.18 109.41 7.29 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 123.558 0.743 . . . . 61.210000000000001 109.189 165.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 66.86 145.39 0.1 OUTLIER Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 128.516 2.726 . . . . 73.319999999999993 110.889 -170.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -71.3 129.79 16.5 Favored 'Trans proline' 0 C--N 1.352 0.737 0 CA-C-N 121.887 1.71 . . . . 63.210000000000001 110.785 -177.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 170.05 -11.01 0.05 OUTLIER Glycine 0 CA--C 1.527 0.841 0 CA-C-O 118.02 -1.433 . . . . 72.129999999999995 114.174 172.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -132.97 -75.28 0.49 Allowed 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 119.586 1.693 . . . . 65.109999999999999 109.34 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 49.18 82.94 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.576 1.95 . . . . 74.340000000000003 113.089 173.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -118.56 -41.53 2.81 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 118.777 -0.63 . . . . 74.329999999999998 110.225 170.52 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 72.4 t -57.07 -43.81 81.89 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 CA-C-N 120.304 1.411 . . . . 74.239999999999995 111.342 -173.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -56.91 -53.97 51.89 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.694 1.198 . . . . 54.049999999999997 109.185 175.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 26.8 ttm-85 -53.83 -42.18 68.19 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 125.679 1.591 . . . . 74.150000000000006 112.067 178.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -75.25 -47.61 27.25 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 118.322 0.51 . . . . 74.329999999999998 109.749 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 16.3 mt -59.55 -44.33 93.27 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 117.689 -1.148 . . . . 74.510000000000005 110.444 -179.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.22 -18.79 64.86 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.988 1.267 . . . . 73.109999999999999 112.364 -177.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -87.4 -52.67 5.24 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.513 1.125 . . . . 62.240000000000002 110.371 170.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -60.18 -48.08 83.25 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 121.044 -1.035 . . . . 72.129999999999995 110.012 -174.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.8 tp -91.32 15.62 11.71 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 130.348 3.459 . . . . 75.540000000000006 111.577 -175.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -55.87 109.87 0.64 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.488 1.515 . . . . 72.319999999999993 109.88 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 110.05 -4.38 30.25 Favored Glycine 0 CA--C 1.528 0.847 0 C-N-CA 125.425 1.488 . . . . 62.140000000000001 112.511 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -133.05 -5.76 3.08 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.046 1.338 . . . . 73.319999999999993 113.275 -171.463 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -146.33 130.07 17.08 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.507 0.67 . . . . 52.539999999999999 110.602 169.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.39 161.13 25.88 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 126.262 1.825 . . . . 74.409999999999997 107.616 164.498 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -58.54 -45.13 89.56 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.973 0.892 . . . . 71.310000000000002 109.35 175.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -70.52 -27.89 64.53 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.689 0.796 . . . . 74.120000000000005 112.373 179.294 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 47.6 m -68.28 -36.19 79.0 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.665 0.786 . . . . 73.349999999999994 110.209 175.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 10.4 mt -69.65 -60.83 2.05 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 CA-C-N 119.937 1.244 . . . . 62.439999999999998 108.566 169.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.55 -18.5 65.4 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 114.173 1.175 . . . . 73.120000000000005 114.173 -164.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -91.91 -31.27 15.73 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 119.208 0.913 . . . . 64.329999999999998 110.419 178.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -64.34 -66.86 0.49 Allowed 'General case' 0 CA--C 1.514 -0.419 0 CA-C-N 119.21 0.914 . . . . 71.519999999999996 111.028 -173.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 5.3 ptt? -66.66 -14.91 63.06 Favored 'General case' 0 N--CA 1.462 0.162 0 N-CA-C 113.592 0.96 . . . . 71.420000000000002 113.592 -162.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 37.4 t -45.67 -49.2 4.29 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 C-N-CA 127.019 2.128 . . . . 75.120000000000005 111.794 166.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -82.0 -21.26 37.16 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 119.502 1.046 . . . . 72.510000000000005 111.838 -169.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 7.0 mp -66.47 -7.37 19.19 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 126.855 2.062 . . . . 75.239999999999995 111.454 -168.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 30.3 mtp180 -54.39 -42.17 70.08 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 122.95 0.5 . . . . 71.340000000000003 110.408 168.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.3 -52.59 8.93 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.617 0.767 . . . . 71.120000000000005 110.293 174.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.0 m -52.84 -29.59 28.77 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.048 0.939 . . . . 74.530000000000001 112.039 -177.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.18 -50.87 68.25 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 125.647 1.579 . . . . 73.540000000000006 114.135 177.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 9.3 ptt180 -75.47 -41.56 55.29 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 109.566 -0.531 . . . . 74.230000000000004 109.566 178.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -48.78 -55.87 10.28 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 126.687 1.995 . . . . 61.32 111.711 177.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -64.28 -25.39 68.03 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.792 0.724 . . . . 74.25 112.523 -174.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.8 mm -77.36 -44.58 30.26 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.254 0 O-C-N 120.707 -1.246 . . . . 72.230000000000004 109.452 176.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 91.8 mt -71.67 -10.46 13.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 C-N-CA 124.844 1.258 . . . . 75.510000000000005 110.501 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 10.7 t -86.72 -56.14 3.54 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.926 1.29 . . . . 63.130000000000003 108.65 170.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 66.8 mt-10 -101.61 56.87 0.83 Allowed 'General case' 0 C--O 1.236 0.385 0 N-CA-C 106.881 -1.525 . . . . 65.430000000000007 106.881 -168.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 83.6 mt . . . . . 0 C--O 1.25 1.107 0 C-N-CA 123.816 0.847 . . . . 73.439999999999998 109.038 -172.202 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.6 mtm . . . . . 0 N--CA 1.476 0.84 0 CA-C-O 117.38 -1.295 . . . . 74.310000000000002 107.513 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 14.1 t -148.89 168.23 23.59 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 120.058 1.299 . . . . 74.540000000000006 108.782 -179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.0 p -118.23 64.66 0.76 Allowed 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 126.787 2.035 . . . . 74.450000000000003 106.475 174.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -90.26 11.07 22.31 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.867 1.267 . . . . 74.420000000000002 110.918 -179.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -73.01 174.43 7.89 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.814 0.846 . . . . 65.540000000000006 110.804 -176.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -130.47 -2.48 4.34 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.514 1.526 . . . . 73.310000000000002 112.513 179.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -151.35 -174.62 4.88 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.278 0.945 . . . . 72.549999999999997 113.196 -168.36 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -67.13 147.67 52.82 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 122.253 1.025 . . . . 65.510000000000005 109.868 172.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -128.9 -66.33 0.83 Allowed 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 124.804 1.242 . . . . 74.209999999999994 108.286 175.788 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -137.11 -2.12 2.09 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 115.737 1.755 . . . . 74.420000000000002 115.737 -155.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . 0.327 1.1 p-80 46.27 -165.53 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.017 1.327 . . . . 73.400000000000006 113.637 168.486 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 44.75 90.38 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.358 1.863 . . . . 70.439999999999998 113.988 177.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 60.69 -3.54 0.14 Allowed 'General case' 0 C--O 1.237 0.397 0 C-N-CA 128.2 2.6 . . . . 74.540000000000006 115.786 -166.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -60.56 -13.73 15.8 Favored 'General case' 0 C--O 1.218 -0.594 0 O-C-N 120.488 -1.382 . . . . 74.340000000000003 112.507 159.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -48.6 -41.05 29.61 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.868 1.213 . . . . 72.510000000000005 112.198 163.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -82.54 -41.83 19.15 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 118.401 0.546 . . . . 61.409999999999997 111.217 174.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -72.41 -44.63 62.18 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.245 1.018 . . . . 63.539999999999999 112.704 -167.507 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -120.08 105.62 11.19 Favored 'General case' 0 CA--C 1.517 -0.316 0 C-N-CA 127.088 2.155 . . . . 62.43 105.59 -175.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.36 -14.52 56.81 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 113.087 0.773 . . . . 51.200000000000003 113.087 -172.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -64.11 -35.72 81.67 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.952 0.901 . . . . 71.209999999999994 109.683 175.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.8 mt -70.85 -37.69 73.13 Favored 'General case' 0 C--O 1.234 0.265 0 O-C-N 120.881 -1.137 . . . . 74.409999999999997 111.086 174.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -60.01 -50.5 73.51 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 118.946 -0.55 . . . . 74.120000000000005 110.153 172.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -52.61 -56.91 12.08 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 126.103 1.761 . . . . 74.209999999999994 109.68 -178.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -45.12 -49.14 12.02 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 124.731 1.212 . . . . 74.340000000000003 111.407 -179.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -76.82 -40.18 48.83 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.055 0.761 . . . . 62.119999999999997 113.055 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -66.78 -19.03 65.66 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.063 -1.023 . . . . 74.120000000000005 110.256 178.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -90.15 13.88 13.93 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 127.656 2.382 . . . . 72.430000000000007 112.289 170.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.6 mmt85 -108.77 -30.37 8.2 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 120.065 1.302 . . . . 71.510000000000005 112.411 172.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.3 ptt85 -57.43 -15.95 8.13 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 115.582 1.697 . . . . 65.510000000000005 115.582 -169.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -121.3 -15.09 8.2 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 126.218 1.807 . . . . 74.140000000000001 111.168 -178.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.62 -22.56 65.33 Favored 'General case' 0 N--CA 1.471 0.591 0 O-C-N 120.698 -1.251 . . . . 74.239999999999995 111.64 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -106.17 -14.17 15.22 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.575 1.55 . . . . 72.340000000000003 114.128 -171.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.52 -34.35 17.01 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 125.422 1.489 . . . . 73.329999999999998 113.355 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -61.81 -24.34 64.42 Favored Glycine 0 CA--C 1.526 0.732 0 CA-C-O 118.386 -1.23 . . . . 63.140000000000001 113.379 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -65.24 -31.0 71.93 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.687 2.243 . . . . 75.239999999999995 112.488 -177.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . 0.434 ' CD1' ' HE3' ' A' ' 88' ' ' LYS . 22.9 t90 -63.8 -72.37 0.14 Allowed 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 125.6 1.56 . . . . 73.239999999999995 108.492 175.02 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.47 -17.13 63.56 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 124.916 1.287 . . . . 71.329999999999998 113.917 -176.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -54.34 -57.41 11.37 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 119.352 0.978 . . . . 60.350000000000001 109.066 173.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.65 -38.25 93.49 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 111.347 -0.701 . . . . 75.109999999999999 111.347 -179.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.5 mp -61.22 -38.37 86.37 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.495 -1.003 . . . . 74.409999999999997 111.064 178.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 95.6 mt -89.14 5.84 42.76 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 127.04 2.136 . . . . 75.319999999999993 113.068 176.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 74.54 9.65 82.18 Favored Glycine 0 CA--C 1.534 1.226 0 C-N-CA 125.388 1.47 . . . . 74.230000000000004 114.424 177.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.9 mttt -85.82 137.96 32.4 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 119.341 1.57 . . . . 73.25 106.983 173.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 37.0 p -138.85 -178.0 5.13 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.664 -0.865 . . . . 75.230000000000004 108.664 168.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 47.47 -117.28 3.22 Favored Glycine 0 CA--C 1.524 0.619 0 C-N-CA 125.288 1.423 . . . . 60.43 112.941 174.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -82.65 -16.59 47.69 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.015 1.726 . . . . 75.140000000000001 112.686 -172.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -76.14 -48.8 19.27 Favored 'General case' 0 CA--C 1.512 -0.486 0 O-C-N 120.912 -1.118 . . . . 62.240000000000002 109.016 169.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -56.81 -42.99 80.51 Favored 'General case' 0 N--CA 1.445 -0.72 0 N-CA-C 108.748 -0.834 . . . . 62.240000000000002 108.748 175.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.3 ttm-85 -51.42 -47.72 62.91 Favored 'General case' 0 N--CA 1.437 -1.107 0 N-CA-C 112.96 0.726 . . . . 75.329999999999998 112.96 173.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.69 -49.25 66.69 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 118.091 0.405 . . . . 73.450000000000003 110.435 -178.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -52.34 -44.93 65.45 Favored 'General case' 0 N--CA 1.457 -0.093 0 C-N-CA 123.435 0.694 . . . . 72.230000000000004 110.696 175.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.46 -30.82 63.36 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 118.421 -0.8 . . . . 60.340000000000003 112.623 -174.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 18.0 mt -75.5 -3.89 36.63 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.2 1.0 . . . . 75.319999999999993 111.861 -175.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.6 t -133.3 49.27 2.31 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.589 1.156 . . . . 63.149999999999999 109.575 179.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 2.0 t -127.98 12.98 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 O-C-N 120.857 -1.152 . . . . 73.510000000000005 110.669 173.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 4.5 m -74.24 53.21 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 125.938 1.695 . . . . 74.450000000000003 112.144 176.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.1 t -79.76 60.82 3.52 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.275 1.43 . . . . 65.140000000000001 108.912 178.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.3 m 63.8 -151.87 0.31 Allowed 'General case' 0 C--O 1.238 0.497 0 N-CA-C 109.919 -0.4 . . . . 71.310000000000002 109.919 169.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -133.45 168.29 18.89 Favored 'General case' 0 CA--C 1.516 -0.35 0 O-C-N 120.743 -1.223 . . . . 74.310000000000002 108.392 161.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -67.66 -11.3 57.95 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 112.777 0.658 . . . . 70.209999999999994 112.777 168.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -81.57 54.54 2.39 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.679 1.191 . . . . 74.540000000000006 109.574 170.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -138.69 163.75 44.6 Favored Pre-proline 0 CA--C 1.541 0.618 0 C-N-CA 126.406 1.882 . . . . 72.329999999999998 109.826 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -83.49 63.2 7.44 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 123.108 2.539 . . . . 62.509999999999998 110.494 -176.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 168.68 61.81 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 N-CA-C 110.21 -1.156 . . . . 71.120000000000005 110.21 -172.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -69.98 71.72 0.39 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.727 2.011 . . . . 70.519999999999996 108.697 174.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -164.08 -58.92 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 128.042 2.537 . . . . 70.400000000000006 105.819 170.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.68 -28.53 69.99 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 121.471 -0.768 . . . . 64.25 112.431 -170.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 78.3 t -57.99 -43.62 85.25 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 123.823 0.849 . . . . 71.209999999999994 110.315 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -76.27 -32.51 58.85 Favored 'General case' 0 C--O 1.233 0.224 0 O-C-N 121.118 -0.989 . . . . 74.109999999999999 109.546 -179.084 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -50.56 -50.38 53.71 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 125.071 1.348 . . . . 73.209999999999994 112.089 -172.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -71.7 -23.6 61.67 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 119.301 0.955 . . . . 70.510000000000005 111.515 -171.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 9.5 mt -74.75 -61.31 1.92 Allowed 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.25 -1.019 . . . . 74.219999999999999 108.25 168.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.12 -37.6 64.5 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.293 1.037 . . . . 54.140000000000001 113.09 -173.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.18 -38.79 87.78 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 123.29 0.636 . . . . 74.209999999999994 111.491 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -74.52 -56.88 4.35 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 122.858 1.313 . . . . 73.230000000000004 108.43 175.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.4 tp -77.15 16.67 0.54 Allowed 'General case' 0 CA--C 1.534 0.329 1 C-N-CA 131.836 4.054 . . . . 64.209999999999994 113.963 -168.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 55.6 tt0 -52.4 122.33 8.6 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 127.14 2.176 . . . . 70.540000000000006 110.464 -174.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 102.27 -15.43 56.3 Favored Glycine 0 CA--C 1.53 1.01 0 C-N-CA 127.249 2.357 . . . . 73.140000000000001 113.034 178.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 35.3 mtmt -126.06 -5.46 6.75 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 119.276 1.538 . . . . 75.030000000000001 114.88 -158.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -154.74 126.43 7.52 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 120.57 1.532 . . . . 73.349999999999994 110.026 171.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.14 163.52 27.77 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.72 1.208 . . . . 74.319999999999993 110.573 -178.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 77.0 mt-10 -48.56 -59.22 3.68 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 124.642 1.177 . . . . 73.340000000000003 110.433 170.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -68.29 -20.73 64.78 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.813 -0.631 . . . . 64.140000000000001 112.114 -175.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 18.8 m -80.16 -40.71 26.77 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.788 1.635 . . . . 71.030000000000001 110.032 176.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 77.4 mt -59.71 -56.56 16.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 C-N-CA 124.788 1.235 . . . . 74.120000000000005 107.689 173.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.81 -47.3 80.57 Favored 'General case' 0 C--N 1.341 0.199 0 O-C-N 123.614 0.571 . . . . 74.540000000000006 110.998 -174.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.54 -43.27 89.2 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.273 0.629 . . . . 72.310000000000002 111.559 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.434 ' HE3' ' CD1' ' A' ' 36' ' ' TRP . 12.3 tptp -66.7 -39.03 87.89 Favored 'General case' 0 C--O 1.223 -0.29 0 O-C-N 121.265 -0.897 . . . . 74.019999999999996 111.216 -176.003 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 18.0 ptp -72.14 -31.4 65.94 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 119.073 -1.051 . . . . 63.5 112.369 -174.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 71.9 t -49.97 -47.15 23.69 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 123.47 0.708 . . . . 65.109999999999999 109.233 167.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -50.58 -45.41 57.2 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.136 1.374 . . . . 74.319999999999993 113.501 -163.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -75.6 11.89 1.18 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.213 1.19 . . . . 73.239999999999995 114.213 -173.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 3.3 tpt85 -49.91 -53.07 28.38 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.844 1.258 . . . . 72.400000000000006 111.3 -178.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -63.01 -50.28 71.31 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 123.823 0.849 . . . . 73.409999999999997 109.999 175.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.8 m -50.18 -45.65 53.66 Favored 'General case' 0 C--N 1.333 -0.125 0 C-N-CA 125.912 1.685 . . . . 74.319999999999993 110.147 -173.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -54.63 -40.65 69.15 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 124.305 1.042 . . . . 71.150000000000006 112.676 -177.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -81.68 -40.32 23.01 Favored 'General case' 0 C--N 1.341 0.202 0 CA-C-O 117.463 -1.256 . . . . 74.239999999999995 111.929 172.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -52.35 -41.78 63.34 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 119.391 0.996 . . . . 73.439999999999998 110.834 -179.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 -56.27 -50.14 72.21 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 118.966 0.803 . . . . 73.120000000000005 112.024 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 43.8 mm -68.07 -42.74 85.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 123.353 0.661 . . . . 73.430000000000007 110.26 -175.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 24.1 mt -66.38 -21.14 28.25 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 N-CA-C 109.036 -0.727 . . . . 74.439999999999998 109.036 177.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 33.8 t -89.54 -6.07 56.68 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.584 1.154 . . . . 70.019999999999996 111.783 177.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -122.72 35.79 4.8 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 125.818 1.647 . . . . 72.030000000000001 108.812 -171.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 21.8 mm . . . . . 0 C--O 1.252 1.19 0 N-CA-C 107.46 -1.311 . . . . 74.209999999999994 107.46 172.687 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.8 mtt . . . . . 0 N--CA 1.473 0.677 0 N-CA-C 109.473 -0.565 . . . . 71.25 109.473 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.2 t -72.68 160.34 32.38 Favored 'General case' 0 CA--C 1.551 1.017 0 N-CA-C 106.25 -1.759 . . . . 74.25 106.25 -177.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 10.9 t -160.98 148.43 15.46 Favored 'General case' 0 C--O 1.235 0.295 0 O-C-N 120.443 -1.411 . . . . 74.239999999999995 110.049 -177.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -146.65 176.9 9.49 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 125.324 1.449 . . . . 73.230000000000004 108.689 170.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -58.72 172.4 0.52 Allowed 'General case' 0 C--O 1.238 0.48 0 C-N-CA 125.202 1.401 . . . . 74.25 110.389 160.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 47.0 p30 -117.5 163.56 16.22 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 124.606 1.163 . . . . 71.030000000000001 110.758 171.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 27.2 mtp85 -140.77 110.06 6.24 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 123.856 0.863 . . . . 74.25 108.758 -167.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.4 mt-10 -67.2 -16.14 64.12 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 113.918 1.081 . . . . 74.040000000000006 113.918 -179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -100.77 172.68 6.92 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 119.527 1.058 . . . . 74.019999999999996 110.213 -174.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 50.75 69.75 0.6 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.643 1.577 . . . . 72.329999999999998 111.394 -173.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -123.38 -165.09 1.28 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 127.102 2.161 . . . . 64.049999999999997 108.514 -179.383 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 64.6 95.17 0.05 Allowed 'General case' 0 C--O 1.235 0.341 0 C-N-CA 126.87 2.068 . . . . 73.049999999999997 111.063 174.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 57.71 0.21 0.1 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 127.729 2.412 . . . . 71.019999999999996 114.21 -166.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 18.5 mmtm -66.33 -16.73 64.29 Favored 'General case' 0 C--O 1.221 -0.433 0 O-C-N 120.194 -1.566 . . . . 73.439999999999998 112.988 -178.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -50.22 -28.33 7.4 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 125.612 1.565 . . . . 72.409999999999997 114.826 173.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.95 -15.67 63.71 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.632 0.604 . . . . 71.439999999999998 112.632 178.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 64.4 t-80 -130.28 141.57 50.6 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 126.138 1.775 . . . . 74.120000000000005 108.129 -164.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 59.51 -175.84 0.1 Allowed 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.839 1.256 . . . . 74.150000000000006 109.532 -160.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -119.37 -19.07 8.39 Favored 'General case' 0 C--O 1.225 -0.21 0 O-C-N 121.146 -0.971 . . . . 74.349999999999994 111.883 164.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.88 -41.86 83.4 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.613 0.765 . . . . 74.120000000000005 110.516 -170.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.0 mt -71.96 -46.4 57.54 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 108.672 -0.862 . . . . 71.25 108.672 -175.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -61.45 -43.84 98.16 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 124.538 1.135 . . . . 73.439999999999998 111.977 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -58.79 -36.9 75.19 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 124.185 0.994 . . . . 74.140000000000001 111.014 -177.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.06 -29.65 44.97 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.821 0.848 . . . . 72.340000000000003 111.498 178.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -74.53 -54.06 8.24 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 124.717 1.207 . . . . 74.150000000000006 112.049 178.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.8 tp10 -55.87 -32.97 64.15 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.588 -0.695 . . . . 72.329999999999998 109.886 174.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -75.34 8.56 2.66 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.513 1.125 . . . . 70.349999999999994 112.31 178.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.2 mmt180 -87.91 -23.71 23.84 Favored 'General case' 0 C--O 1.231 0.111 0 O-C-N 120.656 -1.278 . . . . 74.209999999999994 111.142 166.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.3 ptt180 -67.19 -23.0 65.71 Favored 'General case' 0 C--N 1.344 0.364 0 CA-C-N 120.976 1.716 . . . . 74.430000000000007 115.185 -149.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -110.45 -12.33 14.4 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-O 118.222 -0.894 . . . . 73.420000000000002 112.02 170.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.46 -55.01 31.74 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 125.057 1.343 . . . . 74.0 110.405 171.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -66.22 -9.61 33.84 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.859 1.059 . . . . 74.129999999999995 113.859 -172.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.7 tp -56.33 -31.93 64.2 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 126.946 2.098 . . . . 70.019999999999996 111.291 171.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.49 -31.71 81.68 Favored Glycine 0 CA--C 1.532 1.141 0 O-C-N 121.252 -0.905 . . . . 74.430000000000007 112.325 176.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -68.86 -26.99 65.42 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.797 1.298 . . . . 74.239999999999995 110.768 -178.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 20.6 t90 -68.6 -65.26 0.72 Allowed 'General case' 0 N--CA 1.462 0.144 0 C-N-CA 124.87 1.268 . . . . 74.340000000000003 109.152 173.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.18 -41.36 71.83 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 118.765 -0.636 . . . . 63.119999999999997 111.878 -174.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -44.87 -60.8 1.87 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.523 1.129 . . . . 65.010000000000005 112.92 -178.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.65 -30.4 77.52 Favored Glycine 0 CA--C 1.528 0.898 0 CA-C-N 118.577 0.626 . . . . 72.340000000000003 112.58 -175.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 56.9 mt -68.13 -41.51 81.58 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.131 0.972 . . . . 72.129999999999995 110.012 175.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.8 mp -69.96 -1.84 10.81 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 126.387 1.875 . . . . 72.329999999999998 113.72 168.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 74.5 4.22 69.08 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 125.54 1.543 . . . . 72.310000000000002 113.679 -179.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 53.1 mttm -76.12 128.75 35.61 Favored 'General case' 0 CA--C 1.524 -0.033 0 CA-C-N 119.875 1.838 . . . . 71.430000000000007 106.856 170.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 p -134.72 166.29 23.29 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 123.823 0.849 . . . . 71.230000000000004 109.066 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 55.21 -129.74 46.42 Favored Glycine 0 CA--C 1.525 0.663 0 C-N-CA 123.667 0.651 . . . . 74.439999999999998 112.057 176.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -61.1 -36.2 79.05 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 124.645 1.178 . . . . 72.430000000000007 111.005 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.42 -37.33 86.88 Favored 'General case' 0 N--CA 1.465 0.303 0 O-C-N 121.179 -0.95 . . . . 70.319999999999993 111.296 177.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.44 -43.43 63.8 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 123.112 0.565 . . . . 74.310000000000002 109.858 177.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.5 ptp180 -65.6 -46.09 80.66 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 109.279 -0.637 . . . . 65.430000000000007 109.279 -173.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.25 -36.6 84.19 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.681 1.192 . . . . 62.310000000000002 111.542 -178.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -65.23 -45.8 83.18 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.646 0.779 . . . . 74.409999999999997 110.588 173.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -69.36 -14.95 63.2 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 114.211 1.189 . . . . 71.019999999999996 114.211 -174.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 64.3 mt -58.44 -20.54 45.77 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 119.432 1.014 . . . . 73.439999999999998 112.759 -176.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.0 t -135.32 32.12 3.13 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.352 1.061 . . . . 71.400000000000006 110.586 -168.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 95.0 t -113.61 99.57 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 N-CA-C 106.446 -1.687 . . . . 74.310000000000002 106.446 177.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 9.6 p -156.12 135.88 3.99 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 N-CA-C 107.089 -1.449 . . . . 71.230000000000004 107.089 164.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.7 t 177.21 155.77 0.29 Allowed 'General case' 0 C--O 1.235 0.341 0 C-N-CA 128.353 2.661 . . . . 74.409999999999997 105.477 172.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.2 p -160.01 121.38 3.15 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 119.012 0.824 . . . . 73.099999999999994 108.966 167.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -133.55 167.35 20.62 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 108.714 -0.847 . . . . 74.200000000000003 108.714 162.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -161.24 -170.26 2.6 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.276 1.83 . . . . 74.230000000000004 107.384 170.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 3.9 t70 75.21 -157.93 0.05 Allowed 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 126.779 2.032 . . . . 70.030000000000001 109.289 -178.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 65.91 165.82 0.12 Allowed Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 125.926 1.691 . . . . 63.119999999999997 114.493 177.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -84.91 4.45 6.82 Favored 'Trans proline' 0 CA--C 1.546 1.117 0 C-N-CA 123.797 2.998 . . . . 73.340000000000003 113.527 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -82.92 169.02 47.93 Favored Glycine 0 CA--C 1.526 0.75 0 O-C-N 120.358 -1.464 . . . . 73.219999999999999 112.076 -178.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -86.11 -62.44 1.52 Allowed 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 124.677 1.191 . . . . 70.430000000000007 109.159 172.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -132.86 -64.8 0.73 Allowed 'General case' 0 C--O 1.222 -0.392 0 CA-C-O 118.768 -0.634 . . . . 73.209999999999994 111.867 -136.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 43.6 -85.74 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 128.466 2.706 . . . . 70.329999999999998 116.195 162.05 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 2.1 p -70.12 -57.49 7.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 C-N-CA 126.923 2.089 . . . . 71.299999999999997 109.388 174.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -63.48 -18.54 63.89 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 124.949 1.3 . . . . 74.430000000000007 112.282 -179.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -44.91 -46.81 11.14 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 119.967 1.258 . . . . 74.310000000000002 112.431 -172.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.1 mppt? -78.85 -1.4 34.82 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.163 0.985 . . . . 74.140000000000001 112.918 -174.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 72.1 mt -104.51 -54.33 2.54 Favored 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 126.265 1.826 . . . . 70.420000000000002 108.285 168.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.33 -54.15 44.21 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 126.133 1.773 . . . . 72.319999999999993 111.352 -170.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -76.18 -19.31 58.56 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 111.881 0.326 . . . . 74.430000000000007 111.881 -177.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.37 -50.79 35.21 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 108.007 -1.109 . . . . 71.030000000000001 108.007 173.748 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 79.9 mt -80.62 43.35 0.66 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 129.144 2.978 . . . . 71.310000000000002 110.573 175.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -52.56 104.25 0.09 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.729 1.611 . . . . 74.230000000000004 109.76 177.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 69.03 14.15 67.79 Favored Glycine 0 CA--C 1.533 1.179 0 CA-C-O 118.799 -1.001 . . . . 63.020000000000003 113.844 -177.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 25.0 mtmm -113.46 -11.19 13.13 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.287 1.543 . . . . 74.409999999999997 112.055 178.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -148.69 138.93 22.42 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.204 -1.035 . . . . 71.129999999999995 108.204 165.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.41 161.82 25.9 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 125.787 1.635 . . . . 72.439999999999998 109.407 176.386 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 85.0 mt-10 -59.83 -46.31 89.66 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.46 0.704 . . . . 74.439999999999998 110.091 175.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -74.01 -15.18 61.1 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 121.379 -0.826 . . . . 71.430000000000007 111.311 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.6 m -74.46 -32.88 62.74 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 117.785 -1.102 . . . . 61.43 109.975 171.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 11.7 mt -58.5 -60.31 2.47 Favored 'Isoleucine or valine' 0 C--O 1.239 0.516 0 CA-C-N 120.624 1.557 . . . . 74.400000000000006 108.874 177.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -53.37 -39.73 64.41 Favored 'General case' 0 C--N 1.343 0.314 0 O-C-N 124.679 1.237 . . . . 72.0 109.978 -178.68 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.25 -45.51 76.49 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 119.625 -0.226 . . . . 53.200000000000003 110.567 -176.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.36 -38.31 71.59 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.592 0.589 . . . . 74.340000000000003 112.592 -163.019 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 33.1 mtt -66.93 -0.73 3.31 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.251 -0.905 . . . . 72.230000000000004 112.684 176.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 46.6 t -120.58 -29.15 1.76 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 C-N-CA 126.482 1.913 . . . . 63.039999999999999 110.132 -178.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -55.67 -48.66 74.69 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.368 1.467 . . . . 74.430000000000007 109.007 175.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 15.3 mt -77.43 4.51 10.8 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.013 1.116 . . . . 54.310000000000002 114.013 -176.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 63.9 ttt180 -66.28 -20.64 66.16 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 120.654 -1.279 . . . . 70.109999999999999 113.543 -166.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -88.27 -46.19 9.42 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 119.658 1.117 . . . . 65.430000000000007 110.355 170.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 52.4 m -50.38 -36.19 31.51 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.261 1.024 . . . . 65.439999999999998 110.532 177.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -46.13 -49.58 16.54 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.22 1.008 . . . . 64.310000000000002 113.037 175.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.9 ptt-85 -79.88 -37.82 34.01 Favored 'General case' 0 C--N 1.342 0.259 0 CA-C-N 118.421 0.555 . . . . 64.450000000000003 110.911 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -56.72 -38.11 71.9 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 124.572 1.149 . . . . 73.329999999999998 110.426 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -57.38 -36.73 71.63 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 119.203 0.911 . . . . 74.409999999999997 112.441 -175.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.9 mm -72.62 -48.47 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 CA-C-N 120.196 1.362 . . . . 74.209999999999994 107.885 177.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 70.1 mt -61.02 -13.63 7.9 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 C-N-CA 126.031 1.732 . . . . 74.140000000000001 110.745 -177.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -120.79 10.69 11.0 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.972 1.309 . . . . 62.439999999999998 112.106 -178.18 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 84.4 mt-10 -121.76 22.39 10.5 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.703 1.201 . . . . 73.329999999999998 110.446 174.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 35.2 mm . . . . . 0 C--O 1.256 1.407 0 C-N-CA 128.66 2.784 . . . . 73.120000000000005 110.599 -170.526 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.4 mmt . . . . . 0 N--CA 1.474 0.758 0 N-CA-C 113.77 1.026 . . . . 71.450000000000003 113.77 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.7 m -118.31 56.89 0.86 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 120.826 1.648 . . . . 72.450000000000003 111.307 -150.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . 0.3 57.6 p 53.55 -18.72 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 129.483 3.113 . . . . 72.439999999999998 116.7 -174.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -139.76 167.77 21.34 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 128.673 2.789 . . . . 75.409999999999997 108.035 177.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -126.13 -52.66 1.52 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 126.016 1.727 . . . . 72.329999999999998 108.221 -174.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 50.1 m-20 49.85 -157.62 0.08 Allowed 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 127.166 2.187 . . . . 60.539999999999999 111.142 171.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 20.9 mtp180 -86.55 33.36 0.64 Allowed 'General case' 0 C--O 1.236 0.378 0 O-C-N 119.768 -1.832 . . . . 73.140000000000001 110.156 172.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -102.74 -10.48 19.12 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.819 1.247 . . . . 55.329999999999998 111.64 -176.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.52 161.72 19.55 Favored 'General case' 0 C--O 1.232 0.146 0 O-C-N 120.424 -1.423 . . . . 63.450000000000003 111.535 163.203 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -151.87 54.86 0.83 Allowed 'General case' 0 C--O 1.236 0.35 0 CA-C-N 114.865 -1.062 . . . . 75.510000000000005 111.579 178.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -71.58 24.23 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.487 1.515 . . . . 72.519999999999996 114.84 -174.173 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -81.17 -85.6 0.1 Allowed 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.125 -0.985 . . . . 73.120000000000005 108.868 171.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.97 -14.76 61.08 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.95 0.722 . . . . 75.340000000000003 112.95 -174.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 25.2 mmtm -64.04 -12.22 36.57 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 118.227 -0.892 . . . . 74.120000000000005 113.154 -179.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -62.23 -17.26 57.84 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 120.622 1.555 . . . . 74.510000000000005 113.578 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -93.59 17.46 11.65 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.901 0.88 . . . . 75.510000000000005 111.825 173.487 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -143.37 -64.91 0.39 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.806 1.643 . . . . 75.450000000000003 110.813 -174.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -86.59 123.29 31.61 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 124.52 1.128 . . . . 75.329999999999998 111.406 -166.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.0 -33.99 75.66 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.386 1.074 . . . . 74.209999999999994 110.894 178.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -59.82 -24.39 64.13 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.869 0.867 . . . . 75.519999999999996 111.32 -175.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 48.7 mt -84.65 -46.07 11.86 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 124.992 1.317 . . . . 72.239999999999995 109.398 -179.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -50.6 -51.39 48.89 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.62 1.568 . . . . 73.129999999999995 108.68 176.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.79 -46.91 88.68 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 124.297 1.039 . . . . 74.310000000000002 111.606 -178.004 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -66.52 -39.26 88.54 Favored 'General case' 0 N--CA 1.44 -0.938 0 O-C-N 119.632 -1.917 . . . . 73.120000000000005 109.628 -177.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.8 -44.79 95.24 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 118.068 0.394 . . . . 74.340000000000003 111.894 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.3 tm-20 -53.61 -38.47 64.02 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.388 0.613 . . . . 75.010000000000005 110.307 173.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -78.24 1.76 20.52 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.945 0.898 . . . . 75.239999999999995 113.38 -175.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.4 mmt-85 -80.23 -19.08 47.74 Favored 'General case' 0 N--CA 1.464 0.245 0 O-C-N 120.268 -1.52 . . . . 72.450000000000003 110.95 164.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 45.2 mtp180 -52.95 -41.94 64.99 Favored 'General case' 0 C--N 1.342 0.279 0 N-CA-C 114.587 1.328 . . . . 72.030000000000001 114.587 -169.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -95.23 -31.02 13.69 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 123.813 0.695 . . . . 75.040000000000006 111.671 -177.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -44.6 -52.57 7.99 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.047 1.339 . . . . 75.310000000000002 111.536 -178.182 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.98 -5.08 44.59 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 114.805 1.409 . . . . 74.430000000000007 114.805 -169.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 25.7 tp -71.52 -32.52 68.29 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 127.141 2.176 . . . . 72.200000000000003 110.508 171.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -57.19 -48.59 78.78 Favored Glycine 0 C--N 1.34 0.793 0 N-CA-C 110.568 -1.013 . . . . 64.209999999999994 110.568 173.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -63.88 -30.13 71.24 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 124.807 1.243 . . . . 72.040000000000006 112.803 -170.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 9.1 t90 -63.89 -71.6 0.17 Allowed 'General case' 0 C--O 1.231 0.117 0 N-CA-C 107.446 -1.316 . . . . 73.329999999999998 107.446 171.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.1 -32.35 34.77 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 125.496 1.518 . . . . 74.400000000000006 112.394 -173.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -45.17 -52.95 8.75 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 119.383 0.992 . . . . 73.430000000000007 111.53 174.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.58 -42.22 97.64 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 111.63 -0.588 . . . . 73.209999999999994 111.63 -178.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.6 mp -61.68 -46.29 90.35 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 125.365 1.466 . . . . 75.239999999999995 109.988 177.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.2 mp -63.2 -28.49 70.08 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.89 0.876 . . . . 62.299999999999997 110.478 175.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 104.21 20.38 10.49 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 126.237 1.875 . . . . 63.32 112.181 176.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 39.7 mttm -89.97 133.26 34.9 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 107.461 -1.311 . . . . 74.430000000000007 107.461 169.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.6 p -132.71 162.28 31.84 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 123.577 0.751 . . . . 73.040000000000006 109.479 165.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.51 -135.75 22.51 Favored Glycine 0 N--CA 1.448 -0.508 0 N-CA-C 110.322 -1.111 . . . . 33.149999999999999 110.322 175.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -66.22 -27.22 67.81 Favored 'General case' 0 C--O 1.226 -0.175 0 O-C-N 122.297 -0.531 . . . . 60.310000000000002 112.389 -177.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -56.61 -50.08 73.04 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.997 1.319 . . . . 75.239999999999995 109.123 174.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.13 -40.14 71.6 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 125.44 1.496 . . . . 74.409999999999997 110.299 -177.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.7 ttt85 -59.84 -49.96 75.68 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 123.334 0.654 . . . . 60.340000000000003 109.596 177.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.62 -44.78 95.92 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.153 0.981 . . . . 55.240000000000002 110.684 -178.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 88.6 t80 -57.08 -39.02 74.15 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.498 1.119 . . . . 73.239999999999995 111.099 175.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.85 -4.19 30.24 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 120.59 -1.319 . . . . 63.399999999999999 113.229 178.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 12.9 mt -84.62 -0.07 52.01 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 120.547 1.522 . . . . 62.229999999999997 112.145 176.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 12.0 t -130.49 37.72 3.82 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 120.621 1.555 . . . . 55.420000000000002 112.054 -173.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 1.8 p -134.88 99.0 2.37 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 O-C-N 121.021 -1.049 . . . . 75.299999999999997 110.552 -175.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.2 p -159.59 109.36 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 124.147 0.979 . . . . 72.409999999999997 113.246 166.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.4 t -149.45 57.9 1.0 Allowed 'General case' 0 CA--C 1.554 1.098 0 O-C-N 121.202 -0.936 . . . . 64.219999999999999 111.246 177.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.4 t 61.43 -154.23 0.36 Allowed 'General case' 0 CA--C 1.542 0.641 0 O-C-N 120.218 -1.551 . . . . 64.129999999999995 110.026 -175.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -131.68 -162.87 1.26 Allowed 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 127.776 2.431 . . . . 71.340000000000003 108.263 163.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -69.06 112.02 5.42 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 118.901 0.773 . . . . 72.349999999999994 110.289 -176.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -119.68 91.15 3.48 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 127.097 2.159 . . . . 73.450000000000003 106.06 178.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 58.21 164.96 0.08 OUTLIER Pre-proline 0 CA--C 1.552 1.026 0 C-N-CA 127.717 2.407 . . . . 75.150000000000006 114.306 -172.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -84.76 64.12 6.46 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.878 2.385 . . . . 75.25 110.227 176.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -144.3 -58.24 0.02 OUTLIER Glycine 0 C--N 1.33 0.241 0 N-CA-C 110.058 -1.217 . . . . 75.049999999999997 110.058 -178.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -61.37 -63.84 1.15 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.644 0.777 . . . . 75.420000000000002 109.434 178.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . 0.257 14.6 pt-20 48.74 16.61 0.12 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 129.596 3.158 . . . . 73.239999999999995 115.883 -175.845 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -51.57 -44.32 62.71 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.864 1.666 . . . . 75.329999999999998 112.868 -168.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.2 t -55.19 -59.44 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-N 118.761 0.71 . . . . 75.439999999999998 109.499 174.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -57.59 -36.51 71.83 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.497 0.719 . . . . 75.040000000000006 110.612 -178.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.6 tpt180 -58.88 -26.58 64.41 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 124.489 1.116 . . . . 72.120000000000005 112.439 -178.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.7 mmmt -99.41 -43.84 6.41 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 118.488 0.585 . . . . 75.329999999999998 109.505 175.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -57.44 -54.8 42.7 Favored 'General case' 0 C--O 1.223 -0.341 0 C-N-CA 124.857 1.263 . . . . 75.010000000000005 110.204 -174.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.09 -4.0 15.46 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 114.006 1.113 . . . . 72.439999999999998 114.006 -178.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -87.19 -57.47 2.95 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 108.399 -0.963 . . . . 74.200000000000003 108.399 166.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.05 -43.3 70.09 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 125.068 1.347 . . . . 74.439999999999998 110.653 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.3 tp -110.88 19.85 18.13 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 126.841 2.056 . . . . 75.439999999999998 111.512 -165.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 69.5 tt0 -48.64 118.9 2.76 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 126.007 1.723 . . . . 71.219999999999999 108.284 172.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 81.11 -0.58 87.21 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 125.517 1.532 . . . . 75.120000000000005 114.78 178.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 11.3 mtpp -119.54 1.88 11.18 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 118.899 1.35 . . . . 75.239999999999995 111.785 -172.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -148.68 -163.08 1.7 Allowed 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 125.654 1.582 . . . . 75.230000000000004 107.194 168.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -145.65 158.2 43.88 Favored 'General case' 0 CA--C 1.51 -0.562 0 C-N-CA 125.898 1.679 . . . . 60.340000000000003 108.05 -175.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -59.85 -42.52 93.83 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 118.577 0.626 . . . . 71.450000000000003 111.596 -178.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.92 -39.41 72.72 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.021 0.373 . . . . 75.430000000000007 111.128 176.723 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 53.7 m -59.81 -48.18 82.71 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.197 0.999 . . . . 75.200000000000003 110.819 177.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 64.6 mt -63.34 -50.41 78.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 108.447 -0.945 . . . . 73.129999999999995 108.447 -177.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.97 -40.44 97.73 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 120.703 -0.399 . . . . 75.239999999999995 110.071 -176.479 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.8 -54.82 41.82 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 118.156 -0.926 . . . . 71.030000000000001 110.37 176.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.21 -56.58 12.1 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 118.937 0.789 . . . . 74.310000000000002 111.698 -176.737 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 8.9 ptp -66.09 -26.88 67.68 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 119.468 -0.893 . . . . 61.119999999999997 111.603 -173.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 59.7 t -78.9 -51.99 16.07 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 O-C-N 121.089 -1.007 . . . . 75.340000000000003 110.432 176.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -61.1 -31.46 71.15 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.594 1.158 . . . . 73.310000000000002 112.305 -162.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 18.1 mt -75.63 1.1 15.36 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.57 1.548 . . . . 74.140000000000001 112.894 -177.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 30.4 ttt180 -50.89 -45.81 60.3 Favored 'General case' 0 C--N 1.34 0.195 0 C-N-CA 124.433 1.093 . . . . 74.340000000000003 111.008 177.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -56.21 -61.61 2.28 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.707 0.803 . . . . 71.049999999999997 110.961 174.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 10.9 m -49.26 -37.35 23.26 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 127.265 2.226 . . . . 75.219999999999999 111.993 -175.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -51.08 -30.7 16.66 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.623 1.169 . . . . 72.329999999999998 113.469 -178.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 34.2 ttp180 -69.2 -60.3 2.44 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 108.582 -0.896 . . . . 75.409999999999997 108.582 174.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 11.8 mp0 -55.52 -35.1 65.28 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 118.002 -0.999 . . . . 75.150000000000006 110.651 -173.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -50.63 -45.77 57.89 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-O 118.409 -0.805 . . . . 72.340000000000003 112.483 -178.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 45.7 mm -63.77 -46.37 94.66 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-N 119.33 0.968 . . . . 72.540000000000006 109.72 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 32.4 mt -70.11 -12.03 15.62 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 124.614 1.166 . . . . 75.109999999999999 109.452 179.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 13.1 t -108.21 10.2 27.93 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.93 1.692 . . . . 73.540000000000006 109.154 179.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -112.81 12.53 19.54 Favored 'General case' 0 C--O 1.232 0.162 0 O-C-N 119.93 -1.732 . . . . 72.329999999999998 109.941 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 31.8 mt . . . . . 0 C--O 1.251 1.163 0 N-CA-C 107.704 -1.221 . . . . 72.450000000000003 107.704 -178.619 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ttm . . . . . 0 N--CA 1.474 0.764 0 N-CA-C 107.649 -1.241 . . . . 64.329999999999998 107.649 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -61.16 158.53 13.7 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 119.792 1.178 . . . . 75.530000000000001 108.994 158.435 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 26.1 m 72.1 158.41 0.2 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.938 1.295 . . . . 72.530000000000001 111.309 172.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.24 169.6 16.75 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.281 -0.887 . . . . 73.219999999999999 112.371 -166.13 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -70.16 97.7 1.24 Allowed 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 108.798 -0.816 . . . . 74.030000000000001 108.798 171.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -62.25 -43.76 98.1 Favored 'General case' 0 C--N 1.333 -0.152 0 C-N-CA 125.651 1.58 . . . . 71.25 111.261 177.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 19.4 mmt180 -91.54 128.77 37.5 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 125.197 1.399 . . . . 73.010000000000005 108.957 177.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -67.63 165.66 16.6 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-O 122.267 1.032 . . . . 75.450000000000003 111.054 175.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 49.9 mtm-85 -72.2 175.59 5.92 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.21 1.804 . . . . 71.329999999999998 109.845 172.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -170.71 84.06 0.1 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 126.129 1.772 . . . . 73.209999999999994 109.4 169.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . 0.441 ' CD2' ' H ' ' A' ' 11' ' ' HIS . 0.2 OUTLIER -71.14 -3.48 20.24 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 116.256 1.947 . . . . 74.200000000000003 116.256 177.38 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.472 ' C ' ' H ' ' A' ' 14' ' ' LYS . 31.1 mt-10 -61.96 119.58 9.12 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.984 0.914 . . . . 73.219999999999999 110.679 -177.54 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 56.06 -22.4 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 130.447 3.499 . . . . 75.409999999999997 116.883 -174.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.472 ' H ' ' C ' ' A' ' 12' ' ' GLU . 32.6 mmtt -50.01 -28.86 7.59 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 128.754 2.822 . . . . 75.200000000000003 113.37 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.49 -25.31 64.34 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 113.014 0.746 . . . . 72.129999999999995 113.014 -176.076 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.39 -8.13 43.82 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.152 0.797 . . . . 71.219999999999999 113.152 176.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 13.3 t-80 -145.06 -171.39 3.64 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 125.96 1.704 . . . . 74.430000000000007 108.03 -160.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 58.3 -164.19 0.19 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.228 1.411 . . . . 60.299999999999997 110.365 170.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -143.44 -39.18 0.32 Allowed 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.847 1.259 . . . . 74.209999999999994 110.756 167.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -54.67 -43.67 72.62 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 119.554 1.07 . . . . 64.239999999999995 111.586 -172.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 80.4 mt -75.1 -33.89 61.68 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 123.872 0.869 . . . . 74.439999999999998 112.444 177.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -69.93 -36.8 75.62 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.343 1.457 . . . . 74.310000000000002 110.698 -177.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -46.13 -35.96 5.47 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 128.458 2.703 . . . . 75.209999999999994 113.76 -173.06 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.09 -53.44 57.78 Favored 'General case' 0 C--O 1.225 -0.212 0 O-C-N 120.652 -1.28 . . . . 73.299999999999997 111.138 175.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.74 -39.41 84.25 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 118.985 0.811 . . . . 73.030000000000001 111.884 178.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -50.94 -37.57 45.15 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.73 1.212 . . . . 74.5 110.814 -176.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.442 ' C ' ' H ' ' A' ' 29' ' ' ARG . . . -110.08 -85.34 0.55 Allowed 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.607 -0.886 . . . . 74.540000000000006 108.607 178.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 50.37 -12.95 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 129.128 2.971 . . . . 74.219999999999999 117.414 -173.375 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.442 ' H ' ' C ' ' A' ' 27' ' ' ALA . 30.7 mtm180 -44.45 -48.59 9.99 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 126.958 2.103 . . . . 75.510000000000005 113.186 -158.651 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -100.25 -24.3 14.59 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 122.456 0.302 . . . . 62.119999999999997 111.257 -177.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -7.89 1.06 Allowed 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 126.949 2.1 . . . . 75.150000000000006 114.225 -173.126 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -120.72 -15.16 8.45 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 119.872 1.215 . . . . 62.399999999999999 112.919 -178.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 12.3 tp -60.56 -21.14 62.23 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 127.707 2.403 . . . . 74.129999999999995 111.891 172.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -70.22 -42.29 66.87 Favored Glycine 0 C--O 1.224 -0.499 0 N-CA-C 110.48 -1.048 . . . . 71.049999999999997 110.48 175.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -61.82 -39.35 91.47 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.548 1.174 . . . . 71.420000000000002 110.663 179.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 36.1 t90 -55.03 -63.47 1.14 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.627 0.771 . . . . 75.140000000000001 109.375 172.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.83 -29.4 69.86 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.069 0.948 . . . . 75.450000000000003 113.337 -173.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -55.59 -54.46 43.82 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 124.317 1.047 . . . . 72.25 110.136 -177.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -67.37 -5.83 37.67 Favored Glycine 0 CA--C 1.532 1.117 0 CA-C-O 119.032 -0.871 . . . . 73.239999999999995 113.687 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 35.8 mt -90.93 -37.06 13.76 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 119.339 1.57 . . . . 75.209999999999994 110.42 171.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 47.2 mt -91.36 8.79 34.43 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.58 1.952 . . . . 73.230000000000004 113.163 -173.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 75.65 5.25 78.13 Favored Glycine 0 CA--C 1.527 0.786 0 CA-C-O 119.274 -0.737 . . . . 71.040000000000006 113.0 -177.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.1 mttm -78.91 119.66 22.41 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 119.072 1.436 . . . . 64.040000000000006 107.125 -179.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 67.1 p -135.29 175.95 9.12 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 107.789 -1.189 . . . . 74.409999999999997 107.789 159.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 58.12 -145.25 41.26 Favored Glycine 0 CA--C 1.532 1.096 0 N-CA-C 111.571 -0.612 . . . . 74.319999999999993 111.571 -172.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -58.0 -31.32 66.84 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.312 1.045 . . . . 72.340000000000003 111.348 -172.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -63.57 -42.86 98.29 Favored 'General case' 0 C--O 1.225 -0.224 0 C-N-CA 123.8 0.84 . . . . 73.030000000000001 110.966 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.3 -41.54 69.81 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.856 -0.794 . . . . 74.409999999999997 108.856 177.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.8 ptt-85 -73.07 -41.64 63.91 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 119.368 -0.933 . . . . 75.129999999999995 108.928 -169.088 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.18 -42.33 99.36 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 123.517 0.727 . . . . 74.129999999999995 110.958 176.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -58.1 -46.09 86.1 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.3 0.5 . . . . 75.329999999999998 110.318 173.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.97 -12.93 5.15 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.541 1.136 . . . . 75.230000000000004 113.226 176.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 56.3 mt -101.6 1.44 37.82 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.759 1.624 . . . . 75.349999999999994 112.63 -177.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.8 t -125.23 -9.77 7.02 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 119.501 1.046 . . . . 75.230000000000004 112.502 176.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 12.3 m -70.71 84.39 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 C-N-CA 126.13 1.772 . . . . 75.25 111.756 175.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 2.9 p -139.99 132.98 35.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 O-C-N 121.167 -0.958 . . . . 64.530000000000001 111.804 151.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.1 t -148.47 -164.86 2.12 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 106.058 -1.83 . . . . 74.310000000000002 106.058 162.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.25 -163.66 0.39 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.435 1.494 . . . . 75.129999999999995 112.303 -178.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -138.76 173.18 11.85 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.532 1.133 . . . . 72.519999999999996 109.289 157.058 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -65.53 -85.43 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.253 1.821 . . . . 74.540000000000006 110.65 -175.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 11.9 t0 72.37 0.63 3.66 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 127.531 2.332 . . . . 64.519999999999996 113.06 -172.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -151.25 161.2 30.44 Favored Pre-proline 0 CA--C 1.544 0.745 0 C-N-CA 125.655 1.582 . . . . 62.530000000000001 109.929 177.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -88.62 64.77 3.0 Favored 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 123.154 2.57 . . . . 55.100000000000001 111.022 -167.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -169.47 -140.7 3.03 Favored Glycine 0 CA--C 1.522 0.48 0 N-CA-C 110.213 -1.155 . . . . 72.530000000000001 110.213 -176.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 3.0 t70 46.2 45.43 12.85 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 130.502 3.521 . . . . 63.109999999999999 115.239 173.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 81.9 mt-10 -65.56 61.74 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 125.934 1.694 . . . . 75.129999999999995 112.055 173.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -135.95 -40.32 0.68 Allowed 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 126.575 1.95 . . . . 72.319999999999993 109.665 168.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.3 p -60.22 -44.93 96.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-N 119.543 1.065 . . . . 72.439999999999998 111.198 179.178 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -62.08 -21.07 64.65 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 121.062 -1.024 . . . . 63.509999999999998 113.492 177.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -53.56 -38.85 64.25 Favored 'General case' 0 C--N 1.343 0.287 0 CA-C-N 119.124 0.875 . . . . 73.239999999999995 110.949 -174.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -66.96 -31.62 72.31 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.612 -0.514 . . . . 73.519999999999996 109.612 -171.12 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -78.2 -51.18 10.59 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-O 118.487 -0.768 . . . . 74.439999999999998 109.12 169.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.58 -40.83 72.53 Favored 'General case' 0 C--N 1.334 -0.107 0 C-N-CA 125.074 1.35 . . . . 74.25 113.214 -171.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.81 -17.07 62.18 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.355 1.062 . . . . 73.420000000000002 112.503 179.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -97.95 -55.02 2.91 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 108.782 -0.821 . . . . 74.519999999999996 108.782 -178.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.7 mt -78.71 40.4 0.38 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 127.43 2.292 . . . . 74.409999999999997 111.055 170.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -57.97 113.07 1.72 Allowed 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.836 1.254 . . . . 73.239999999999995 108.312 175.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 75.31 12.05 83.81 Favored Glycine 0 CA--C 1.528 0.884 0 C-N-CA 124.708 1.147 . . . . 61.509999999999998 112.949 -178.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -133.02 -8.63 3.05 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.013 1.325 . . . . 75.430000000000007 112.153 -172.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -157.69 114.83 2.98 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.883 1.273 . . . . 73.140000000000001 108.25 163.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -67.44 170.65 7.1 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 124.72 1.208 . . . . 74.099999999999994 110.912 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -47.42 -55.74 8.36 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.123 1.769 . . . . 75.439999999999998 110.12 166.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -69.84 -30.48 67.99 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 122.967 0.507 . . . . 75.439999999999998 111.119 -176.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 30.5 m -65.09 -53.63 42.43 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 109.268 -0.642 . . . . 71.5 109.268 176.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 41.2 mt -61.74 -52.46 60.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 CA-C-N 119.575 1.079 . . . . 75.530000000000001 109.017 -178.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.04 -23.41 67.43 Favored 'General case' 0 C--N 1.34 0.157 0 N-CA-C 111.849 0.314 . . . . 75.120000000000005 111.849 -175.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.42 -54.73 5.21 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 108.717 -0.845 . . . . 75.230000000000004 108.717 174.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.9 tppm? -54.56 -57.1 12.73 Favored 'General case' 0 CA--C 1.512 -0.518 0 C-N-CA 125.948 1.699 . . . . 73.120000000000005 112.136 -171.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 5.2 ptm -59.56 -26.93 65.79 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 120.067 -0.653 . . . . 71.329999999999998 111.237 -175.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 59.7 t -88.25 -27.08 5.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 125.625 1.57 . . . . 74.140000000000001 111.832 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -55.52 -57.82 10.34 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 126.342 1.857 . . . . 73.099999999999994 108.053 172.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.2 pp -80.8 11.58 3.81 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.912 1.685 . . . . 73.219999999999999 113.275 -172.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -53.37 -50.99 63.91 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 120.945 -1.097 . . . . 74.219999999999999 110.971 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.99 -45.41 85.73 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.232 0.539 . . . . 75.439999999999998 110.694 175.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.9 m -50.92 -35.92 35.72 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.625 1.57 . . . . 71.109999999999999 111.517 -178.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -47.79 -45.57 29.61 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.26 1.424 . . . . 74.219999999999999 113.547 177.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -78.86 -43.44 25.08 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.807 1.185 . . . . 75.230000000000004 111.038 174.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.14 -31.91 67.65 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 124.434 1.094 . . . . 75.030000000000001 112.538 -175.131 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -61.73 -24.48 66.83 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.338 0.972 . . . . 72.310000000000002 112.448 177.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 26.7 mm -81.77 -38.38 15.92 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 C-N-CA 124.106 0.962 . . . . 63.039999999999999 110.03 175.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 23.0 mm -59.41 -27.17 36.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 123.733 0.813 . . . . 74.010000000000005 109.648 174.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.63 -17.41 61.67 Favored 'General case' 0 N--CA 1.44 -0.928 0 C-N-CA 125.889 1.675 . . . . 74.209999999999994 112.021 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -139.37 62.23 1.53 Allowed 'General case' 0 C--O 1.237 0.422 0 N-CA-C 106.403 -1.702 . . . . 60.0 106.403 -175.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 95.8 mt . . . . . 0 C--O 1.255 1.383 0 N-CA-C 107.089 -1.448 . . . . 71.439999999999998 107.089 162.582 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.483 1.203 0 CA-C-O 121.735 0.779 . . . . 75.409999999999997 110.021 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.5 p -155.36 -57.67 0.1 Allowed 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 125.246 1.418 . . . . 72.430000000000007 108.395 -149.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 64.06 15.92 9.59 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.334 1.454 . . . . 75.400000000000006 114.069 171.14 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -84.98 80.01 9.44 Favored 'General case' 0 C--O 1.237 0.407 0 O-C-N 120.501 -1.374 . . . . 73.430000000000007 108.891 168.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 50.71 -168.15 0.03 OUTLIER 'General case' 0 C--O 1.236 0.386 0 C-N-CA 128.11 2.564 . . . . 75.230000000000004 112.042 -175.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -176.49 -164.93 0.12 Allowed 'General case' 0 C--O 1.238 0.482 0 C-N-CA 129.232 3.013 . . . . 60.299999999999997 107.228 159.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 43.9 mtm180 -110.19 -172.28 2.0 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 127.023 2.129 . . . . 73.409999999999997 110.788 -166.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -137.78 -66.67 0.5 Allowed 'General case' 0 CA--C 1.523 -0.079 0 O-C-N 120.933 -1.104 . . . . 73.530000000000001 110.865 178.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 35.5 mtp180 -83.63 -27.69 28.97 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.858 0.361 . . . . 74.519999999999996 111.398 -160.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.99 34.67 0.36 Allowed 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 125.379 1.472 . . . . 74.140000000000001 112.372 -169.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -69.82 10.14 0.43 Allowed 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.882 1.068 . . . . 74.099999999999994 113.882 173.461 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -50.1 109.26 0.28 Allowed 'General case' 0 C--O 1.238 0.451 0 C-N-CA 126.635 1.974 . . . . 74.200000000000003 109.708 175.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 48.43 33.58 4.06 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 126.969 2.108 . . . . 75.319999999999993 113.759 -175.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.427 ' HZ1' ' CG ' ' A' ' 18' ' ' ASP . 26.2 mttt -114.4 -10.3 12.65 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.346 1.059 . . . . 71.230000000000004 113.175 174.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -66.15 -21.51 66.34 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 119.311 0.959 . . . . 75.530000000000001 112.863 -171.222 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -122.67 72.55 1.08 Allowed 'General case' 0 C--O 1.232 0.155 0 N-CA-C 107.261 -1.385 . . . . 63.310000000000002 107.261 162.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -164.44 -46.98 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.031 0.932 . . . . 74.219999999999999 110.48 173.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.427 ' CG ' ' HZ1' ' A' ' 14' ' ' LYS . 0.4 OUTLIER -100.58 161.27 13.71 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 121.52 -0.737 . . . . 64.530000000000001 111.488 -167.933 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -93.8 -38.67 11.14 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.199 0.999 . . . . 74.200000000000003 109.576 162.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -44.76 -62.14 1.32 Allowed 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.295 1.438 . . . . 73.540000000000006 111.041 -175.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 13.4 mt -84.31 -29.5 26.32 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 125.38 1.472 . . . . 61.109999999999999 110.735 -172.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 51.4 t30 -69.55 -21.45 63.63 Favored 'General case' 0 C--O 1.216 -0.689 0 CA-C-O 117.88 -1.057 . . . . 73.540000000000006 111.837 176.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -48.2 -55.24 10.94 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 120.214 1.37 . . . . 74.519999999999996 111.174 -170.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.5 pttm -56.44 -53.3 59.04 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 121.131 -0.981 . . . . 75.319999999999993 111.242 173.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.84 -11.51 27.92 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.306 1.042 . . . . 75.200000000000003 113.684 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -87.84 -14.45 39.47 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 120.545 -1.347 . . . . 75.540000000000006 110.469 176.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -153.81 92.12 1.53 Allowed 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.355 1.062 . . . . 72.400000000000006 110.416 178.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.62 -17.51 9.26 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-O 118.389 -0.815 . . . . 64.310000000000002 111.903 169.16 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.74 -35.79 33.27 Favored 'General case' 0 C--N 1.342 0.257 0 CA-C-N 119.974 1.261 . . . . 75.140000000000001 113.344 -173.495 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -83.53 -22.02 32.54 Favored 'General case' 0 C--O 1.223 -0.309 0 CA-C-O 118.028 -0.987 . . . . 75.540000000000006 113.629 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.02 -54.76 29.28 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 120.541 1.518 . . . . 73.239999999999995 109.778 166.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.0 mp -68.73 -24.77 64.51 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.596 0.758 . . . . 73.510000000000005 110.443 -167.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 mt -46.14 -38.51 8.28 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.664 1.185 . . . . 74.319999999999993 111.569 167.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -69.54 -40.17 78.46 Favored Glycine 0 C--N 1.34 0.774 0 O-C-N 121.419 -0.8 . . . . 73.129999999999995 112.465 177.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -64.2 -30.02 71.1 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 118.537 1.168 . . . . 74.420000000000002 111.667 -177.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 20.5 t90 -61.51 -77.24 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 108.421 -0.955 . . . . 75.099999999999994 108.421 166.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.72 -30.76 63.84 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.015 1.326 . . . . 75.209999999999994 113.867 -166.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.39 -54.99 24.77 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 123.943 0.897 . . . . 75.430000000000007 109.743 171.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -55.1 -45.45 81.94 Favored Glycine 0 CA--C 1.522 0.476 0 C-N-CA 124.195 0.902 . . . . 52.119999999999997 111.746 -178.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 9.0 mp -54.68 -41.89 70.75 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 125.695 1.598 . . . . 72.329999999999998 110.937 177.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 51.5 mt -87.87 6.03 37.49 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 126.303 1.841 . . . . 75.540000000000006 112.177 -178.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 73.51 15.47 79.14 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-O 119.108 -0.829 . . . . 50.009999999999998 112.83 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 52.2 mttt -89.07 127.3 35.69 Favored 'General case' 0 CA--C 1.519 -0.231 0 N-CA-C 106.443 -1.688 . . . . 72.239999999999995 106.443 174.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.3 p -141.28 169.72 17.08 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.684 -0.858 . . . . 74.400000000000006 108.684 177.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 55.94 -130.2 48.53 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 110.23 -1.148 . . . . 75.530000000000001 110.23 179.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.88 -29.16 66.3 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 112.174 0.435 . . . . 74.319999999999993 112.174 -174.355 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.62 -33.38 75.79 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 121.234 -0.916 . . . . 74.329999999999998 110.031 177.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.36 -40.44 62.13 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.488 0.715 . . . . 75.540000000000006 109.718 177.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.0 ptp180 -67.23 -44.24 79.98 Favored 'General case' 0 C--O 1.227 -0.124 0 N-CA-C 109.765 -0.458 . . . . 72.510000000000005 109.765 -178.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.59 -43.79 84.89 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 125.983 1.713 . . . . 75.510000000000005 110.131 176.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -60.85 -47.95 84.04 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 122.78 0.432 . . . . 74.530000000000001 111.299 173.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.46 -16.14 44.22 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.352 -0.842 . . . . 75.430000000000007 112.932 -176.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 50.1 mt -61.87 -11.37 12.55 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 119.462 1.028 . . . . 75.519999999999996 113.732 178.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 8.9 t -132.52 -3.17 3.37 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 120.351 1.432 . . . . 75.329999999999998 112.831 -172.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 6.0 p -80.05 11.45 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.932 0 O-C-N 120.668 -1.27 . . . . 71.340000000000003 113.107 -171.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 2.1 p -115.8 120.7 65.56 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.173 0 O-C-N 120.666 -1.271 . . . . 74.400000000000006 110.605 -164.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 5.9 t -161.98 -178.35 6.38 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 130.372 3.469 . . . . 63.140000000000001 105.615 -176.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.5 m -161.67 112.06 1.63 Allowed 'General case' 0 CA--C 1.532 0.278 0 O-C-N 120.244 -1.535 . . . . 72.530000000000001 110.384 170.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -155.8 126.35 6.8 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 104.318 -2.475 . . . . 75.239999999999995 104.318 168.366 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -164.61 -171.92 2.49 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 119.972 1.26 . . . . 75.239999999999995 108.346 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 4.3 t70 75.85 32.77 0.64 Allowed 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 127.272 2.229 . . . . 75.519999999999996 110.23 -178.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . 0.279 17.3 pt-20 46.19 71.7 1.48 Allowed Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 129.623 3.169 . . . . 75.540000000000006 111.353 -171.381 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -90.74 -2.3 5.02 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 124.068 3.179 . . . . 75.120000000000005 113.878 -171.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -178.01 -93.92 0.09 OUTLIER Glycine 0 C--N 1.335 0.498 0 CA-C-N 119.641 1.11 . . . . 55.219999999999999 110.483 -178.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -128.95 -78.24 0.56 Allowed 'General case' 0 N--CA 1.457 -0.122 0 N-CA-C 105.996 -1.853 . . . . 73.230000000000004 105.996 -166.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.4 pt-20 -156.68 144.6 19.4 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 127.802 2.441 . . . . 71.219999999999999 107.508 170.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -148.67 -71.39 0.2 Allowed 'General case' 0 C--O 1.233 0.192 0 O-C-N 121.156 -0.965 . . . . 62.409999999999997 110.848 -173.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 54.9 t -83.51 -35.82 11.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 109.05 -0.722 . . . . 73.140000000000001 109.05 177.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -58.85 -44.62 91.02 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-O 117.958 -1.02 . . . . 75.230000000000004 109.308 169.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.409 ' CZ ' ' HE3' ' A' ' 71' ' ' LYS . 34.2 ttp85 -45.68 -58.47 3.42 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.684 0.794 . . . . 75.519999999999996 111.57 -177.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.409 ' HE3' ' CZ ' ' A' ' 70' ' ' ARG . 1.0 OUTLIER -69.83 -40.1 76.07 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 118.38 -0.819 . . . . 75.239999999999995 111.44 -175.831 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 38.6 mt -64.88 -48.06 75.62 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-N 119.2 0.909 . . . . 72.109999999999999 110.695 -179.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.73 -28.71 67.06 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 124.961 1.304 . . . . 74.540000000000006 111.816 -179.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.99 -47.88 67.31 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 118.899 0.772 . . . . 62.210000000000001 110.659 172.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.55 -55.26 18.74 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 107.738 -1.208 . . . . 71.299999999999997 107.738 -178.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 87.0 mt -87.18 34.57 0.69 Allowed 'General case' 0 C--O 1.233 0.222 0 C-N-CA 127.416 2.286 . . . . 74.239999999999995 111.907 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -53.24 115.37 1.86 Allowed 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 107.251 -1.388 . . . . 75.319999999999993 107.251 171.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 87.37 4.24 80.87 Favored Glycine 0 CA--C 1.532 1.102 0 C-N-CA 124.929 1.252 . . . . 60.509999999999998 114.163 176.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 28.9 mtmm -133.64 5.34 3.68 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 125.134 1.374 . . . . 73.519999999999996 112.416 -174.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -144.62 177.73 8.48 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.052 1.341 . . . . 74.230000000000004 108.91 170.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -143.51 164.74 29.5 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 126.754 2.022 . . . . 75.400000000000006 107.319 177.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -58.93 -54.81 42.95 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 124.085 0.954 . . . . 71.540000000000006 110.666 176.264 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -71.96 -11.77 60.93 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 122.978 0.511 . . . . 74.140000000000001 111.943 -178.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 54.3 m -84.09 -52.07 6.58 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 108.498 -0.927 . . . . 72.239999999999995 108.498 174.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 71.8 mt -55.77 -46.65 79.86 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 120.23 1.377 . . . . 75.420000000000002 109.068 178.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.46 -28.92 60.95 Favored 'General case' 0 C--N 1.344 0.347 0 N-CA-C 112.55 0.574 . . . . 75.150000000000006 112.55 -177.527 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.3 -44.47 12.83 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 124.121 0.969 . . . . 73.310000000000002 109.952 176.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 6.3 tptt -66.59 -48.82 68.36 Favored 'General case' 0 CA--C 1.521 -0.149 0 C-N-CA 125.98 1.712 . . . . 74.340000000000003 111.738 -166.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.44 -29.02 69.66 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.13 0.877 . . . . 72.430000000000007 111.183 -178.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 57.1 t -72.92 -31.12 34.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 123.805 0.842 . . . . 73.230000000000004 110.562 174.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.06 -53.75 54.08 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 126.981 2.112 . . . . 72.109999999999999 112.946 -162.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -67.24 22.82 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 127.988 2.515 . . . . 63.509999999999998 113.88 -171.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 6.7 ppt_? -65.3 -25.68 67.73 Favored 'General case' 0 N--CA 1.466 0.368 0 O-C-N 120.139 -1.601 . . . . 74.430000000000007 113.58 -169.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.85 -47.19 9.25 Favored 'General case' 0 C--N 1.332 -0.172 0 O-C-N 121.026 -1.047 . . . . 74.109999999999999 109.044 178.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.8 m -55.14 -29.66 58.22 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.79 1.236 . . . . 65.400000000000006 110.891 175.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -56.59 -45.54 81.34 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.826 1.25 . . . . 63.420000000000002 112.49 173.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 26.1 ttt-85 -63.36 -51.83 64.29 Favored 'General case' 0 CA--C 1.517 -0.292 0 O-C-N 120.828 -1.17 . . . . 74.519999999999996 108.663 175.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.62 -55.41 32.38 Favored 'General case' 0 N--CA 1.444 -0.754 0 O-C-N 125.022 1.451 . . . . 74.319999999999993 110.669 -168.478 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -57.51 -42.28 82.5 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-O 118.732 -0.652 . . . . 74.430000000000007 112.427 -174.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 39.4 mm -64.25 -39.75 86.62 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-N 119.903 1.229 . . . . 75.129999999999995 110.541 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 61.8 mt -71.37 -11.74 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 O-C-N 121.5 -0.75 . . . . 74.230000000000004 109.355 178.173 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.16 4.91 34.57 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.26 1.424 . . . . 74.200000000000003 111.579 176.009 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 80.5 mt-10 -124.52 29.18 6.37 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 125.198 1.399 . . . . 75.430000000000007 108.791 -174.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.6 mm . . . . . 0 C--O 1.251 1.163 0 N-CA-C 105.54 -2.022 . . . . 74.239999999999995 105.54 169.532 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.4 ptt? . . . . . 0 N--CA 1.476 0.872 0 CA-C-O 118.894 -0.574 . . . . 73.430000000000007 109.727 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.6 m 60.97 68.02 0.77 Allowed 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.151 1.38 . . . . 71.530000000000001 109.442 174.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 12.5 t -144.68 144.57 31.29 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 106.313 -1.736 . . . . 74.549999999999997 106.313 173.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 18.6 p90 -80.3 176.08 10.08 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.101 -1.074 . . . . 70.530000000000001 108.101 152.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.9 t0 174.67 -55.21 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 129.237 3.015 . . . . 74.340000000000003 104.743 171.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -60.28 -51.99 67.19 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 128.599 2.759 . . . . 70.540000000000006 112.588 173.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.9 ptp180 -83.73 126.99 33.46 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.035 -1.098 . . . . 74.340000000000003 108.035 -171.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -89.03 178.78 6.31 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 124.667 1.187 . . . . 71.150000000000006 108.939 175.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 23.2 mtm105 -61.9 169.35 2.63 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 122.446 1.117 . . . . 74.239999999999995 111.023 171.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -91.51 18.15 7.71 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.904 -1.044 . . . . 72.129999999999995 113.393 -166.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . 0.32 0.1 OUTLIER 43.82 16.61 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 130.846 3.659 . . . . 73.510000000000005 113.467 -168.005 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.9 114.1 14.14 Favored 'General case' 0 N--CA 1.444 -0.759 0 O-C-N 119.751 -1.843 . . . . 73.129999999999995 108.061 -171.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 60.81 31.67 20.07 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.896 2.078 . . . . 70.310000000000002 114.862 -174.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -100.11 -25.33 14.32 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 115.429 1.64 . . . . 74.129999999999995 115.429 -177.392 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -74.99 0.32 16.25 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 114.705 1.372 . . . . 74.549999999999997 114.705 -166.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -113.11 25.47 11.34 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.577 1.081 . . . . 65.510000000000005 110.085 173.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -151.38 174.65 13.09 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 124.925 1.29 . . . . 74.439999999999998 108.656 -179.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 60.85 -160.11 0.31 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.635 1.174 . . . . 74.319999999999993 108.852 171.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -137.11 -35.81 0.68 Allowed 'General case' 0 C--N 1.332 -0.173 0 O-C-N 120.375 -1.453 . . . . 74.439999999999998 111.237 161.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -47.83 -54.44 12.45 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.245 1.018 . . . . 74.430000000000007 112.712 -170.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.4 mt -77.74 -29.91 51.33 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.852 -0.53 . . . . 62.409999999999997 111.739 -172.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -63.52 -49.48 73.34 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 108.974 -0.75 . . . . 74.340000000000003 108.974 174.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -55.7 -39.5 71.12 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.949 0.899 . . . . 72.430000000000007 110.934 -178.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -44.8 -48.36 10.95 Favored 'General case' 0 C--N 1.344 0.336 0 C-N-CA 124.281 1.032 . . . . 61.229999999999997 111.777 173.664 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.72 -49.15 71.99 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.565 1.146 . . . . 74.129999999999995 111.441 -178.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -71.0 -18.09 62.61 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 121.975 -0.453 . . . . 71.510000000000005 110.982 -176.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -113.37 55.06 0.72 Allowed 'General case' 0 C--O 1.237 0.41 0 C-N-CA 125.265 1.426 . . . . 74.200000000000003 109.025 -176.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.4 mmt-85 -121.97 -7.66 8.91 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 126.048 1.739 . . . . 71.409999999999997 112.261 172.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 36.8 mtm-85 -53.38 -53.85 45.24 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 119.599 1.091 . . . . 73.140000000000001 112.192 -168.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -82.34 -15.23 53.6 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.501 -0.75 . . . . 74.430000000000007 112.604 -167.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.83 -14.21 59.65 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 119.033 0.833 . . . . 74.430000000000007 112.808 -169.013 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -127.83 3.65 6.02 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.973 2.109 . . . . 71.430000000000007 112.027 -171.334 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 56.7 tp -56.41 -30.13 62.41 Favored 'General case' 0 N--CA 1.461 0.1 0 C-N-CA 128.607 2.763 . . . . 74.5 111.807 174.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -45.8 -46.81 13.81 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 124.791 1.186 . . . . 71.430000000000007 113.016 170.154 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -63.0 -22.49 66.89 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.768 1.227 . . . . 71.230000000000004 111.938 -172.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 5.8 t90 -64.07 -72.66 0.14 Allowed 'General case' 0 C--N 1.343 0.307 0 N-CA-C 107.913 -1.143 . . . . 74.219999999999999 107.913 168.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.93 -29.2 62.89 Favored 'General case' 0 C--O 1.221 -0.441 0 C-N-CA 126.314 1.846 . . . . 61.310000000000002 112.193 -171.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -47.36 -49.27 24.86 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.987 0.812 . . . . 70.439999999999998 111.52 -179.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.46 -35.9 91.75 Favored Glycine 0 CA--C 1.534 1.242 0 CA-C-N 118.352 0.523 . . . . 62.219999999999999 112.869 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.2 mp -64.98 -39.29 93.26 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.649 1.58 . . . . 71.430000000000007 109.339 178.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.9 mp -73.04 -9.68 58.98 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 127.324 2.25 . . . . 71.219999999999999 112.977 172.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 71.44 29.7 67.76 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 125.806 1.67 . . . . 75.209999999999994 112.188 -176.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -111.22 139.06 46.91 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 119.551 1.676 . . . . 73.219999999999999 107.228 170.746 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.1 p -135.73 175.87 9.2 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 107.254 -1.387 . . . . 75.319999999999993 107.254 168.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 60.48 -126.74 41.99 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.487 -1.045 . . . . 72.430000000000007 110.487 173.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -78.29 -34.69 48.65 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 123.974 0.91 . . . . 75.409999999999997 110.512 -170.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.79 -35.2 79.82 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.773 0.829 . . . . 74.129999999999995 109.621 173.309 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.32 -42.06 69.08 Favored 'General case' 0 C--N 1.339 0.109 0 O-C-N 121.961 -0.462 . . . . 64.510000000000005 111.15 170.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.0 ttm180 -55.79 -47.43 77.12 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.436 0.694 . . . . 65.400000000000006 111.603 -176.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.76 -50.6 73.19 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.357 0.526 . . . . 73.129999999999995 110.203 -178.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -53.31 -42.78 67.0 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.693 1.197 . . . . 72.329999999999998 111.477 173.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.25 -24.62 65.03 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 124.071 0.948 . . . . 72.319999999999993 113.519 -178.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 43.9 mt -84.68 -14.8 47.42 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 118.05 -0.976 . . . . 74.219999999999999 111.977 -171.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 11.7 t -102.77 -28.14 12.27 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 119.989 1.268 . . . . 74.120000000000005 112.273 -173.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 1.6 p -72.43 96.57 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.325 0 C-N-CA 127.31 2.244 . . . . 73.430000000000007 109.892 172.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 11.0 p -148.97 152.42 12.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 C-N-CA 125.421 1.488 . . . . 73.510000000000005 108.701 152.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -149.24 -85.91 0.09 Allowed 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 118.219 -0.896 . . . . 74.140000000000001 108.826 155.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.9 t -153.26 -86.42 0.06 Allowed 'General case' 0 C--O 1.226 -0.133 0 CA-C-N 120.012 1.278 . . . . 65.120000000000005 108.367 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -179.81 176.45 0.76 Allowed 'General case' 0 C--O 1.238 0.469 0 N-CA-C 107.405 -1.332 . . . . 70.209999999999994 107.405 -166.492 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.407 ' CZ ' ' HA ' ' A' ' 86' ' ' ARG . 0.1 OUTLIER -103.23 77.46 1.53 Allowed 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 127.09 2.156 . . . . 72.099999999999994 109.102 176.816 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.78 -32.27 70.66 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 119.267 -0.973 . . . . 65.200000000000003 109.995 -179.355 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -148.91 165.1 18.61 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 125.566 1.546 . . . . 65.219999999999999 109.102 173.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_endo -71.23 173.01 12.9 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.778 2.985 . . . . 70.230000000000004 112.1 176.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -168.69 -109.62 0.22 Allowed Glycine 0 CA--C 1.524 0.616 0 CA-C-O 119.216 -0.769 . . . . 71.340000000000003 111.694 -178.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -164.87 88.73 0.47 Allowed 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 126.863 2.065 . . . . 63.329999999999998 105.766 175.186 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 54.23 86.69 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.799 2.04 . . . . 73.129999999999995 112.462 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -121.09 -86.31 0.65 Allowed 'General case' 0 N--CA 1.48 1.051 0 CA-C-O 117.886 -1.054 . . . . 74.230000000000004 111.125 179.239 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 14.1 p -63.06 -32.46 56.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 121.115 1.779 . . . . 74.430000000000007 110.646 178.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -78.1 -18.12 56.08 Favored 'General case' 0 C--O 1.221 -0.408 0 N-CA-C 116.084 1.883 . . . . 70.230000000000004 116.084 176.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 22.1 ttt180 -55.36 -57.37 12.14 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 122.375 2.352 . . . . 72.109999999999999 114.286 -169.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -74.57 3.33 7.9 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 122.989 0.516 . . . . 65.540000000000006 111.559 -174.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 18.1 tp -112.78 -63.94 1.37 Allowed 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 127.872 2.469 . . . . 74.510000000000005 108.465 -174.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -51.29 -40.37 58.81 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 127.02 2.128 . . . . 73.129999999999995 111.418 177.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -76.27 -27.01 56.5 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 112.87 0.692 . . . . 74.400000000000006 112.87 -179.203 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.55 -9.22 59.5 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.693 0.797 . . . . 72.430000000000007 110.492 172.252 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 69.0 mt -116.48 34.99 4.75 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 128.723 2.809 . . . . 73.319999999999993 110.916 177.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -54.55 110.93 0.7 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.157 1.383 . . . . 54.030000000000001 108.618 176.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 86.2 2.64 85.51 Favored Glycine 0 CA--C 1.529 0.956 0 C-N-CA 125.439 1.495 . . . . 43.119999999999997 114.957 -179.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -127.24 1.25 6.41 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 118.871 1.336 . . . . 74.329999999999998 112.193 -165.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -147.64 -172.85 4.13 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.733 1.213 . . . . 72.219999999999999 109.498 172.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -146.84 170.38 17.16 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 126.976 2.11 . . . . 73.109999999999999 105.799 165.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -55.13 -47.55 74.89 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.227 1.011 . . . . 61.210000000000001 110.356 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -82.88 -24.21 33.28 Favored 'General case' 0 CA--C 1.534 0.354 0 O-C-N 121.333 -0.854 . . . . 70.510000000000005 111.339 -177.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 79.5 m -64.29 -39.13 93.3 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 120.737 -1.227 . . . . 72.319999999999993 108.909 172.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 96.8 mt -61.15 -50.33 80.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 O-C-N 121.116 -0.99 . . . . 72.120000000000005 109.345 173.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.407 ' HA ' ' CZ ' ' A' ' 60' ' ' PHE . 0.0 OUTLIER -64.53 -32.26 73.83 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 118.966 -1.094 . . . . 71.120000000000005 111.087 -174.985 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.09 -53.05 60.87 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 109.203 -0.666 . . . . 73.519999999999996 109.203 172.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.66 -44.88 95.94 Favored 'General case' 0 N--CA 1.463 0.178 0 O-C-N 120.956 -1.09 . . . . 74.140000000000001 113.366 -173.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 59.7 mtt -59.92 -20.97 60.36 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 118.662 0.665 . . . . 71.430000000000007 111.828 178.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 66.4 t -98.3 -25.51 4.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 125.028 1.331 . . . . 74.439999999999998 110.542 -176.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -60.19 -54.03 50.63 Favored 'General case' 0 N--CA 1.463 0.201 0 O-C-N 120.75 -1.219 . . . . 74.299999999999997 108.56 173.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 4.0 pp -73.97 7.01 2.88 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.45 1.1 . . . . 73.420000000000002 112.85 -178.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 21.5 ttt-85 -56.24 -50.46 71.24 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 120.011 -1.681 . . . . 73.420000000000002 112.692 -176.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.34 -31.91 72.98 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 119.409 1.004 . . . . 73.5 112.388 -178.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 73.7 m -47.42 -36.64 10.15 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.284 1.434 . . . . 64.519999999999996 110.147 178.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -53.94 -46.65 71.61 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 124.983 1.313 . . . . 71.310000000000002 113.192 -175.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.6 ptt-85 -82.72 -34.78 27.15 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 120.541 -0.464 . . . . 65.329999999999998 111.364 178.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -59.29 -41.24 88.5 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.242 1.017 . . . . 71.219999999999999 109.634 -179.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 60.8 mm-40 -50.18 -49.92 50.91 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 126.463 1.905 . . . . 74.099999999999994 112.645 174.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 21.6 mm -59.61 -48.31 87.85 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-N 118.925 0.784 . . . . 74.099999999999994 109.047 178.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 97.7 mt -68.38 -5.16 4.01 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 C-N-CA 126.846 2.058 . . . . 72.540000000000006 110.888 -178.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -103.74 -17.86 14.92 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 125.419 1.488 . . . . 73.099999999999994 111.381 175.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -132.55 46.0 2.68 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 125.026 1.331 . . . . 70.400000000000006 109.324 -168.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 24.5 mt . . . . . 0 C--O 1.249 1.027 0 C-N-CA 130.277 3.431 . . . . 73.400000000000006 108.197 -176.455 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.7 ptt? . . . . . 0 N--CA 1.473 0.683 0 CA-C-O 118.784 -0.627 . . . . 71.519999999999996 112.447 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.2 t -91.66 -30.14 16.49 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.669 1.122 . . . . 75.129999999999995 109.778 -163.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.7 p -88.29 111.41 21.67 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 126.846 2.058 . . . . 74.299999999999997 107.676 174.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 35.5 p90 -147.05 176.68 9.75 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.229 1.012 . . . . 72.219999999999999 109.647 176.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -135.58 174.8 10.21 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 123.891 0.876 . . . . 73.129999999999995 109.404 175.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -124.08 -36.72 2.65 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 126.252 1.821 . . . . 74.540000000000006 110.806 -174.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 18.1 ptt180 -88.93 37.01 0.82 Allowed 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.994 1.27 . . . . 74.420000000000002 110.465 -179.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -118.91 -15.85 9.3 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.245 1.418 . . . . 74.430000000000007 112.752 -169.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 44.6 mtm180 -94.67 163.59 13.31 Favored 'General case' 0 N--CA 1.464 0.268 0 O-C-N 120.378 -1.451 . . . . 74.329999999999998 109.244 156.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -160.41 71.05 0.43 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.406 1.483 . . . . 72.439999999999998 108.705 178.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -74.42 10.0 1.49 Allowed 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 115.719 1.748 . . . . 73.209999999999994 115.719 -172.051 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -45.0 -42.75 8.56 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 115.921 1.823 . . . . 72.239999999999995 115.921 -162.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -129.12 -1.16 5.17 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.969 1.308 . . . . 62.43 112.096 169.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.1 mtpt -63.57 -19.97 65.26 Favored 'General case' 0 C--O 1.223 -0.295 0 O-C-N 121.016 -1.052 . . . . 71.099999999999994 113.634 -171.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -49.22 -33.24 12.18 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 127.415 2.286 . . . . 73.299999999999997 114.559 -173.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.59 -20.67 63.63 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.154 0.582 . . . . 74.5 112.287 -178.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -113.98 -169.18 1.47 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 129.95 3.3 . . . . 74.299999999999997 105.915 178.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 57.94 -169.99 0.11 Allowed 'General case' 0 C--O 1.239 0.515 0 C-N-CA 124.516 1.126 . . . . 73.319999999999993 110.644 177.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -143.34 -48.06 0.3 Allowed 'General case' 0 C--N 1.333 -0.146 0 O-C-N 120.4 -1.437 . . . . 72.439999999999998 110.71 171.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 64.3 tt0 -60.55 -32.24 71.31 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.079 0.552 . . . . 72.140000000000001 110.937 -171.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 72.3 mt -71.81 -41.2 68.53 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.225 -0.922 . . . . 73.409999999999997 110.491 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -63.57 -42.72 98.29 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.3 1.04 . . . . 72.120000000000005 110.514 173.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -54.53 -41.55 69.83 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.001 0.92 . . . . 75.400000000000006 109.884 174.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.36 -16.66 6.01 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 117.267 -1.349 . . . . 72.400000000000006 114.1 175.452 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -97.01 -32.01 12.22 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 121.145 1.793 . . . . 72.140000000000001 113.642 173.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.0 tp10 -46.1 -43.09 14.5 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.805 1.642 . . . . 70.099999999999994 112.035 -176.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -91.42 26.3 2.31 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.046 1.338 . . . . 61.399999999999999 112.277 -167.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 2.8 mmt180 -112.23 2.73 16.75 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 120.569 -1.332 . . . . 73.430000000000007 111.924 177.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 19.3 mtt-85 -63.53 -23.92 67.59 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.332 1.423 . . . . 73.540000000000006 112.295 -175.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.422 ' C ' ' H ' ' A' ' 32' ' ' LEU . 4.0 m120 -135.11 -16.17 1.92 Allowed 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 117.067 -1.444 . . . . 74.200000000000003 114.559 173.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.07 6.88 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 128.112 2.565 . . . . 72.540000000000006 114.578 -173.117 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.422 ' H ' ' C ' ' A' ' 30' ' ' ASN . 0.3 OUTLIER -137.35 -1.7 2.08 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 127.456 2.302 . . . . 71.200000000000003 110.693 -166.956 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 52.3 tp -66.8 -30.75 71.03 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 127.104 2.162 . . . . 72.230000000000004 110.824 170.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -65.69 -43.8 93.62 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.924 -0.87 . . . . 62.5 110.924 170.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -65.08 -23.85 67.28 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 118.376 1.088 . . . . 71.519999999999996 111.996 -173.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 22.5 t90 -60.15 -69.28 0.22 Allowed 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 124.415 1.086 . . . . 74.230000000000004 108.97 168.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.0 -40.45 80.75 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 122.954 0.502 . . . . 72.409999999999997 111.699 -177.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.26 -54.72 27.7 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.669 1.187 . . . . 73.219999999999999 109.908 173.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -64.08 -36.44 93.25 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-N 117.866 0.303 . . . . 31.210000000000001 112.389 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 38.2 mt -62.63 -38.98 92.37 Favored 'General case' 0 C--O 1.233 0.225 0 O-C-N 120.766 -1.432 . . . . 74.299999999999997 110.696 176.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 92.5 mt -88.16 6.87 34.51 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 126.951 2.1 . . . . 63.140000000000001 113.282 -178.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 81.82 12.95 80.63 Favored Glycine 0 CA--C 1.531 1.093 0 CA-C-N 119.839 1.2 . . . . 72.099999999999994 113.996 171.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -90.83 149.47 21.95 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 126.026 1.73 . . . . 74.140000000000001 109.888 172.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.0 p -148.72 175.71 10.98 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 126.863 2.065 . . . . 71.5 110.054 178.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 58.08 -135.51 51.74 Favored Glycine 0 CA--C 1.525 0.667 0 C-N-CA 124.322 0.963 . . . . 71.099999999999994 111.72 172.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -51.62 -46.41 63.62 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.934 1.294 . . . . 73.340000000000003 111.163 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.8 -38.35 87.78 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.325 -0.852 . . . . 72.540000000000006 110.385 -173.647 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.0 -45.09 52.05 Favored 'General case' 0 N--CA 1.455 -0.22 0 O-C-N 121.887 -0.508 . . . . 63.439999999999998 111.075 171.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 52.0 mtm-85 -59.07 -55.23 37.69 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 118.058 -0.972 . . . . 73.430000000000007 112.633 -172.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.18 -34.39 77.92 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 118.331 -0.842 . . . . 53.340000000000003 110.196 -172.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -61.82 -45.47 93.69 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-O 121.835 0.826 . . . . 74.430000000000007 109.858 173.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.18 -26.61 68.44 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 120.563 -1.336 . . . . 74.5 113.277 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 41.3 mt -84.22 -12.82 54.16 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.757 1.223 . . . . 75.319999999999993 111.158 177.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 40.9 p -105.27 3.37 29.91 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 119.609 1.095 . . . . 75.400000000000006 111.699 175.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.2 t -118.1 98.68 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 C-N-CA 126.039 1.736 . . . . 72.239999999999995 108.191 -173.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 1.9 t -129.65 66.66 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 N-CA-C 107.658 -1.238 . . . . 74.230000000000004 107.658 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.278 6.6 t 51.28 -164.67 0.05 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.199 1.8 . . . . 74.430000000000007 111.425 -178.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -165.38 -154.31 0.21 Allowed 'General case' 0 C--O 1.239 0.532 0 C-N-CA 129.253 3.021 . . . . 74.230000000000004 103.411 156.682 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -84.18 -176.82 6.44 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 120.518 1.508 . . . . 42.420000000000002 113.05 177.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -145.6 -13.17 0.5 Allowed 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 127.167 2.187 . . . . 74.530000000000001 110.903 175.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -68.62 -168.18 0.11 Allowed 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 119.586 1.084 . . . . 75.230000000000004 110.011 165.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 46.98 72.78 1.15 Allowed Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 126.296 1.838 . . . . 74.140000000000001 112.423 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -74.61 158.71 43.47 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 124.991 3.794 . . . . 73.129999999999995 111.987 -172.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.04 -5.35 78.7 Favored Glycine 0 CA--C 1.532 1.118 0 C-N-CA 124.491 1.043 . . . . 64.239999999999995 112.601 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -121.09 57.08 1.0 Allowed 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 126.99 2.116 . . . . 75.409999999999997 106.821 -165.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -44.53 102.12 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 130.715 3.606 . . . . 62.149999999999999 109.397 178.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -128.2 -83.6 0.59 Allowed 'General case' 0 N--CA 1.467 0.38 0 O-C-N 121.61 -0.681 . . . . 61.43 110.362 170.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 7.1 p -61.74 -45.7 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 CA-C-N 119.091 0.859 . . . . 73.450000000000003 110.276 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.91 -23.05 67.11 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 115.037 1.495 . . . . 75.409999999999997 115.037 170.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 75.7 ttt-85 -63.12 -54.29 40.2 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 121.172 1.806 . . . . 70.430000000000007 110.604 -178.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -71.74 9.35 0.9 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.995 0.918 . . . . 72.319999999999993 111.567 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 69.0 mt -132.86 -5.07 3.16 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 124.794 1.238 . . . . 73.430000000000007 114.185 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -100.75 -79.65 0.5 Allowed 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.86 1.264 . . . . 74.310000000000002 108.053 173.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.02 -45.73 91.82 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 118.422 0.556 . . . . 73.450000000000003 110.339 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.77 -29.51 66.85 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.078 0.551 . . . . 74.519999999999996 110.858 -175.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.4 tp -111.7 19.35 18.14 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 127.085 2.154 . . . . 73.219999999999999 111.213 -166.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -44.56 126.82 5.69 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 127.075 2.15 . . . . 65.430000000000007 111.635 -169.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 86.54 -12.21 61.7 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 126.231 1.872 . . . . 74.230000000000004 113.579 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 32.2 mtmm -117.31 10.63 13.76 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.689 1.195 . . . . 73.540000000000006 110.445 -175.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -147.03 175.03 11.0 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 126.39 1.876 . . . . 71.340000000000003 110.02 177.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -150.14 172.38 15.38 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 105.617 -1.994 . . . . 63.539999999999999 105.617 154.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -55.67 -52.03 65.25 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 124.672 1.189 . . . . 73.120000000000005 109.38 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -66.42 -29.98 70.25 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.821 0.848 . . . . 71.409999999999997 111.036 -178.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 99.0 m -70.19 -44.48 68.6 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 118.541 -0.742 . . . . 74.549999999999997 109.193 -179.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 69.7 mt -55.15 -46.48 77.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 CA-C-N 119.829 1.195 . . . . 74.540000000000006 109.616 -175.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.98 -47.97 76.7 Favored 'General case' 0 C--N 1.347 0.496 0 CA-C-O 121.595 0.712 . . . . 74.430000000000007 109.568 -179.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -88.01 29.38 0.94 Allowed 'General case' 0 N--CA 1.443 -0.808 0 C-N-CA 125.552 1.541 . . . . 74.140000000000001 111.025 -176.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.31 -48.51 2.88 Favored 'General case' 0 CA--C 1.513 -0.466 0 O-C-N 121.111 -0.993 . . . . 62.539999999999999 109.132 158.349 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 27.0 mtm -57.49 -42.64 83.09 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 117.771 0.26 . . . . 74.450000000000003 111.052 -176.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 27.1 t -79.81 -31.88 13.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 124.347 1.059 . . . . 74.329999999999998 111.957 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -62.18 -24.81 67.41 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.883 1.273 . . . . 71.549999999999997 112.604 -170.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 20.8 mt -86.84 -1.05 57.48 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 114.941 1.46 . . . . 73.420000000000002 114.941 -165.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 73.6 mtp180 -56.45 -50.01 72.94 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 120.306 -1.496 . . . . 71.510000000000005 112.844 -171.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.02 -20.39 59.64 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 120.031 1.287 . . . . 73.129999999999995 112.105 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.6 m -56.5 -25.35 51.12 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.064 0.847 . . . . 74.420000000000002 110.373 176.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.13 -51.34 69.71 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 114.556 1.317 . . . . 74.430000000000007 114.556 176.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -74.93 -38.22 61.83 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 108.994 -0.743 . . . . 72.420000000000002 108.994 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.2 -53.68 54.28 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 124.955 1.302 . . . . 73.140000000000001 109.454 -175.739 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -58.29 -44.58 88.55 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-O 118.839 -0.601 . . . . 74.219999999999999 112.529 -174.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 16.9 mm -65.2 -42.02 93.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 119.079 0.854 . . . . 73.200000000000003 109.003 -178.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 98.0 mt -69.74 -15.71 19.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 N-CA-C 109.479 -0.563 . . . . 74.310000000000002 109.479 177.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -85.78 -11.0 54.62 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 126.012 1.725 . . . . 62.310000000000002 111.225 174.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 66.6 mt-10 -129.77 42.03 3.34 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 128.177 2.591 . . . . 74.510000000000005 108.925 -166.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 92.7 mt . . . . . 0 C--O 1.255 1.372 0 N-CA-C 108.697 -0.853 . . . . 73.5 108.697 -177.145 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.9 tpt . . . . . 0 N--CA 1.465 0.3 0 N-CA-C 108.328 -0.99 . . . . 73.340000000000003 108.328 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 14.1 p -65.85 163.09 17.56 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.171 0.588 . . . . 74.519999999999996 110.136 175.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 13.4 t -148.86 162.42 39.88 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.473 -0.936 . . . . 73.140000000000001 108.473 170.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -91.05 163.6 14.25 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 107.656 -1.238 . . . . 71.540000000000006 107.656 170.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -70.71 156.1 39.91 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 109.047 -0.723 . . . . 62.420000000000002 109.047 172.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -133.45 158.04 44.09 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 125.278 1.431 . . . . 74.549999999999997 109.572 178.707 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 14.6 mmt180 -78.9 80.85 5.23 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 107.717 -1.216 . . . . 74.040000000000006 107.717 177.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -74.4 -46.5 39.88 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.564 -0.743 . . . . 74.239999999999995 111.338 -163.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.5 mpp_? -101.41 172.33 7.05 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.581 1.553 . . . . 73.239999999999995 110.357 173.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 62.39 45.87 6.24 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 127.311 2.244 . . . . 73.420000000000002 112.311 -171.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -58.44 -17.66 22.48 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.325 0.861 . . . . 71.049999999999997 113.325 164.453 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -46.38 -42.46 15.02 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 128.87 2.868 . . . . 73.219999999999999 112.75 -172.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.07 13.82 13.03 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.8 1.24 . . . . 71.109999999999999 111.329 178.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.409 ' HZ3' ' CG ' ' A' ' 18' ' ' ASP . 19.0 mttm -108.25 -13.24 14.94 Favored 'General case' 0 C--O 1.225 -0.199 0 C-N-CA 124.596 1.159 . . . . 72.129999999999995 112.398 176.227 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -64.35 -27.02 68.73 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 120.494 1.497 . . . . 74.030000000000001 110.86 170.288 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -86.94 26.24 1.18 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.698 1.599 . . . . 63.210000000000001 112.36 173.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -167.54 -167.94 0.96 Allowed 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 119.465 1.03 . . . . 74.030000000000001 109.965 -178.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.409 ' CG ' ' HZ3' ' A' ' 14' ' ' LYS . 1.5 m-20 57.8 -160.7 0.24 Allowed 'General case' 0 C--O 1.238 0.474 0 C-N-CA 125.765 1.626 . . . . 72.239999999999995 110.499 165.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -140.19 -32.86 0.59 Allowed 'General case' 0 C--O 1.219 -0.532 0 O-C-N 120.985 -1.072 . . . . 72.329999999999998 111.029 160.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -49.31 -41.66 38.99 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 125.274 1.43 . . . . 73.530000000000001 111.985 -168.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 67.9 mt -91.62 -37.28 13.17 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 119.048 -0.501 . . . . 75.120000000000005 110.785 -176.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 27.0 t30 -53.33 -45.18 68.97 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 119.106 0.867 . . . . 72.329999999999998 110.539 170.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -60.87 -39.77 90.45 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 125.801 1.641 . . . . 75.140000000000001 110.499 -178.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -45.78 -44.92 14.36 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 121.181 -0.949 . . . . 75.019999999999996 110.964 171.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -75.31 -62.19 1.65 Allowed 'General case' 0 C--O 1.235 0.312 0 C-N-CA 126.208 1.803 . . . . 74.329999999999998 112.915 177.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -61.51 -16.54 48.48 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.741 1.216 . . . . 71.420000000000002 111.713 -173.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -119.49 37.39 4.18 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.331 1.852 . . . . 75.319999999999993 111.366 -177.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.13 6.12 4.2 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 121.289 -0.882 . . . . 64.329999999999998 112.634 168.387 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.2 ptt85 -63.36 -19.05 64.31 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 120.566 -1.334 . . . . 75.129999999999995 113.27 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -78.72 -20.36 50.24 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 119.803 1.183 . . . . 75.120000000000005 112.142 175.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.49 -19.06 63.75 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 120.323 1.419 . . . . 75.230000000000004 112.65 -168.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.19 2.14 9.18 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.709 2.004 . . . . 74.030000000000001 111.684 -168.495 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.5 mt -60.96 -28.8 69.24 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.702 1.201 . . . . 64.430000000000007 111.336 171.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -61.24 -37.2 93.61 Favored Glycine 0 C--O 1.223 -0.533 0 N-CA-C 111.317 -0.713 . . . . 75.400000000000006 111.317 -178.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -62.28 -33.51 74.78 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.419 1.088 . . . . 72.400000000000006 110.227 -170.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 10.2 t90 -62.65 -65.09 0.74 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.689 1.596 . . . . 74.319999999999993 110.044 170.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.26 -21.09 66.69 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.412 0.685 . . . . 72.329999999999998 112.481 -171.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -70.77 -55.3 8.9 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 125.024 1.33 . . . . 72.019999999999996 109.257 168.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -49.26 -45.07 35.16 Favored Glycine 0 CA--C 1.527 0.842 0 C-N-CA 124.231 0.919 . . . . 54.5 112.042 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 16.1 mt -61.06 -32.74 72.37 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.496 1.118 . . . . 75.219999999999999 113.89 179.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 95.7 mt -85.66 -3.45 58.89 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.365 1.066 . . . . 73.030000000000001 112.446 176.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.11 19.69 56.87 Favored Glycine 0 CA--C 1.526 0.763 0 CA-C-O 118.424 -1.209 . . . . 74.120000000000005 113.374 -175.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 14.3 mmtp -101.53 119.18 38.37 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 125.81 1.644 . . . . 75.400000000000006 108.655 177.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.8 p -152.6 135.56 15.57 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.433 0.693 . . . . 75.340000000000003 110.827 -179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 87.59 -148.85 21.39 Favored Glycine 0 CA--C 1.533 1.2 0 N-CA-C 110.894 -0.883 . . . . 75.310000000000002 110.894 -164.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -63.96 -22.11 66.78 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.937 1.458 . . . . 73.019999999999996 114.937 -161.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.76 -51.29 23.44 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 108.253 -1.018 . . . . 74.230000000000004 108.253 175.31 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -56.51 -40.19 74.6 Favored 'General case' 0 C--N 1.344 0.334 0 O-C-N 121.69 -0.631 . . . . 73.230000000000004 109.886 171.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.02 -25.58 67.74 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.756 1.223 . . . . 75.319999999999993 113.002 179.623 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.05 -51.66 11.83 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 119.533 1.06 . . . . 75.030000000000001 109.663 169.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -60.15 -29.08 68.42 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.266 1.026 . . . . 64.349999999999994 112.822 -177.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.0 -18.97 49.92 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 120.461 -1.399 . . . . 55.420000000000002 112.513 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 22.0 mt -90.74 -15.38 30.33 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.126 0.97 . . . . 75.030000000000001 111.651 -168.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.8 t -95.92 -29.26 14.28 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.64 1.176 . . . . 63.340000000000003 111.411 -178.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 5.3 p -70.8 8.53 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 126.202 1.801 . . . . 73.420000000000002 114.374 -166.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 5.2 m -104.14 49.12 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 O-C-N 119.196 -2.19 . . . . 75.319999999999993 112.004 -163.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.4 t -58.74 -50.48 73.76 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 109.797 -0.446 . . . . 74.299999999999997 109.797 172.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.0 t 52.3 69.43 0.68 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.539 1.136 . . . . 74.310000000000002 108.784 -167.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.2 t0 -146.65 108.01 4.25 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 105.114 -2.18 . . . . 72.099999999999994 105.114 179.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -170.9 23.16 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.167 0.587 . . . . 75.019999999999996 111.902 -168.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -92.61 81.89 4.8 Favored 'General case' 0 N--CA 1.464 0.246 0 O-C-N 120.555 -1.341 . . . . 61.399999999999999 111.06 -170.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 56.33 61.26 7.53 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 124.827 1.251 . . . . 74.540000000000006 109.295 -169.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -80.59 178.92 6.51 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 124.279 3.32 . . . . 72.010000000000005 113.448 -161.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.16 -171.44 7.55 Favored Glycine 0 CA--C 1.534 1.265 0 C-N-CA 125.141 1.353 . . . . 65.120000000000005 113.691 177.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -85.69 2.37 45.6 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 127.232 2.213 . . . . 72.409999999999997 111.126 178.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 178.32 -163.19 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.367 1.867 . . . . 70.0 107.958 -168.162 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . 0.268 5.1 t70 68.53 -66.29 0.24 Allowed 'General case' 0 CA--C 1.518 -0.278 0 C-N-CA 131.378 3.871 . . . . 74.409999999999997 111.725 -172.626 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 30.1 t -47.76 -63.57 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 125.448 1.499 . . . . 74.409999999999997 108.476 170.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -79.37 -5.23 54.12 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 115.011 1.486 . . . . 75.140000000000001 115.011 -179.382 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.2 ptt180 -54.07 -19.85 5.55 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 115.486 1.661 . . . . 74.299999999999997 115.486 -172.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -113.21 -10.84 13.33 Favored 'General case' 0 CA--C 1.516 -0.345 0 C-N-CA 124.034 0.934 . . . . 74.239999999999995 112.648 177.339 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 17.9 tp -94.34 -58.43 2.21 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.881 1.273 . . . . 75.420000000000002 108.086 -175.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.32 -49.14 70.38 Favored 'General case' 0 C--O 1.223 -0.291 0 C-N-CA 124.897 1.279 . . . . 73.209999999999994 109.529 170.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.9 -20.58 65.94 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 114.314 1.227 . . . . 53.399999999999999 114.314 -178.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.08 -52.75 8.26 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 106.954 -1.498 . . . . 75.200000000000003 106.954 170.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 90.5 mt -80.39 39.67 0.47 Allowed 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 127.264 2.225 . . . . 73.340000000000003 110.785 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 62.0 tt0 -55.67 113.26 1.39 Allowed 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 126.579 1.952 . . . . 75.010000000000005 107.504 173.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 80.19 6.95 88.95 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 124.491 1.043 . . . . 53.140000000000001 114.58 -177.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 27.2 mtmm -130.43 -2.58 4.36 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 118.779 1.29 . . . . 75.040000000000006 113.443 -176.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -151.33 106.68 3.33 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 119.993 1.269 . . . . 74.040000000000006 110.379 175.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -64.53 166.48 8.43 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 108.458 -0.942 . . . . 72.400000000000006 108.458 167.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -55.46 -39.47 70.39 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 120.85 -1.156 . . . . 71.209999999999994 110.47 177.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -75.73 -16.73 60.1 Favored 'General case' 0 CA--C 1.53 0.188 0 O-C-N 121.483 -0.761 . . . . 75.230000000000004 111.276 -177.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 96.3 m -68.75 -43.81 75.04 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 118.64 0.655 . . . . 75.439999999999998 109.625 170.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.1 mt -62.29 -57.08 13.7 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-N 119.9 1.227 . . . . 75.299999999999997 108.82 -176.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.96 -44.58 67.22 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 118.274 0.488 . . . . 75.040000000000006 111.528 178.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.28 -52.67 64.64 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 108.922 -0.77 . . . . 73.120000000000005 108.922 -177.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -63.85 -43.76 95.17 Favored 'General case' 0 CA--C 1.518 -0.285 0 C-N-CA 123.748 0.819 . . . . 75.019999999999996 112.869 -174.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 10.0 mtt -58.29 -42.92 87.65 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 118.887 0.767 . . . . 73.420000000000002 110.757 177.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 60.0 t -68.68 -40.24 81.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 124.086 0.954 . . . . 74.0 110.39 179.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -58.26 -52.5 65.34 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 119.655 1.116 . . . . 72.310000000000002 110.947 -173.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 22.3 mt -67.97 1.68 2.53 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.509 1.924 . . . . 74.140000000000001 112.765 -168.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -67.83 -19.39 65.05 Favored 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 125.307 1.443 . . . . 72.200000000000003 112.112 -176.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -76.81 -56.27 4.75 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 119.994 1.27 . . . . 75.409999999999997 109.293 172.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 55.3 m -51.21 -36.85 43.57 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.21 1.404 . . . . 64.129999999999995 110.566 177.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.33 -50.82 68.64 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.693 0.797 . . . . 75.040000000000006 113.033 175.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -76.87 -35.7 57.28 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 118.522 0.601 . . . . 74.019999999999996 110.645 -179.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -61.47 -37.99 85.62 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 124.955 1.302 . . . . 73.329999999999998 111.817 179.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -63.37 -20.76 65.81 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 119.235 0.925 . . . . 73.219999999999999 112.854 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 41.9 mm -79.34 -29.49 13.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 CA-C-N 119.328 0.967 . . . . 73.019999999999996 110.605 174.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 15.9 mm -61.14 -23.78 31.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 N-CA-C 108.641 -0.874 . . . . 75.049999999999997 108.641 167.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -93.76 9.65 36.25 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.523 0.729 . . . . 74.409999999999997 111.779 176.601 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 88.3 mt-10 -132.29 37.49 3.54 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.582 1.953 . . . . 75.25 108.886 -179.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 96.9 mt . . . . . 0 C--O 1.254 1.339 0 C-N-CA 125.779 1.631 . . . . 75.310000000000002 109.331 166.456 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.468 0 N-CA-C 106.799 -1.556 . . . . 75.299999999999997 106.799 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 26.6 m 62.5 114.93 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.571 1.148 . . . . 75.040000000000006 109.301 -158.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -146.07 168.61 20.53 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.302 1.441 . . . . 75.099999999999994 108.675 178.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 12.7 t80 70.04 -70.17 0.15 Allowed 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 127.085 2.154 . . . . 75.140000000000001 112.009 175.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 61.36 13.1 4.71 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 126.997 2.119 . . . . 61.439999999999998 114.449 167.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.7 t0 -87.54 115.28 24.86 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 125.312 1.445 . . . . 44.140000000000001 107.29 170.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 22.8 ptt85 -46.14 139.69 4.4 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.995 2.118 . . . . 75.030000000000001 112.631 -174.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -72.36 174.0 7.95 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-O 122.991 1.376 . . . . 73.099999999999994 110.558 174.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.5 mtm180 -93.15 -176.73 4.25 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.558 1.543 . . . . 71.230000000000004 109.164 -171.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 44.26 61.47 2.36 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.128 1.771 . . . . 72.230000000000004 113.268 170.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -59.64 -14.84 15.36 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 115.444 1.646 . . . . 74.420000000000002 115.444 -172.319 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.471 ' HG3' ' H ' ' A' ' 13' ' ' ALA . 7.0 pt-20 -44.94 -78.75 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.951 2.101 . . . . 74.120000000000005 113.306 -168.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.471 ' H ' ' HG3' ' A' ' 12' ' ' GLU . . . -81.56 -2.57 50.46 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.627 0.771 . . . . 73.129999999999995 112.655 -179.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 31.4 mttm -75.6 -11.04 59.93 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.115 0.966 . . . . 74.140000000000001 112.329 176.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -61.56 -27.04 68.34 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 120.536 1.516 . . . . 75.439999999999998 112.571 -174.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -86.86 16.0 5.3 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.583 1.553 . . . . 62.219999999999999 113.033 174.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 50.9 m-70 -140.69 -65.55 0.45 Allowed 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.077 1.751 . . . . 74.400000000000006 109.966 -173.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -84.24 84.78 7.5 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 126.047 1.739 . . . . 74.409999999999997 107.427 -172.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.87 -26.07 57.94 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 114.811 -1.086 . . . . 75.239999999999995 110.912 175.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.01 -34.19 77.84 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.505 1.122 . . . . 64.129999999999995 111.592 174.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 82.0 mt -77.51 -36.96 52.04 Favored 'General case' 0 C--O 1.232 0.184 0 O-C-N 120.215 -1.553 . . . . 73.299999999999997 109.451 173.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -66.52 -29.74 69.9 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 121.244 -0.91 . . . . 74.400000000000006 111.062 176.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -58.62 -45.9 88.22 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.809 1.244 . . . . 64.099999999999994 110.879 172.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.31 -30.92 13.07 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.773 0.829 . . . . 73.239999999999995 112.247 174.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.18 -24.65 34.86 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 113.73 1.011 . . . . 75.439999999999998 113.73 -174.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -79.84 -16.57 55.19 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 119.352 0.978 . . . . 71.040000000000006 110.972 173.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -74.26 -160.12 0.09 Allowed 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 126.389 1.876 . . . . 71.109999999999999 108.932 166.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.4 mmt180 59.7 -29.65 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 128.973 2.909 . . . . 72.239999999999995 115.818 -176.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.1 ptt180 -50.9 -12.86 0.12 Allowed 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 130.89 3.676 . . . . 75.420000000000002 116.114 -174.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 25.4 m120 -113.4 -23.57 9.79 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 119.574 1.079 . . . . 62.509999999999998 112.275 178.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.9 -44.45 91.23 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 120.9 1.682 . . . . 74.420000000000002 110.301 173.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -79.69 -13.39 59.51 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 113.451 0.908 . . . . 71.420000000000002 113.451 -171.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 15.7 mt -62.02 -24.99 67.39 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.642 0.777 . . . . 74.209999999999994 111.681 173.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -57.55 -39.44 90.88 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.899 -0.88 . . . . 72.549999999999997 110.899 176.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -65.36 -35.05 79.81 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.631 1.215 . . . . 72.420000000000002 111.108 -179.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 56.4 t90 -66.19 -61.88 1.78 Allowed 'General case' 0 C--N 1.342 0.242 0 C-N-CA 123.738 0.815 . . . . 71.140000000000001 108.969 178.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.08 -39.95 83.71 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 119.123 -0.465 . . . . 74.409999999999997 110.985 -178.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.0 -50.31 73.09 Favored 'General case' 0 C--N 1.339 0.15 0 CA-C-N 118.981 0.81 . . . . 53.219999999999999 110.889 172.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -52.28 -50.4 46.86 Favored Glycine 0 C--N 1.335 0.504 0 C-N-CA 124.977 1.275 . . . . 71.329999999999998 110.96 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 91.4 mt -58.53 -51.34 70.28 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 123.816 0.846 . . . . 73.230000000000004 109.764 175.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 32.1 mt -66.19 -6.11 12.45 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 115.406 1.632 . . . . 74.549999999999997 115.406 -176.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 80.61 12.48 82.86 Favored Glycine 0 CA--C 1.529 0.929 0 CA-C-N 119.078 0.854 . . . . 72.349999999999994 112.626 -177.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 57.8 mttt -87.86 129.1 35.31 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 118.834 1.317 . . . . 72.439999999999998 108.4 170.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 61.2 p -144.53 160.43 41.14 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.825 0.85 . . . . 70.319999999999993 108.764 167.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.82 -145.33 32.41 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 110.488 -1.045 . . . . 64.540000000000006 110.488 -175.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -57.36 -35.23 69.69 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.741 1.217 . . . . 54.310000000000002 110.583 -178.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -54.21 -43.56 70.89 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.309 1.044 . . . . 64.439999999999998 111.24 175.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -77.59 -42.56 34.71 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 121.997 -0.439 . . . . 72.349999999999994 109.924 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.3 ptt180 -63.29 -46.07 88.46 Favored 'General case' 0 C--O 1.225 -0.186 0 N-CA-C 109.511 -0.551 . . . . 74.439999999999998 109.511 -174.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.59 -44.16 96.57 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 126.13 1.772 . . . . 62.439999999999998 110.212 -176.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 17.1 t80 -60.78 -55.5 32.34 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.281 0.632 . . . . 74.430000000000007 109.445 171.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.81 -5.52 2.08 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 125.416 1.486 . . . . 61.409999999999997 114.045 -176.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 45.5 mt -65.11 -34.38 78.27 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 120.708 -1.245 . . . . 72.450000000000003 110.369 169.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 13.8 t -133.98 73.45 1.5 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 122.51 1.147 . . . . 54.340000000000003 109.943 -165.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.6 m -136.03 12.98 0.97 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 126.023 1.729 . . . . 71.329999999999998 111.688 -178.143 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 16.0 t -82.78 90.23 2.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 O-C-N 120.626 -1.296 . . . . 75.340000000000003 109.99 -171.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 5.3 t -147.51 131.6 17.3 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 126.171 1.788 . . . . 74.450000000000003 106.554 176.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.6 p -143.4 95.95 2.83 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 124.113 0.965 . . . . 62.119999999999997 108.402 176.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.4 t0 -141.0 89.46 2.25 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 107.429 -1.323 . . . . 71.109999999999999 107.429 -175.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -160.38 176.02 12.14 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 126.247 1.819 . . . . 74.150000000000006 109.66 -175.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 39.0 t70 51.8 91.62 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.109 0 C-N-CA 126.982 2.113 . . . . 74.150000000000006 109.882 -160.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 52.5 72.54 1.15 Allowed Pre-proline 0 CA--C 1.546 0.792 0 C-N-CA 129.77 3.228 . . . . 74.519999999999996 113.708 -168.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -71.36 168.69 22.73 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 123.174 2.583 . . . . 61.549999999999997 111.012 173.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -107.88 -33.75 2.97 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 125.131 1.348 . . . . 75.409999999999997 112.904 178.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -133.48 -14.07 2.58 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 125.54 1.536 . . . . 73.420000000000002 111.337 -179.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 63.32 26.15 14.94 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.769 1.228 . . . . 75.519999999999996 111.071 163.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -76.46 25.44 0.13 Allowed 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.882 1.673 . . . . 75.530000000000001 113.602 -165.233 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 1.6 p -131.31 -57.67 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 C-N-CA 127.83 2.452 . . . . 75.209999999999994 107.655 179.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 46.9 t80 -55.78 -44.02 77.33 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 119.526 1.057 . . . . 75.349999999999994 109.56 172.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.3 ttt180 -62.1 -11.75 15.72 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 114.824 1.416 . . . . 75.310000000000002 114.824 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 55.8 mmtt -105.63 -48.79 3.57 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 120.04 1.291 . . . . 75.510000000000005 109.368 175.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 13.8 mt -70.72 -27.83 64.27 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 118.48 -0.771 . . . . 74.530000000000001 110.956 -172.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.05 -53.25 21.36 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-N 119.434 1.015 . . . . 62.520000000000003 108.529 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.92 -20.96 66.72 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 117.955 -1.021 . . . . 74.109999999999999 113.05 174.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.88 -56.78 6.15 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 103.741 -2.689 . . . . 63.539999999999999 103.741 170.187 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 97.2 mt -77.6 31.56 0.16 Allowed 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 127.135 2.174 . . . . 74.549999999999997 112.141 -174.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -57.06 105.15 0.2 Allowed 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 126.779 2.032 . . . . 64.349999999999994 109.306 174.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 101.84 -1.36 52.04 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 126.153 1.835 . . . . 65.230000000000004 114.788 -177.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 28.9 mtmm -133.24 10.96 4.17 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 126.027 1.731 . . . . 74.329999999999998 113.088 -177.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -151.33 176.04 11.64 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 121.842 0.83 . . . . 63.109999999999999 111.683 175.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -140.65 163.68 32.22 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 127.582 2.353 . . . . 71.519999999999996 105.599 172.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -46.05 -61.78 1.61 Allowed 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 126.109 1.763 . . . . 62.310000000000002 110.358 169.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -67.57 -38.11 83.61 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.188 0.595 . . . . 75.510000000000005 111.821 -176.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 28.5 m -55.57 -46.39 77.2 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.802 0.841 . . . . 74.349999999999994 110.895 174.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 7.5 mt -70.28 -56.84 9.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 120.181 1.355 . . . . 72.439999999999998 110.301 173.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.87 -17.65 61.82 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 119.676 1.126 . . . . 75.25 113.153 -170.272 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -88.99 -32.86 17.42 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 119.541 1.064 . . . . 75.430000000000007 112.823 171.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 57.7 tptt -63.64 -70.27 0.23 Allowed 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.718 1.207 . . . . 74.530000000000001 112.178 -169.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -31.64 71.26 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 112.806 0.669 . . . . 75.129999999999995 112.806 -167.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 74.2 t -58.74 -38.76 73.95 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 C-N-CA 124.925 1.29 . . . . 74.230000000000004 109.428 176.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -73.4 -21.4 60.5 Favored 'General case' 0 C--O 1.232 0.181 0 O-C-N 121.67 -0.644 . . . . 72.439999999999998 111.336 -172.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 89.0 mt -72.25 8.17 1.44 Allowed 'General case' 0 C--O 1.227 -0.127 0 C-N-CA 123.785 0.834 . . . . 64.430000000000007 111.661 -170.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 38.1 ttp85 -57.88 -44.52 86.75 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 121.224 -0.923 . . . . 73.409999999999997 110.015 174.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.52 -50.24 74.68 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-N 118.466 0.576 . . . . 62.350000000000001 110.851 171.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -58.3 -36.91 74.04 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.609 -0.682 . . . . 73.450000000000003 110.713 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -71.23 -48.82 49.0 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.718 1.207 . . . . 74.140000000000001 111.754 -177.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -63.2 -30.22 71.41 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 117.723 0.238 . . . . 75.450000000000003 110.659 177.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -57.66 -53.56 56.75 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 125.565 1.546 . . . . 71.019999999999996 111.048 170.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -57.2 -16.76 8.87 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 114.037 1.125 . . . . 73.150000000000006 114.037 -174.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 50.0 mm -71.23 -61.86 1.52 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 118.927 0.785 . . . . 73.400000000000006 110.168 168.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 84.5 mt -67.71 -19.36 24.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 124.478 1.111 . . . . 72.239999999999995 110.48 -173.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -69.55 -16.38 63.41 Favored 'General case' 0 N--CA 1.429 -1.517 0 C-N-CA 124.247 1.019 . . . . 73.109999999999999 111.839 172.053 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -145.7 67.84 1.21 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-N 119.899 1.227 . . . . 64.239999999999995 109.867 -173.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 15.2 mm . . . . . 0 C--O 1.252 1.185 0 C-N-CA 125.249 1.42 . . . . 74.230000000000004 108.74 173.876 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ptt? . . . . . 0 N--CA 1.478 0.933 0 CA-C-O 118.226 -0.892 . . . . 71.450000000000003 110.445 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 13.9 t -128.56 178.07 6.57 Favored 'General case' 0 C--O 1.239 0.547 0 N-CA-C 106.465 -1.68 . . . . 71.319999999999993 106.465 161.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.1 p -152.71 145.3 24.19 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 129.491 3.116 . . . . 73.530000000000001 105.631 -176.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -156.17 84.09 1.0 Allowed 'General case' 0 C--O 1.236 0.366 0 CA-C-N 119.857 1.208 . . . . 74.140000000000001 109.003 -174.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -79.2 93.97 5.32 Favored 'General case' 0 C--O 1.234 0.243 0 O-C-N 121.379 -0.826 . . . . 63.219999999999999 109.938 178.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 66.6 t0 -158.22 97.24 1.49 Allowed 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 103.481 -2.785 . . . . 73.310000000000002 103.481 165.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.5 ttp180 -130.46 120.22 23.85 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 106.993 -1.484 . . . . 74.430000000000007 106.993 -173.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.3 pm0 -68.78 163.87 23.12 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 122.117 0.96 . . . . 74.140000000000001 111.541 173.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.404 ' NH1' ' HZ1' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -74.47 -52.35 12.22 Favored 'General case' 0 C--O 1.226 -0.142 0 CA-C-N 114.791 -1.095 . . . . 73.510000000000005 109.249 -179.59 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 46.12 68.62 0.57 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 126.992 2.117 . . . . 74.239999999999995 111.821 176.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -71.02 -4.85 27.12 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 115.249 1.574 . . . . 74.420000000000002 115.249 -169.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -62.34 129.58 41.36 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 108.823 -0.806 . . . . 73.150000000000006 108.823 -177.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 57.26 -8.63 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 127.889 2.476 . . . . 73.109999999999999 115.535 -169.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -77.33 -25.13 50.85 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 119.93 1.241 . . . . 72.150000000000006 112.066 174.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.39 -17.6 59.53 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 114.18 1.178 . . . . 74.329999999999998 114.18 -169.614 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -126.28 40.29 3.76 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 125.622 1.569 . . . . 73.340000000000003 108.847 173.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -149.37 -75.54 0.16 Allowed 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 107.79 -1.189 . . . . 74.439999999999998 107.79 179.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.57 117.77 9.23 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 124.804 1.241 . . . . 74.25 108.631 -178.178 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.74 -31.13 72.2 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 124.168 0.987 . . . . 72.420000000000002 111.669 -173.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -60.74 -62.55 1.77 Allowed 'General case' 0 C--O 1.231 0.095 0 C-N-CA 125.717 1.607 . . . . 71.129999999999995 112.163 -177.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 36.0 mt -72.03 -32.81 67.49 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 121.788 -0.57 . . . . 64.230000000000004 109.481 -169.218 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 58.0 t-20 -53.57 -59.93 3.96 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 126.36 1.864 . . . . 74.109999999999999 108.744 169.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -56.22 -45.6 79.86 Favored 'General case' 0 CA--C 1.517 -0.298 0 C-N-CA 123.665 0.786 . . . . 73.319999999999993 111.483 179.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.404 ' HZ1' ' NH1' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -52.37 -31.4 33.61 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 119.234 0.924 . . . . 74.340000000000003 112.268 -177.912 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -91.58 -53.97 4.09 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 125.274 1.43 . . . . 72.239999999999995 111.868 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -58.29 -25.12 61.46 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.73 -0.606 . . . . 74.310000000000002 110.962 179.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -106.88 7.54 30.16 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 125.094 1.358 . . . . 71.239999999999995 112.401 -177.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.47 -14.98 3.46 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 120.744 -1.223 . . . . 74.099999999999994 113.124 174.597 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 49.5 mtm180 -62.42 16.56 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 131.344 3.858 . . . . 74.340000000000003 116.113 -166.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.624 HD22 ' N ' ' A' ' 58' ' ' SER . 1.0 OUTLIER -124.61 -70.05 0.77 Allowed 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 119.719 1.145 . . . . 72.109999999999999 108.819 165.336 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.34 -19.83 56.98 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.467 1.284 . . . . 73.319999999999993 114.467 -165.828 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.18 -19.93 66.21 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 113.039 0.755 . . . . 74.5 113.039 174.291 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 20.9 tp -72.49 -27.53 62.33 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 126.436 1.894 . . . . 73.400000000000006 110.905 171.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.25 -53.66 38.12 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 108.469 -1.852 . . . . 50.229999999999997 108.469 164.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -63.59 -7.13 6.39 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.231 1.412 . . . . 71.239999999999995 113.791 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 22.6 t90 -86.02 -79.4 0.25 Allowed 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 107.37 -1.344 . . . . 75.430000000000007 107.37 165.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.37 -21.86 62.62 Favored 'General case' 0 C--O 1.225 -0.193 0 C-N-CA 124.804 1.242 . . . . 74.420000000000002 114.099 -167.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -54.09 -53.49 52.51 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.861 1.209 . . . . 75.209999999999994 109.866 176.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -54.74 -48.78 64.44 Favored Glycine 0 CA--C 1.524 0.644 0 C-N-CA 124.254 0.931 . . . . 63.340000000000003 111.771 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.0 mp -52.9 -39.56 62.85 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.523 1.529 . . . . 71.209999999999994 111.78 175.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 67.8 mt -86.8 1.44 52.3 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.704 1.602 . . . . 75.129999999999995 112.881 -177.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.79 29.64 25.81 Favored Glycine 0 CA--C 1.526 0.771 0 C-N-CA 124.391 0.996 . . . . 53.130000000000003 112.864 177.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.9 mttt -128.76 122.0 29.62 Favored 'General case' 0 CA--C 1.523 -0.092 0 C-N-CA 125.642 1.577 . . . . 64.340000000000003 108.566 -168.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.4 p -138.26 179.59 6.36 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 124.077 0.951 . . . . 64.540000000000006 109.387 175.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 52.46 -131.0 38.77 Favored Glycine 0 CA--C 1.523 0.579 0 C-N-CA 124.613 1.102 . . . . 74.409999999999997 111.414 178.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -61.8 -28.77 69.69 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 113.258 0.836 . . . . 61.530000000000001 113.258 -176.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -68.63 -47.56 66.31 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 122.61 1.195 . . . . 72.319999999999993 110.424 179.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.72 -36.54 81.25 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 114.721 -1.127 . . . . 64.409999999999997 111.079 172.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.5 ttm-85 -53.34 -52.28 59.72 Favored 'General case' 0 N--CA 1.444 -0.755 0 C-N-CA 123.712 0.805 . . . . 73.140000000000001 111.43 175.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.74 -45.04 94.55 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.413 0.551 . . . . 73.319999999999993 111.042 -177.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -54.23 -45.89 72.4 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.054 0.941 . . . . 74.310000000000002 110.051 175.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.97 -13.09 30.6 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 114.106 1.15 . . . . 71.200000000000003 114.106 179.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 18.3 mt -94.14 -14.58 25.52 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 120.905 -1.122 . . . . 73.5 110.773 179.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 12.5 t -110.24 29.06 8.02 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.067 1.747 . . . . 73.510000000000005 109.721 172.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 58.5 t -134.07 75.76 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 N-CA-C 107.337 -1.357 . . . . 54.409999999999997 107.337 170.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 1.6 t -137.36 168.19 21.63 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 C-N-CA 125.047 1.339 . . . . 73.400000000000006 107.744 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER 67.2 -36.13 0.27 Allowed 'General case' 0 CA--C 1.553 1.078 1 C-N-CA 135.327 5.451 . . . . 61.530000000000001 116.186 -175.767 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.624 ' N ' HD22 ' A' ' 30' ' ' ASN . 95.0 p 65.96 146.43 0.04 OUTLIER 'General case' 0 C--N 1.345 0.383 0 C-N-CA 129.038 2.935 . . . . 73.129999999999995 111.985 -168.053 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -158.79 93.97 1.21 Allowed 'General case' 0 C--O 1.234 0.28 0 N-CA-C 108.934 -0.765 . . . . 51.299999999999997 108.934 -167.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.444 ' CE2' ' HB3' ' A' ' 86' ' ' ARG . 0.2 OUTLIER -164.68 51.84 0.12 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.445 1.098 . . . . 74.540000000000006 110.868 -173.614 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -147.99 122.51 9.77 Favored 'General case' 0 N--CA 1.477 0.925 0 O-C-N 120.576 -1.328 . . . . 73.129999999999995 113.203 -168.531 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 57.26 165.36 0.07 OUTLIER Pre-proline 0 N--CA 1.48 1.044 0 C-N-CA 127.623 2.369 . . . . 73.510000000000005 113.254 -160.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -74.62 70.67 4.93 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 123.595 2.863 . . . . 65.510000000000005 110.455 177.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -164.22 -42.77 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 125.216 1.389 . . . . 72.519999999999996 110.993 175.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -85.78 86.03 7.37 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 105.851 -1.907 . . . . 74.239999999999995 105.851 -175.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -139.42 72.15 1.4 Allowed 'General case' 0 N--CA 1.445 -0.716 0 N-CA-C 105.345 -2.095 . . . . 51.130000000000003 105.345 170.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.84 -65.05 1.04 Allowed 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 109.904 -0.406 . . . . 72.530000000000001 109.904 173.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.3 p -67.0 -44.1 88.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 118.393 0.542 . . . . 70.5 110.648 -177.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -61.72 -33.34 73.87 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 121.493 -0.754 . . . . 74.530000000000001 111.231 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 17.5 tpp180 -51.82 -50.76 60.2 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 124.804 1.242 . . . . 73.519999999999996 111.341 -171.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.91 -26.8 22.53 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 119.455 -0.307 . . . . 74.230000000000004 111.073 -177.751 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -52.44 -61.41 2.29 Favored 'General case' 0 CA--C 1.52 -0.197 0 C-N-CA 123.974 0.91 . . . . 70.310000000000002 108.839 177.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.72 -36.45 80.97 Favored 'General case' 0 N--CA 1.456 -0.165 0 O-C-N 123.889 0.743 . . . . 71.329999999999998 111.931 -171.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.39 -45.13 85.24 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.03 0.443 . . . . 74.239999999999995 110.534 178.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -65.81 -48.13 72.73 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 122.131 0.967 . . . . 71.219999999999999 109.65 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 11.8 tp -87.2 10.34 17.24 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 127.35 2.26 . . . . 72.230000000000004 113.26 -169.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -47.54 111.13 0.38 Allowed 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 127.313 2.245 . . . . 72.099999999999994 110.446 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 106.1 -2.26 38.0 Favored Glycine 0 CA--C 1.524 0.629 0 C-N-CA 125.768 1.652 . . . . 74.400000000000006 113.599 177.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.35 -0.13 5.68 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 119.722 1.761 . . . . 71.340000000000003 112.475 -179.329 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -147.89 176.35 10.22 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 125.065 1.346 . . . . 71.030000000000001 108.88 176.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -141.57 170.8 15.05 Favored 'General case' 0 CA--C 1.511 -0.521 0 C-N-CA 125.464 1.506 . . . . 65.299999999999997 107.88 174.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -65.47 -52.76 50.71 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 125.59 1.556 . . . . 70.030000000000001 108.63 -177.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -67.38 -29.95 69.61 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.463 0.705 . . . . 74.540000000000006 110.34 178.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 5.0 m -65.46 -57.8 7.39 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.419 0.688 . . . . 73.209999999999994 110.271 173.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 21.1 mt -60.29 -53.05 54.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 CA-C-N 120.511 1.505 . . . . 72.519999999999996 109.269 -171.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.444 ' HB3' ' CE2' ' A' ' 60' ' ' PHE . 0.9 OUTLIER -55.1 -37.58 67.02 Favored 'General case' 0 C--N 1.342 0.265 0 O-C-N 123.999 0.812 . . . . 71.219999999999999 110.858 -178.626 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -71.19 -47.91 54.75 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-O 118.375 -0.821 . . . . 64.129999999999995 109.285 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -50.51 -60.97 2.48 Favored 'General case' 0 CA--C 1.516 -0.345 0 C-N-CA 125.051 1.34 . . . . 73.219999999999999 109.295 -177.517 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . 0.282 0.0 OUTLIER -59.16 -38.35 79.53 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 120.271 -0.572 . . . . 73.439999999999998 111.928 -165.747 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 32.0 t -70.29 -53.16 24.32 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 125.249 1.42 . . . . 71.109999999999999 110.558 174.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -63.69 -26.15 68.53 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 120.178 -1.576 . . . . 65.239999999999995 111.769 -168.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 44.9 mt -64.6 8.95 0.09 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.856 1.662 . . . . 74.239999999999995 113.753 177.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -45.0 -64.11 0.78 Allowed 'General case' 0 C--N 1.34 0.195 0 C-N-CA 127.588 2.355 . . . . 73.209999999999994 113.13 -177.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.25 -20.2 28.81 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 118.966 0.803 . . . . 62.439999999999998 111.41 178.245 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.2 m -57.56 -30.04 64.91 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 120.858 -1.151 . . . . 74.519999999999996 110.242 174.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -54.18 -36.39 63.35 Favored 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 124.929 1.292 . . . . 62.299999999999997 114.253 170.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 18.5 ptt180 -90.78 -24.41 20.34 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 117.606 -1.188 . . . . 70.400000000000006 111.671 179.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -56.4 -59.28 5.2 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 119.044 0.838 . . . . 72.439999999999998 109.108 169.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -58.07 -20.63 40.94 Favored 'General case' 0 C--O 1.223 -0.315 0 N-CA-C 114.636 1.347 . . . . 74.5 114.636 -168.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 8.4 mm -89.19 -35.36 7.58 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 O-C-N 120.696 -1.253 . . . . 74.439999999999998 110.016 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 97.0 mt -66.96 -30.32 49.22 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 N-CA-C 108.579 -0.897 . . . . 73.109999999999999 108.579 168.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 2.2 t -71.69 -43.0 66.75 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.067 1.347 . . . . 74.319999999999993 109.413 178.175 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -129.49 70.2 1.42 Allowed 'General case' 0 C--O 1.234 0.288 0 C-N-CA 125.778 1.631 . . . . 73.340000000000003 107.508 -169.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 76.7 mt . . . . . 0 C--O 1.248 0.975 0 C-N-CA 126.533 1.933 . . . . 75.530000000000001 110.76 -176.007 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.2 ttt . . . . . 0 N--CA 1.475 0.801 0 N-CA-C 108.484 -0.932 . . . . 74.409999999999997 108.484 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.458 HG23 ' H ' ' A' ' 3' ' ' THR . 17.4 m 66.18 -164.18 0.23 Allowed 'General case' 0 C--O 1.243 0.715 0 CA-C-N 118.796 0.725 . . . . 74.340000000000003 109.182 167.14 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.458 ' H ' HG23 ' A' ' 2' ' ' THR . 0.7 OUTLIER -119.69 178.08 4.71 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.932 2.093 . . . . 75.420000000000002 107.235 166.841 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -151.35 174.46 13.3 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 124.635 1.174 . . . . 74.239999999999995 108.393 167.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -115.08 -177.41 3.12 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.145 1.378 . . . . 73.450000000000003 107.866 -176.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -144.57 83.41 1.71 Allowed 'General case' 0 CA--C 1.52 -0.179 0 O-C-N 120.746 -1.221 . . . . 75.549999999999997 108.606 158.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -91.74 154.32 19.04 Favored 'General case' 0 C--O 1.236 0.381 0 O-C-N 121.78 -0.575 . . . . 73.310000000000002 110.284 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -69.89 157.0 38.24 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.456 -0.942 . . . . 75.540000000000006 108.456 167.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -61.5 144.86 53.54 Favored 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 126.916 2.086 . . . . 72.530000000000001 109.913 175.523 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -172.45 95.83 0.14 Allowed 'General case' 0 C--O 1.234 0.285 0 C-N-CA 126.904 2.082 . . . . 75.510000000000005 106.632 169.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -131.86 9.94 4.61 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 115.432 1.641 . . . . 73.540000000000006 115.432 177.318 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -53.78 121.37 7.75 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.647 1.112 . . . . 75.319999999999993 109.12 174.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 48.51 -0.23 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 129.577 3.151 . . . . 64.319999999999993 117.248 -176.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.3 mmtt -76.59 -6.77 53.36 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 125.58 1.552 . . . . 73.409999999999997 112.808 -173.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -58.85 -36.0 73.87 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 119.449 1.022 . . . . 72.319999999999993 111.809 177.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.79 16.75 0.08 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.59 1.956 . . . . 75.400000000000006 113.399 178.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 44.8 t-80 -152.15 -73.49 0.14 Allowed 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 123.508 0.723 . . . . 75.510000000000005 109.94 -163.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -83.73 145.39 28.76 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 123.811 0.844 . . . . 72.530000000000001 108.841 -170.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.41 -50.57 9.29 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-O 117.945 -1.026 . . . . 75.329999999999998 109.771 175.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -44.94 -42.85 8.51 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 126.489 1.915 . . . . 75.329999999999998 113.392 -178.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 82.8 mt -76.38 -28.9 56.93 Favored 'General case' 0 C--N 1.33 -0.274 0 O-C-N 120.908 -1.12 . . . . 75.140000000000001 111.004 -174.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -80.03 -28.81 39.28 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.716 2.006 . . . . 75.099999999999994 111.212 171.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -56.63 -48.67 77.01 Favored 'General case' 0 C--O 1.226 -0.142 0 C-N-CA 126.929 2.092 . . . . 74.439999999999998 109.696 -171.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.45 -41.71 63.53 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 118.526 -0.75 . . . . 73.400000000000006 112.537 175.481 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.15 -54.27 43.56 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 124.515 1.126 . . . . 60.109999999999999 111.153 178.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -66.19 -11.26 48.51 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 112.647 0.61 . . . . 72.340000000000003 112.647 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -121.3 32.59 5.86 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.42 1.488 . . . . 60.329999999999998 111.335 -177.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -120.01 17.5 12.5 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.057 1.343 . . . . 73.540000000000006 112.86 178.304 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 71.7 mtm-85 -71.23 -48.82 48.94 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 120.296 -1.503 . . . . 74.109999999999999 111.825 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 30.3 m120 -62.19 -27.63 69.11 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 114.642 1.349 . . . . 74.120000000000005 114.642 -163.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.11 -34.61 66.2 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 119.322 0.964 . . . . 75.140000000000001 113.29 172.672 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -75.14 -33.23 61.51 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 123.613 0.765 . . . . 74.549999999999997 108.995 -177.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -62.64 -33.44 75.02 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 108.625 -0.879 . . . . 75.420000000000002 108.625 169.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -67.81 -14.36 65.23 Favored Glycine 0 CA--C 1.538 1.524 0 CA-C-O 117.709 -1.606 . . . . 63.119999999999997 113.685 170.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -91.52 -18.69 23.73 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 121.291 2.545 . . . . 74.450000000000003 111.255 169.026 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 10.6 t90 -76.62 -79.23 0.11 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.148 1.379 . . . . 64.349999999999994 110.518 -176.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -50.69 -29.84 12.24 Favored 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 127.472 2.309 . . . . 74.340000000000003 112.722 -171.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -44.57 -52.87 7.65 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 126.64 1.976 . . . . 74.150000000000006 110.616 173.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -53.45 -48.73 59.47 Favored Glycine 0 C--N 1.337 0.625 0 N-CA-C 110.479 -1.048 . . . . 71.230000000000004 110.479 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.42 ' H ' ' CD1' ' A' ' 40' ' ' LEU . 2.2 mp -61.79 -46.48 89.36 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 126.728 2.011 . . . . 73.129999999999995 108.621 -177.37 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.0 mp -62.97 -18.28 63.04 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.083 1.353 . . . . 63.32 112.899 175.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 106.08 -1.91 38.07 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 127.065 2.269 . . . . 74.450000000000003 112.8 177.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 44.4 mttm -75.1 143.53 43.32 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 118.466 1.133 . . . . 71.319999999999993 108.65 178.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.1 p -142.16 178.53 7.48 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 124.043 0.937 . . . . 73.319999999999993 109.326 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 55.08 -119.89 15.23 Favored Glycine 0 N--CA 1.442 -0.922 0 C-N-CA 124.63 1.109 . . . . 64.319999999999993 110.544 168.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -82.86 -22.52 34.03 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 123.568 0.747 . . . . 73.420000000000002 112.768 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -72.43 -41.51 66.11 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.003 -1.06 . . . . 60.210000000000001 110.372 -176.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.8 -46.71 88.36 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.647 -0.872 . . . . 73.329999999999998 108.647 168.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -59.17 -33.63 71.15 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 118.419 -0.801 . . . . 74.430000000000007 112.895 179.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.56 -51.23 29.9 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 124.704 1.202 . . . . 72.420000000000002 109.849 175.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -56.77 -30.28 63.47 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.5 1.12 . . . . 75.239999999999995 111.857 176.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.45 1.09 2.48 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 120.468 -1.395 . . . . 75.239999999999995 114.32 175.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.0 mt -108.81 1.49 20.99 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 125.263 1.425 . . . . 75.319999999999993 110.147 179.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 77.4 p -129.9 18.79 5.58 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.165 0.893 . . . . 72.530000000000001 112.163 -168.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 5.4 t -132.97 102.68 5.23 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 C-N-CA 125.06 1.344 . . . . 75.310000000000002 109.08 177.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 4.2 p -146.78 128.15 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 O-C-N 120.884 -1.135 . . . . 75.549999999999997 110.058 175.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 5.5 t -170.55 87.13 0.12 Allowed 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 106.663 -1.606 . . . . 72.450000000000003 106.663 178.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.1 t -83.08 59.38 4.91 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.76 2.024 . . . . 74.200000000000003 108.173 -172.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 38.2 m-20 -139.17 39.7 2.11 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.397 1.879 . . . . 74.120000000000005 109.537 -159.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -138.28 61.39 1.59 Allowed 'General case' 0 C--O 1.235 0.328 0 O-C-N 120.124 -1.61 . . . . 75.310000000000002 110.015 -166.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -150.84 4.92 0.49 Allowed 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 115.432 1.641 . . . . 75.239999999999995 115.432 167.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -67.73 159.49 78.5 Favored Pre-proline 0 CA--C 1.542 0.673 0 CA-C-N 119.509 1.05 . . . . 75.319999999999993 108.911 160.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -79.45 65.18 8.9 Favored 'Trans proline' 0 CA--C 1.544 0.989 0 C-N-CA 122.586 2.191 . . . . 55.119999999999997 113.35 -165.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 135.75 -62.35 0.61 Allowed Glycine 0 CA--C 1.523 0.582 0 C-N-CA 126.023 1.773 . . . . 72.319999999999993 109.692 176.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . 0.265 14.2 t70 44.83 -45.42 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.494 1 C-N-CA 134.094 4.958 . . . . 71.140000000000001 118.522 -178.233 . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 66.93 -3.25 0.97 Allowed 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 126.31 1.844 . . . . 74.120000000000005 115.865 153.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -97.46 -21.17 17.29 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 119.883 -1.761 . . . . 74.310000000000002 111.459 174.13 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 48.2 t -84.38 -48.88 16.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 C-N-CA 124.17 0.988 . . . . 63.299999999999997 109.939 -177.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.43 -22.11 60.98 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 118.868 0.758 . . . . 75.430000000000007 112.889 -179.001 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.0 ttt180 -44.6 -43.14 7.94 Favored 'General case' 0 CA--C 1.516 -0.352 0 C-N-CA 128.429 2.692 . . . . 73.420000000000002 112.021 172.114 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -74.0 -15.79 61.09 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 118.403 -0.808 . . . . 75.109999999999999 111.98 -171.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 70.0 mt -96.32 -53.93 3.45 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.55 -0.907 . . . . 71.510000000000005 108.55 167.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -52.62 -40.47 62.78 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.753 1.621 . . . . 74.439999999999998 113.109 -169.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.35 -48.18 62.11 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.847 0.459 . . . . 74.140000000000001 111.159 177.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -67.24 -28.77 68.33 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 120.852 -1.155 . . . . 63.25 111.262 -176.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 14.2 tp -103.78 13.43 33.02 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 128.063 2.545 . . . . 75.409999999999997 111.824 -172.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -59.34 111.84 1.52 Allowed 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 126.268 1.827 . . . . 64.549999999999997 109.462 -177.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 105.49 -3.61 39.9 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 126.084 1.802 . . . . 75.049999999999997 113.077 -174.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 14.3 mtmm -134.16 -0.4 3.03 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 118.959 1.38 . . . . 72.030000000000001 112.474 -177.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -144.93 172.15 13.44 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 119.028 0.831 . . . . 75.239999999999995 110.506 168.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -132.83 161.45 34.12 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 125.845 1.658 . . . . 71.019999999999996 107.478 -178.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -64.73 -49.74 69.67 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.117 -0.947 . . . . 75.239999999999995 110.066 -164.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -71.64 -34.94 70.21 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 122.695 0.398 . . . . 75.519999999999996 110.042 177.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 52.3 m -57.24 -45.71 83.69 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.004 0.922 . . . . 74.340000000000003 111.062 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 79.8 mt -58.5 -48.58 85.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 CA-C-N 119.589 1.086 . . . . 74.540000000000006 110.404 179.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.64 -44.75 93.39 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 118.943 0.792 . . . . 71.329999999999998 110.667 -175.587 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.7 -38.08 89.76 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.198 0.599 . . . . 75.239999999999995 111.567 179.046 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.36 -47.04 76.36 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.319 0.648 . . . . 75.019999999999996 110.744 -177.078 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 10.5 mtt -61.84 -30.59 70.94 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 120.992 0.425 . . . . 74.530000000000001 111.853 -178.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 92.1 t -86.6 -25.44 6.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 124.915 1.286 . . . . 74.230000000000004 110.207 -171.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 90.2 mt-10 -56.99 -45.02 83.26 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.459 1.104 . . . . 55.509999999999998 110.459 175.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 4.2 pp -101.28 18.69 19.32 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 127.592 2.357 . . . . 74.040000000000006 112.688 -174.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.71 -31.08 72.14 Favored 'General case' 0 N--CA 1.469 0.493 0 O-C-N 119.92 -1.738 . . . . 75.400000000000006 113.945 -173.757 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -78.09 -37.2 46.99 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 119.665 1.12 . . . . 74.109999999999999 111.313 173.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 6.1 m -45.38 -47.56 13.51 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.435 1.894 . . . . 74.439999999999998 110.902 -172.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -64.75 -40.47 95.36 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 113.945 1.091 . . . . 72.420000000000002 113.945 -177.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 11.6 ptt180 -73.87 -33.13 63.93 Favored 'General case' 0 C--N 1.342 0.247 0 CA-C-O 117.436 -1.268 . . . . 74.209999999999994 110.59 -175.489 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -49.47 -55.69 12.36 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 118.314 -0.85 . . . . 63.310000000000002 109.034 171.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -53.12 -39.84 63.74 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-O 118.475 -0.774 . . . . 72.109999999999999 112.987 -173.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 8.5 mm -63.23 -46.41 95.85 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 120.04 1.291 . . . . 75.120000000000005 109.961 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 56.0 mt -67.03 -24.52 32.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 124.821 1.248 . . . . 75.329999999999998 109.095 179.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.13 -12.57 59.65 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.527 1.931 . . . . 74.329999999999998 111.53 176.23 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -121.36 24.07 10.12 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 125.587 1.555 . . . . 73.25 109.873 -163.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 33.0 mm . . . . . 0 C--O 1.255 1.346 0 N-CA-C 107.371 -1.344 . . . . 63.399999999999999 107.371 176.443 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.7 mtt . . . . . 0 N--CA 1.471 0.592 0 N-CA-C 106.952 -1.499 . . . . 71.120000000000005 106.952 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 42.1 p -136.43 -39.93 0.65 Allowed 'General case' 0 C--O 1.235 0.319 0 C-N-CA 123.008 0.523 . . . . 71.299999999999997 110.568 -168.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 6.8 m 68.46 -62.44 0.37 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 127.516 2.326 . . . . 74.019999999999996 112.062 172.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 47.1 p90 -137.67 -37.21 0.61 Allowed 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 126.817 2.047 . . . . 74.140000000000001 109.503 175.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 44.84 90.44 0.01 OUTLIER 'General case' 0 C--N 1.342 0.242 0 C-N-CA 129.111 2.964 . . . . 53.539999999999999 112.323 -176.623 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -56.46 -66.78 0.38 Allowed 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.1 0.96 . . . . 64.239999999999995 110.713 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -88.7 157.86 18.39 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 122.341 0.256 . . . . 75.239999999999995 110.334 -171.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -96.43 -85.82 0.33 Allowed 'General case' 0 CA--C 1.54 0.561 0 O-C-N 123.462 0.476 . . . . 75.200000000000003 111.006 -176.09 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 81.0 mtm-85 -128.29 -63.8 0.98 Allowed 'General case' 0 N--CA 1.475 0.781 0 O-C-N 120.796 -1.19 . . . . 75.219999999999999 112.705 -168.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 45.23 77.36 0.08 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 127.745 2.418 . . . . 72.340000000000003 114.359 179.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -60.59 16.19 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 127.36 2.264 . . . . 71.439999999999998 116.607 170.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.436 ' C ' ' H ' ' A' ' 14' ' ' LYS . 46.0 mt-10 -77.37 117.53 18.95 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 119.481 -2.012 . . . . 73.219999999999999 109.369 -171.221 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.29 -15.94 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 128.335 2.654 . . . . 71.310000000000002 116.069 -164.123 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.436 ' H ' ' C ' ' A' ' 12' ' ' GLU . 30.4 mttm -74.27 2.91 8.12 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.873 2.069 . . . . 74.120000000000005 115.802 -173.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -80.71 1.56 29.68 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 119.513 -1.992 . . . . 74.340000000000003 112.307 175.388 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -120.86 -154.75 0.6 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.922 2.089 . . . . 64.230000000000004 105.568 159.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 65.92 -54.61 0.37 Allowed 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 129.167 2.987 . . . . 73.099999999999994 115.711 168.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -96.0 -175.44 3.4 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 127.747 2.419 . . . . 75.200000000000003 107.604 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -113.72 -39.98 3.9 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 117.747 -1.12 . . . . 73.420000000000002 110.515 166.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 77.8 mt-10 -45.55 -54.02 8.17 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.066 1.346 . . . . 73.430000000000007 112.521 -175.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.554 ' CD2' ' H ' ' A' ' 21' ' ' LEU . 0.6 OUTLIER -72.34 -33.93 67.67 Favored 'General case' 0 N--CA 1.436 -1.137 0 O-C-N 121.01 -1.056 . . . . 73.030000000000001 111.931 -177.262 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -72.34 -30.01 64.35 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 123.37 0.668 . . . . 74.030000000000001 110.697 177.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.22 -45.84 90.04 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.674 1.189 . . . . 75.140000000000001 109.644 177.38 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 13.3 mttp -53.06 -39.63 63.4 Favored 'General case' 0 N--CA 1.463 0.182 0 O-C-N 121.599 -0.688 . . . . 72.439999999999998 110.927 172.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -78.98 -28.64 43.53 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 114.098 1.147 . . . . 74.120000000000005 114.098 179.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -67.6 -40.61 84.75 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 108.436 -0.95 . . . . 74.0 108.436 178.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -109.06 54.99 0.64 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 122.004 0.907 . . . . 71.140000000000001 110.221 -156.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.5 ppt_? -151.71 -15.45 0.19 Allowed 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 114.215 1.191 . . . . 62.219999999999999 114.215 -177.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.13 -22.25 16.07 Favored 'General case' 0 C--O 1.231 0.088 0 O-C-N 120.69 -1.256 . . . . 73.200000000000003 114.031 -178.169 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -105.12 -25.32 12.55 Favored 'General case' 0 CA--C 1.518 -0.25 0 N-CA-C 113.99 1.107 . . . . 74.140000000000001 113.99 176.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.92 -22.4 64.33 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 118.919 0.782 . . . . 75.140000000000001 112.317 -169.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.4 -11.87 47.93 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 124.589 1.155 . . . . 73.030000000000001 113.678 -178.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 16.9 tp -72.88 -21.75 60.88 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.814 1.246 . . . . 75.230000000000004 112.243 -175.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -66.19 -37.59 93.1 Favored Glycine 0 CA--C 1.521 0.434 0 N-CA-C 110.898 -0.881 . . . . 75.439999999999998 110.898 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -54.73 -34.97 63.19 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 126.377 1.871 . . . . 73.340000000000003 111.568 178.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 28.3 t90 -70.26 -81.53 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.673 -0.862 . . . . 75.409999999999997 108.673 174.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -57.92 -24.7 58.99 Favored 'General case' 0 C--N 1.34 0.178 0 N-CA-C 114.311 1.226 . . . . 75.209999999999994 114.311 -167.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.01 -56.41 14.46 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 119.725 1.148 . . . . 75.120000000000005 109.954 176.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -53.45 -49.05 58.59 Favored Glycine 0 CA--C 1.527 0.79 0 CA-C-O 119.282 -0.732 . . . . 75.310000000000002 111.889 177.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 8.4 mp -52.41 -45.88 66.09 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.609 1.163 . . . . 74.329999999999998 110.892 179.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 84.8 mt -79.02 0.28 28.35 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 127.0 2.12 . . . . 74.310000000000002 112.862 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 71.41 3.07 52.33 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 124.691 1.138 . . . . 71.400000000000006 113.113 -175.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -63.48 127.72 32.6 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 106.178 -1.786 . . . . 75.030000000000001 106.178 175.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 37.7 p -136.37 171.79 13.97 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 107.98 -1.119 . . . . 61.240000000000002 107.98 175.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 51.14 -125.69 25.2 Favored Glycine 0 CA--C 1.524 0.634 0 C-N-CA 124.024 0.821 . . . . 63.240000000000002 112.632 172.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -61.89 -37.27 83.94 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.804 1.242 . . . . 73.219999999999999 111.704 -176.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.49 -43.03 73.97 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.686 0.795 . . . . 72.019999999999996 110.944 -177.399 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.77 -41.84 87.07 Favored 'General case' 0 C--O 1.227 -0.102 0 C-N-CA 123.577 0.751 . . . . 73.129999999999995 109.799 173.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 23.0 mtm180 -54.45 -57.3 11.84 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 118.87 -0.586 . . . . 75.319999999999993 109.531 176.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.58 -33.47 75.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 119.081 0.855 . . . . 74.310000000000002 111.49 -170.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 61.4 t80 -60.29 -55.24 36.11 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.284 1.034 . . . . 73.219999999999999 109.269 169.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.75 -36.7 81.77 Favored 'General case' 0 N--CA 1.462 0.128 0 C-N-CA 125.597 1.559 . . . . 72.400000000000006 113.604 -175.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.2 mt -59.69 -23.28 62.99 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 124.981 1.312 . . . . 75.310000000000002 111.149 -174.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.45 -82.22 0.62 Allowed 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 126.083 1.753 . . . . 74.340000000000003 107.585 178.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . 0.353 8.9 p 44.38 25.77 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 C-N-CA 128.315 2.646 . . . . 63.130000000000003 114.023 -171.308 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 3.6 m -100.79 125.68 54.62 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.855 0 O-C-N 119.042 -2.286 . . . . 73.299999999999997 110.688 178.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.8 t -153.57 -171.68 3.98 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 128.289 2.636 . . . . 55.240000000000002 105.379 170.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.8 m -104.35 74.46 1.18 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.686 1.194 . . . . 73.140000000000001 108.724 -165.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -66.41 102.79 0.92 Allowed 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 121.614 0.721 . . . . 72.409999999999997 112.026 -169.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 51.74 58.46 5.45 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.08 1.752 . . . . 72.099999999999994 109.39 -175.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.81 86.7 7.2 Favored 'General case' 0 N--CA 1.462 0.126 0 C-N-CA 125.062 1.345 . . . . 73.219999999999999 110.485 -175.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 63.79 163.93 0.12 Allowed Pre-proline 0 CA--C 1.546 0.801 0 C-N-CA 126.662 1.985 . . . . 75.430000000000007 112.946 -172.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -82.59 64.85 8.19 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.5 2.134 . . . . 74.230000000000004 112.323 -164.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -171.63 5.87 0.04 OUTLIER Glycine 0 CA--C 1.526 0.763 0 CA-C-O 118.22 -1.322 . . . . 71.329999999999998 114.393 176.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -131.89 23.52 4.6 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 118.79 1.295 . . . . 74.340000000000003 111.645 -167.268 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -60.39 1.22 0.13 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 127.022 2.129 . . . . 75.0 114.36 -174.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -58.91 -23.57 61.38 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.783 1.633 . . . . 73.319999999999993 111.633 -176.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 87.2 t -56.9 -49.02 80.41 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 O-C-N 119.901 -1.75 . . . . 60.229999999999997 110.579 169.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -65.88 -38.73 89.55 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 118.701 -0.666 . . . . 72.200000000000003 110.285 176.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.5 tpt180 -52.41 -56.51 14.55 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 118.349 0.522 . . . . 72.430000000000007 110.026 177.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? -63.28 -50.58 69.57 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 124.101 0.96 . . . . 64.209999999999994 109.459 -178.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 9.1 mt -56.15 -50.59 70.71 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-O 118.342 -0.837 . . . . 72.299999999999997 110.329 -176.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.07 -39.12 92.77 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 119.623 1.101 . . . . 75.040000000000006 112.419 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.36 -25.6 66.06 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 118.756 0.707 . . . . 72.420000000000002 111.498 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.05 -38.03 16.91 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 124.004 0.921 . . . . 71.230000000000004 111.035 174.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 94.3 mt -86.03 37.93 0.74 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.158 1.783 . . . . 71.420000000000002 109.84 175.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -61.65 102.33 0.25 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.472 1.909 . . . . 71.140000000000001 108.386 176.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 89.97 9.85 65.34 Favored Glycine 0 CA--C 1.523 0.569 0 C-N-CA 124.665 1.126 . . . . 72.230000000000004 112.876 -177.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -129.11 -10.95 4.74 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 119.475 1.637 . . . . 73.0 113.019 -173.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -149.27 171.37 16.61 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 119.207 0.912 . . . . 63.310000000000002 111.286 172.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -120.87 165.34 15.33 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 125.01 1.324 . . . . 62.210000000000001 109.973 -171.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -57.03 -26.69 60.73 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 126.842 2.057 . . . . 55.299999999999997 113.576 179.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -109.46 -22.47 12.0 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.885 0.874 . . . . 72.230000000000004 113.056 174.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.8 m -65.6 -37.88 87.87 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 120.562 -1.337 . . . . 54.399999999999999 113.132 -175.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 10.4 mt -69.69 -56.45 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 N-CA-C 107.627 -1.249 . . . . 74.140000000000001 107.627 179.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.51 -36.43 66.68 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 123.172 0.589 . . . . 73.319999999999993 110.979 -174.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.24 -38.89 78.7 Favored 'General case' 0 N--CA 1.443 -0.807 0 O-C-N 123.658 0.599 . . . . 73.310000000000002 110.858 179.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 6.3 tppt? -64.0 -49.66 71.56 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 119.448 1.022 . . . . 73.239999999999995 109.08 -161.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -43.88 97.16 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 113.119 0.785 . . . . 73.030000000000001 113.119 -177.811 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 58.6 t -65.04 -37.02 79.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 C-N-CA 123.985 0.914 . . . . 72.430000000000007 110.772 177.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -66.37 -26.49 67.29 Favored 'General case' 0 C--O 1.237 0.436 0 O-C-N 120.584 -1.322 . . . . 75.230000000000004 112.053 -175.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 45.3 mt -87.48 9.65 20.2 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.081 0.952 . . . . 75.209999999999994 112.322 -167.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 76.2 mtt85 -52.81 -46.62 67.78 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 120.88 1.673 . . . . 73.230000000000004 111.155 175.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -54.56 -66.23 0.44 Allowed 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 125.728 1.611 . . . . 73.030000000000001 109.12 177.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.6 m -48.01 -52.01 21.7 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 126.096 1.758 . . . . 72.400000000000006 110.766 -178.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.7 -36.14 73.75 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.874 1.27 . . . . 74.010000000000005 111.711 -177.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 14.8 ttp180 -59.4 -57.9 10.98 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 119.947 1.249 . . . . 71.040000000000006 108.45 173.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -65.82 -30.56 71.21 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-O 116.574 -1.679 . . . . 75.329999999999998 112.065 -169.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -48.85 -54.53 14.86 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-N 119.898 1.226 . . . . 75.430000000000007 110.237 174.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 18.8 mm -55.97 -47.1 80.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-N 119.684 1.129 . . . . 75.120000000000005 111.56 179.227 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 50.6 mt -66.66 -18.17 23.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 124.329 1.051 . . . . 64.340000000000003 109.569 -178.226 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 1.4 t -115.72 19.42 15.25 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.708 2.003 . . . . 73.420000000000002 110.058 -174.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -130.65 19.72 5.14 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.695 1.998 . . . . 72.329999999999998 110.341 177.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 33.3 mm . . . . . 0 C--O 1.247 0.943 0 CA-C-O 116.788 -1.577 . . . . 73.200000000000003 109.369 177.195 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 34.1 mtt . . . . . 0 N--CA 1.471 0.616 0 N-CA-C 108.86 -0.792 . . . . 73.430000000000007 108.86 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 22.8 p 53.53 175.23 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 127.691 2.396 . . . . 71.510000000000005 115.093 175.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -139.28 88.42 2.27 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 106.494 -1.669 . . . . 75.430000000000007 106.494 178.525 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -136.27 123.48 21.77 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 124.209 1.004 . . . . 74.420000000000002 109.116 -177.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -178.88 -170.71 0.2 Allowed 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 127.242 2.217 . . . . 65.299999999999997 106.589 -159.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.9 t70 61.11 -166.0 0.21 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.55 1.14 . . . . 72.030000000000001 110.357 -177.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 66.7 mtp180 -79.67 151.35 30.55 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 119.695 -1.878 . . . . 74.120000000000005 109.357 171.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.0 tp10 -94.04 -86.28 0.27 Allowed 'General case' 0 CA--C 1.533 0.325 0 O-C-N 123.932 0.77 . . . . 71.400000000000006 109.277 176.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 62.6 mtp180 -149.68 -85.8 0.09 Allowed 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.501 1.121 . . . . 72.109999999999999 108.582 -166.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -164.93 84.37 0.39 Allowed 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.806 1.243 . . . . 61.32 109.316 174.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -80.19 34.3 0.3 Allowed 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 114.125 1.157 . . . . 74.299999999999997 114.125 -175.447 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.465 ' HG3' ' H ' ' A' ' 13' ' ' ALA . 6.1 pt-20 -70.08 -85.54 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.64 1.109 . . . . 65.099999999999994 111.444 -176.151 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.465 ' H ' ' HG3' ' A' ' 12' ' ' GLU . . . -72.1 -11.88 60.95 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.736 -1.228 . . . . 50.399999999999999 112.112 177.176 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 51.2 mmtt -57.68 -22.9 48.66 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 125.026 1.33 . . . . 74.540000000000006 113.528 -178.255 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -60.41 -18.79 53.09 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.561 0.744 . . . . 74.400000000000006 112.796 177.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -125.97 55.29 1.47 Allowed 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.258 1.023 . . . . 65.430000000000007 108.41 168.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -156.05 -55.62 0.09 Allowed 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 118.413 -0.803 . . . . 72.099999999999994 111.206 -179.027 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -117.19 122.6 44.5 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 119.093 0.86 . . . . 71.530000000000001 110.357 -165.018 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.41 -32.51 66.93 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 125.952 1.701 . . . . 64.129999999999995 112.893 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -63.28 -52.8 60.54 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 123.447 0.699 . . . . 72.230000000000004 111.439 -179.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 44.2 mt -71.97 -39.99 68.95 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 108.463 -0.939 . . . . 71.140000000000001 108.463 -176.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -47.11 -48.31 23.01 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 117.36 -1.305 . . . . 71.209999999999994 111.475 166.325 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -64.79 -48.39 74.63 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 120.419 1.463 . . . . 64.530000000000001 110.803 177.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -50.42 -42.37 53.75 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 121.514 -0.741 . . . . 74.209999999999994 110.798 175.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -90.65 -9.58 46.35 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 125.343 1.457 . . . . 62.100000000000001 114.615 -177.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.07 -41.37 82.02 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 119.723 1.147 . . . . 71.400000000000006 110.552 -174.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -117.48 -85.26 0.64 Allowed 'General case' 0 N--CA 1.442 -0.84 0 N-CA-C 106.266 -1.753 . . . . 72.510000000000005 106.266 -160.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.346 0.0 OUTLIER 48.56 -1.41 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 117.652 2.464 . . . . 72.400000000000006 117.652 171.099 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 -80.13 4.96 15.66 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 121.358 1.89 . . . . 73.299999999999997 112.111 -177.267 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -130.65 -26.98 2.18 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-O 117.31 -1.329 . . . . 73.129999999999995 111.044 178.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.83 -55.01 7.16 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 120.686 1.585 . . . . 74.430000000000007 108.894 175.368 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.01 -13.71 18.23 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 126.41 1.884 . . . . 74.310000000000002 115.266 -175.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 29.6 tp -71.38 -32.59 68.65 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 120.782 -1.199 . . . . 71.400000000000006 110.262 -172.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.01 -34.82 90.94 Favored Glycine 0 CA--C 1.529 0.948 0 N-CA-C 110.949 -0.861 . . . . 74.340000000000003 110.949 173.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.32 -19.14 65.82 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.754 1.277 . . . . 64.420000000000002 111.406 -173.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 19.9 t90 -74.4 -75.71 0.15 Allowed 'General case' 0 C--N 1.341 0.227 0 N-CA-C 107.946 -1.131 . . . . 71.140000000000001 107.946 169.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -54.7 -29.3 52.69 Favored 'General case' 0 C--O 1.222 -0.356 0 C-N-CA 125.139 1.375 . . . . 73.040000000000006 112.722 -171.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -45.08 -53.75 7.55 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.903 1.229 . . . . 70.450000000000003 111.222 169.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.4 -33.52 87.46 Favored Glycine 0 CA--C 1.532 1.109 0 O-C-N 121.95 -0.469 . . . . 74.450000000000003 112.01 -177.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.4 mp -66.12 -50.93 62.31 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.608 1.563 . . . . 71.439999999999998 109.588 173.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.7 mp -62.99 -28.45 70.1 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 125.498 1.519 . . . . 74.209999999999994 113.072 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 108.92 20.82 7.78 Favored Glycine 0 CA--C 1.527 0.802 0 C-N-CA 124.892 1.234 . . . . 72.120000000000005 112.878 -179.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.0 mttt -106.83 135.66 47.99 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 125.794 1.638 . . . . 74.25 107.944 178.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 17.5 p -138.29 154.22 49.03 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 124.458 1.103 . . . . 73.109999999999999 108.789 -176.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 49.94 -118.06 5.38 Favored Glycine 0 CA--C 1.523 0.555 0 N-CA-C 111.214 -0.754 . . . . 72.340000000000003 111.214 173.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -57.71 -36.86 72.58 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.765 1.626 . . . . 72.140000000000001 113.313 -177.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -68.01 -45.85 72.88 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 122.024 0.916 . . . . 75.239999999999995 109.851 177.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.92 -32.53 74.08 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.695 0.798 . . . . 70.319999999999993 110.475 177.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.7 ttm180 -54.88 -52.12 63.82 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 124.332 1.053 . . . . 74.140000000000001 111.266 178.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.47 -41.22 96.9 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-O 121.671 0.748 . . . . 74.230000000000004 110.988 -179.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -65.14 -37.65 88.09 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 121.252 0.549 . . . . 74.340000000000003 111.396 178.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.09 -1.47 5.99 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.169 1.387 . . . . 34.420000000000002 112.596 177.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 35.7 mt -106.83 7.96 30.49 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.895 1.678 . . . . 65.109999999999999 111.106 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.0 t -141.21 19.94 2.26 Favored 'General case' 0 CA--C 1.543 0.673 0 O-C-N 121.409 -0.807 . . . . 74.430000000000007 112.963 -174.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 25.8 t -130.84 73.49 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 O-C-N 120.445 -1.409 . . . . 73.430000000000007 107.884 178.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 79.9 t -142.15 124.72 14.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 C-N-CA 124.155 0.982 . . . . 74.010000000000005 108.959 175.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.7 t -155.2 -55.66 0.09 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 106.033 -1.839 . . . . 61.399999999999999 106.033 169.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.32 88.38 0.09 Allowed 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 122.385 1.088 . . . . 72.420000000000002 109.871 -166.006 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -146.28 158.19 43.86 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 107.537 -1.283 . . . . 64.230000000000004 107.537 148.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -158.92 -164.68 1.47 Allowed 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 104.501 -2.407 . . . . 73.230000000000004 104.501 170.702 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 66.33 -155.75 0.25 Allowed 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 120.207 1.367 . . . . 65.230000000000004 109.231 -179.481 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 65.58 167.49 0.11 Allowed Pre-proline 0 CA--C 1.556 1.188 0 CA-C-N 120.706 1.594 . . . . 72.200000000000003 110.853 -178.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -61.47 172.15 3.71 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 CA-C-N 121.211 1.468 . . . . 71.430000000000007 109.855 162.275 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -67.48 92.51 0.22 Allowed Glycine 0 CA--C 1.522 0.515 0 N-CA-C 110.368 -1.093 . . . . 63.32 110.368 -176.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.48 -14.57 32.48 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 118.945 1.372 . . . . 75.010000000000005 111.576 175.343 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 49.44 55.86 8.7 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.544 1.938 . . . . 75.420000000000002 111.049 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -111.12 -58.65 2.08 Favored 'General case' 0 CA--C 1.522 -0.12 0 O-C-N 121.949 -0.47 . . . . 72.409999999999997 110.349 -177.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 85.6 t -84.74 -39.66 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 O-C-N 121.528 -0.733 . . . . 73.040000000000006 111.199 -175.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -74.4 -25.15 59.29 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.503 -0.748 . . . . 72.340000000000003 111.553 179.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.7 ttm180 -44.88 -67.77 0.26 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.065 1.746 . . . . 74.049999999999997 112.848 -174.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.409 ' H ' ' CD ' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -55.13 -46.75 75.66 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 126.087 1.755 . . . . 72.340000000000003 110.115 -177.01 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.65 -57.44 11.94 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 125.267 1.427 . . . . 71.209999999999994 110.189 -177.392 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.59 -36.64 84.33 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.998 0.519 . . . . 74.430000000000007 110.906 -175.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.82 -47.07 85.02 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.828 0.451 . . . . 62.420000000000002 111.148 176.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.06 -48.85 78.39 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 124.906 1.283 . . . . 75.430000000000007 109.873 179.332 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 11.8 tp -100.84 14.65 31.05 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 125.819 1.647 . . . . 74.340000000000003 112.959 -159.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -47.01 119.81 2.74 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 127.315 2.246 . . . . 63.25 110.987 -174.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 86.53 -1.74 87.27 Favored Glycine 0 CA--C 1.524 0.614 0 C-N-CA 124.657 1.122 . . . . 74.349999999999994 113.571 175.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -124.73 0.47 8.09 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 118.675 1.237 . . . . 70.219999999999999 110.512 -174.579 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -148.98 176.14 10.69 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 125.86 1.664 . . . . 51.109999999999999 109.794 171.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -135.69 162.02 33.91 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 126.45 1.9 . . . . 74.239999999999995 107.14 -177.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.43 -55.29 30.29 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 124.926 1.29 . . . . 70.209999999999994 111.409 178.499 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -68.7 -31.45 70.56 Favored 'General case' 0 C--O 1.225 -0.201 0 O-C-N 121.529 -0.732 . . . . 74.239999999999995 111.008 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 77.0 m -66.23 -39.48 89.59 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 118.751 -0.643 . . . . 73.409999999999997 109.286 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 75.0 mt -65.62 -48.32 83.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-N 119.795 1.18 . . . . 74.420000000000002 108.89 175.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.6 ppt_? -63.43 -36.81 84.97 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 118.771 -0.633 . . . . 73.329999999999998 110.818 -175.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.49 -54.62 21.88 Favored 'General case' 0 N--CA 1.445 -0.72 0 C-N-CA 124.244 1.018 . . . . 70.409999999999997 109.312 174.442 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 10.7 tptt -50.07 -51.88 39.01 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 118.828 0.74 . . . . 74.099999999999994 110.62 -171.027 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 12.6 ptp -64.19 -29.56 70.66 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 120.049 -0.66 . . . . 72.319999999999993 112.27 -175.312 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 89.2 t -79.58 -28.34 12.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 124.159 0.984 . . . . 74.430000000000007 111.072 174.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -54.0 -51.58 63.48 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 121.217 1.826 . . . . 64.010000000000005 110.432 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.31 6.12 4.84 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.828 0.677 . . . . 65.299999999999997 112.828 -174.167 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 36.2 ttm180 -47.64 -41.12 21.48 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.306 1.442 . . . . 73.329999999999998 112.516 -174.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -96.96 -27.39 14.66 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 113.268 0.84 . . . . 73.439999999999998 113.268 173.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 44.5 m -59.33 -35.61 74.14 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 120.467 -1.395 . . . . 71.019999999999996 110.962 177.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -51.44 -45.01 62.5 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.189 0.996 . . . . 73.120000000000005 112.246 -177.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.47 -27.21 67.63 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-O 119.167 -0.444 . . . . 72.0 112.09 -178.065 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -80.11 -38.55 31.37 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 109.105 -0.702 . . . . 74.109999999999999 109.105 -178.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -55.94 -44.57 78.54 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-O 117.636 -1.173 . . . . 72.409999999999997 112.84 -176.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 20.0 mm -56.1 -49.27 76.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 120.234 1.379 . . . . 74.439999999999998 108.729 178.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 53.7 mt -69.93 -7.04 7.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 C-N-CA 125.245 1.418 . . . . 72.109999999999999 111.453 178.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 9.5 t -117.45 21.38 13.09 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.853 2.061 . . . . 74.340000000000003 110.767 178.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 -119.53 13.39 12.56 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.926 2.091 . . . . 72.439999999999998 108.604 176.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.255 1.363 0 N-CA-C 108.273 -1.01 . . . . 74.409999999999997 108.273 177.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.0 mtm . . . . . 0 N--CA 1.471 0.623 0 N-CA-C 107.531 -1.285 . . . . 73.530000000000001 107.531 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.89 20.02 3.5 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 119.67 1.123 . . . . 72.230000000000004 111.824 -163.506 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 63.48 -173.44 0.16 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.39 1.476 . . . . 74.340000000000003 110.374 -169.562 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -59.68 154.23 18.38 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 124.588 1.155 . . . . 74.409999999999997 109.578 167.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -85.86 156.47 20.53 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 107.48 -1.304 . . . . 51.439999999999998 107.48 151.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -147.6 -60.66 0.27 Allowed 'General case' 0 C--O 1.235 0.34 0 N-CA-C 106.355 -1.72 . . . . 72.140000000000001 106.355 -179.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 26.0 ptt-85 -53.63 164.82 0.48 Allowed 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 126.777 2.031 . . . . 73.420000000000002 111.444 162.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -68.23 -81.71 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.659 0.784 . . . . 74.099999999999994 110.258 174.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 32.6 mtp180 -147.17 -70.46 0.23 Allowed 'General case' 0 N--CA 1.465 0.321 0 O-C-N 121.221 -0.924 . . . . 73.019999999999996 109.815 -157.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 44.69 73.92 0.14 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 127.716 2.406 . . . . 74.129999999999995 111.224 -176.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -132.83 -163.45 1.35 Allowed 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 127.086 2.155 . . . . 75.099999999999994 107.942 178.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . 0.256 12.9 pt-20 49.69 81.72 0.06 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.911 1.685 . . . . 74.310000000000002 111.461 -176.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.42 39.64 14.9 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 126.288 1.835 . . . . 64.109999999999999 112.756 -177.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.3 mmtt -107.38 -9.46 16.01 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 125.166 1.386 . . . . 75.200000000000003 112.487 -178.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -51.15 -31.22 19.08 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.006 1.322 . . . . 75.120000000000005 113.817 176.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.33 -8.11 29.86 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.438 1.095 . . . . 75.099999999999994 113.169 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 18.0 t-80 -117.88 161.2 20.14 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 126.648 1.979 . . . . 71.340000000000003 107.63 -175.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 58.18 -158.07 0.29 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.405 1.082 . . . . 75.129999999999995 109.133 177.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -136.33 -34.11 0.79 Allowed 'General case' 0 C--O 1.223 -0.312 0 C-N-CA 124.277 1.031 . . . . 74.200000000000003 109.222 159.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -45.92 -40.36 10.07 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 125.074 1.35 . . . . 74.299999999999997 111.939 177.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 18.7 mt -66.16 -39.45 89.8 Favored 'General case' 0 C--N 1.331 -0.201 0 O-C-N 120.936 -1.102 . . . . 73.540000000000006 110.918 -175.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -76.76 -26.64 54.76 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.365 1.466 . . . . 72.299999999999997 110.611 174.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -55.36 -39.88 70.61 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.811 1.244 . . . . 72.310000000000002 111.229 -169.697 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.1 ptmt -54.38 -46.5 73.07 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 120.692 -1.255 . . . . 73.530000000000001 111.259 175.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.38 -58.71 5.22 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 125.693 1.597 . . . . 74.0 110.847 179.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -67.82 -3.45 9.6 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.06 0.763 . . . . 60.509999999999998 113.06 -176.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -116.38 11.41 14.97 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.675 1.99 . . . . 64.310000000000002 112.888 171.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.6 mmt-85 -74.84 -14.42 60.68 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 119.626 -1.921 . . . . 74.340000000000003 112.543 175.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -47.17 -72.41 0.05 Allowed 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 127.37 2.268 . . . . 74.109999999999999 112.819 -163.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -74.13 -5.91 44.55 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 120.76 1.618 . . . . 75.209999999999994 112.993 -177.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.14 -34.98 66.4 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 121.143 1.792 . . . . 74.439999999999998 111.624 -177.027 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.25 -11.76 58.47 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 112.464 0.542 . . . . 74.230000000000004 112.464 -175.674 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -66.93 -22.26 65.95 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 126.103 1.761 . . . . 74.120000000000005 114.239 -171.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -70.08 -31.75 69.38 Favored Glycine 0 C--O 1.224 -0.487 0 C-N-CA 120.608 -0.806 . . . . 74.0 111.301 -179.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 75.4 mt-10 -64.65 -33.58 76.26 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 124.035 0.934 . . . . 74.310000000000002 111.517 -172.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 9.0 t90 -58.07 -77.74 0.03 OUTLIER 'General case' 0 C--O 1.233 0.194 0 C-N-CA 124.518 1.127 . . . . 75.230000000000004 108.08 168.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -57.28 -29.18 63.64 Favored 'General case' 0 C--O 1.218 -0.565 0 C-N-CA 125.886 1.674 . . . . 74.439999999999998 112.745 -168.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -46.16 -54.56 8.45 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 120.321 1.419 . . . . 74.140000000000001 112.038 176.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -57.86 -40.42 93.05 Favored Glycine 0 CA--C 1.531 1.033 0 CA-C-N 118.707 0.685 . . . . 74.129999999999995 111.443 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.4 mp -63.06 -42.58 99.74 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.364 1.466 . . . . 74.120000000000005 110.362 178.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.5 mp -70.08 -0.58 7.93 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 127.899 2.479 . . . . 72.129999999999995 113.198 172.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 71.96 25.54 74.54 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 124.862 1.22 . . . . 71.140000000000001 112.523 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 45.1 mttt -107.98 148.51 29.6 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 125.329 1.452 . . . . 74.530000000000001 108.629 174.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.0 p -142.95 166.78 23.7 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-O 121.283 0.563 . . . . 71.239999999999995 110.767 171.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 67.13 -113.69 5.79 Favored Glycine 0 N--CA 1.444 -0.793 0 C-N-CA 124.881 1.229 . . . . 74.150000000000006 110.965 168.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -73.44 -41.85 62.71 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.207 -0.497 . . . . 71.340000000000003 111.304 -171.236 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.22 -36.37 82.87 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 110.158 -0.312 . . . . 74.209999999999994 110.158 178.19 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.54 -43.81 93.41 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 122.91 0.484 . . . . 73.349999999999994 110.86 173.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.7 ttt180 -65.27 -47.77 75.51 Favored 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 124.221 1.008 . . . . 74.209999999999994 108.959 179.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.83 -48.13 78.04 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 118.888 -0.577 . . . . 72.450000000000003 110.354 -176.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 45.4 t80 -50.6 -52.6 37.73 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 124.157 0.983 . . . . 74.310000000000002 110.03 172.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.56 -26.55 55.4 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 113.219 0.822 . . . . 74.439999999999998 113.219 178.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 16.3 mt -76.35 -16.95 59.63 Favored 'General case' 0 C--N 1.333 -0.148 0 O-C-N 120.63 -1.294 . . . . 73.200000000000003 111.486 -175.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.6 t -121.26 -8.09 9.25 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 119.965 1.257 . . . . 73.540000000000006 112.664 -172.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 4.7 p -73.19 3.04 1.02 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.095 0 N-CA-C 115.53 1.678 . . . . 63.299999999999997 115.53 -173.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 70.4 t -78.14 110.49 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 O-C-N 119.261 -2.149 . . . . 73.109999999999999 109.315 -168.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.7 p -79.82 -85.98 0.08 Allowed 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.611 1.165 . . . . 74.340000000000003 110.823 177.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.4 t -161.42 -86.48 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 107.053 -1.462 . . . . 72.430000000000007 107.053 -176.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -170.75 162.38 7.66 Favored 'General case' 0 C--N 1.343 0.291 0 C-N-CA 124.476 1.111 . . . . 60.409999999999997 111.131 173.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -83.02 -176.43 6.33 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.89 1.276 . . . . 75.540000000000006 111.894 175.169 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 74.56 -176.98 0.15 Allowed 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 128.76 2.824 . . . . 75.420000000000002 109.575 -166.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 64.73 79.82 0.24 Allowed Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 126.531 1.932 . . . . 64.129999999999995 112.183 166.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.44 95.91 0.47 Allowed 'Trans proline' 0 N--CA 1.458 -0.612 0 C-N-CA 123.304 2.669 . . . . 61.43 110.136 -174.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 178.53 -49.69 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.407 0 CA-C-O 118.473 -1.181 . . . . 72.299999999999997 111.295 176.227 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -52.22 -49.85 63.14 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 125.853 1.661 . . . . 71.5 110.489 -169.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.558 ' CG ' ' H ' ' A' ' 67' ' ' ASP 0.271 10.5 tt0 59.85 -164.05 0.22 Allowed 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 125.042 1.337 . . . . 72.109999999999999 108.906 -169.417 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.558 ' H ' ' CG ' ' A' ' 66' ' ' GLU 0.299 44.0 m-20 67.77 -48.05 0.51 Allowed 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 129.978 3.311 . . . . 55.039999999999999 112.277 -172.082 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.4 t -48.96 -61.61 0.54 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 C-N-CA 125.628 1.571 . . . . 75.510000000000005 111.13 177.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -71.08 -42.35 69.48 Favored 'General case' 0 CA--C 1.527 0.061 0 C-N-CA 123.611 0.764 . . . . 72.530000000000001 110.647 177.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -51.84 -50.25 61.26 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.365 1.066 . . . . 64.340000000000003 110.334 -173.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -67.95 -37.8 82.02 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 118.874 -0.584 . . . . 72.209999999999994 110.672 -175.404 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.89 -52.46 56.4 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-N 119.062 0.846 . . . . 73.329999999999998 110.276 174.853 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.24 -21.06 65.99 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.629 1.104 . . . . 61.340000000000003 112.365 -177.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.99 -63.7 1.01 Allowed 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.892 0.877 . . . . 75.230000000000004 110.606 166.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.61 -21.71 66.6 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.859 0.863 . . . . 71.409999999999997 112.698 -174.049 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.3 tp -113.1 19.29 17.3 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.918 2.487 . . . . 75.120000000000005 110.79 -171.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -51.23 110.24 0.42 Allowed 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.586 1.954 . . . . 62.210000000000001 108.821 171.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 94.62 0.14 64.85 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 125.187 1.375 . . . . 72.109999999999999 114.319 178.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.6 7.45 5.28 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.956 1.702 . . . . 72.430000000000007 111.5 178.803 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -135.21 176.98 8.17 Favored 'General case' 0 C--O 1.233 0.234 0 O-C-N 120.87 -1.144 . . . . 52.409999999999997 111.116 177.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -138.24 168.62 19.36 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 114.168 -1.378 . . . . 73.420000000000002 107.659 158.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 87.5 mt-10 -66.09 -19.19 65.77 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 112.195 -2.275 . . . . 75.219999999999999 111.442 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -110.15 -8.93 14.72 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.022 0.828 . . . . 75.109999999999999 111.403 177.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.1 m -84.2 -41.36 17.06 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.641 -0.662 . . . . 72.239999999999995 110.678 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 79.5 mt -60.2 -44.63 95.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-N 119.727 1.149 . . . . 62.439999999999998 109.504 -179.018 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -58.71 -24.94 62.36 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 118.34 0.518 . . . . 75.299999999999997 112.218 178.208 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -94.12 -5.52 47.05 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 118.548 -0.739 . . . . 74.299999999999997 111.943 -178.721 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -93.23 -64.52 1.08 Allowed 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 120.046 1.293 . . . . 72.329999999999998 110.154 173.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 2.0 mtm -64.71 -29.09 70.07 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 119.597 -0.841 . . . . 75.540000000000006 111.62 -161.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 27.4 t -63.51 -47.53 91.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 125.106 1.362 . . . . 73.510000000000005 110.795 176.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -59.65 -45.99 90.35 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 119.301 0.955 . . . . 54.420000000000002 111.23 -170.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.3 mt -72.38 -0.74 13.21 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 125.126 1.37 . . . . 74.200000000000003 110.704 -167.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 45.3 ttt180 -51.17 -38.6 53.1 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 124.254 1.022 . . . . 75.420000000000002 110.764 164.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.01 -53.31 40.25 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.974 0.807 . . . . 75.109999999999999 110.711 176.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.0 m -54.7 -31.27 57.74 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.027 1.731 . . . . 72.010000000000005 111.283 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.7 -53.37 59.12 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.431 1.092 . . . . 74.299999999999997 112.313 -178.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -70.43 -37.55 74.41 Favored 'General case' 0 CA--C 1.519 -0.229 0 C-N-CA 120.053 -0.659 . . . . 71.140000000000001 110.991 179.232 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -59.0 -46.29 88.55 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-O 118.072 -0.966 . . . . 71.129999999999995 111.488 -174.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -59.62 -31.98 69.99 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 119.029 0.831 . . . . 63.020000000000003 112.791 -174.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 27.2 mm -73.39 -38.2 52.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 O-C-N 121.224 -0.922 . . . . 75.099999999999994 110.374 177.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 82.3 mt -74.76 -13.63 15.54 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 C-N-CA 124.187 0.995 . . . . 74.099999999999994 109.191 177.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 16.1 t -85.62 -40.82 15.81 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.213 1.405 . . . . 72.400000000000006 108.154 174.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -128.71 65.61 1.42 Allowed 'General case' 0 C--O 1.239 0.541 0 C-N-CA 124.745 1.218 . . . . 74.010000000000005 107.781 -169.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 5.1 mp . . . . . 0 C--O 1.253 1.286 0 N-CA-C 107.403 -1.332 . . . . 74.439999999999998 107.403 176.499 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.2 mtt . . . . . 0 N--CA 1.469 0.492 0 N-CA-C 106.863 -1.532 . . . . 61.409999999999997 106.863 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.4 t -103.31 -25.45 13.31 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.854 1.262 . . . . 73.120000000000005 111.923 -161.511 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.2 m 44.95 44.57 8.12 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.641 1.576 . . . . 73.099999999999994 112.559 175.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 47.26 70.41 0.41 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 126.827 2.051 . . . . 73.400000000000006 111.499 -168.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -60.82 141.71 56.79 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 123.42 0.688 . . . . 53.009999999999998 109.522 -178.606 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -152.63 -85.27 0.07 Allowed 'General case' 0 N--CA 1.445 -0.724 0 CA-C-O 118.773 -0.632 . . . . 72.230000000000004 110.015 -173.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 71.7 mtm180 -117.27 60.08 0.76 Allowed 'General case' 0 CA--C 1.518 -0.285 0 C-N-CA 125.201 1.4 . . . . 74.400000000000006 107.557 -175.035 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -65.9 -29.52 69.97 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.721 1.209 . . . . 73.219999999999999 112.209 -175.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.8 -164.76 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.542 1.537 . . . . 72.400000000000006 113.434 178.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 57.22 46.76 18.19 Favored 'General case' 0 C--O 1.227 -0.101 0 C-N-CA 127.026 2.131 . . . . 65.239999999999995 111.488 -176.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -64.53 1.36 0.83 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 114.39 1.256 . . . . 73.400000000000006 114.39 167.242 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -50.94 98.38 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 127.232 2.213 . . . . 72.510000000000005 110.676 179.469 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 53.05 11.85 0.25 Allowed 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 115.846 1.795 . . . . 72.430000000000007 115.846 -171.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 54.3 mttt -84.71 -4.04 58.84 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 124.691 1.197 . . . . 72.5 113.192 177.153 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -55.18 -30.36 59.74 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 120.927 1.694 . . . . 73.239999999999995 112.445 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -77.76 5.51 9.28 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.749 1.018 . . . . 70.5 113.749 179.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 10.2 t-80 -143.47 176.61 9.05 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.607 1.563 . . . . 64.219999999999999 109.472 -176.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 62.76 -171.8 0.16 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.87 1.668 . . . . 73.239999999999995 111.992 165.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -118.3 -35.82 3.71 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 124.713 1.205 . . . . 73.129999999999995 110.001 171.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.3 mp0 -45.08 -50.25 11.12 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 127.409 2.284 . . . . 74.439999999999998 112.327 -172.612 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.638 ' CD2' ' H ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER -75.23 -44.18 47.63 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 124.255 1.022 . . . . 74.420000000000002 111.568 -176.882 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -57.51 -44.97 85.44 Favored 'General case' 0 C--O 1.219 -0.527 0 C-N-CA 125.017 1.327 . . . . 73.209999999999994 109.988 178.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.72 -48.22 66.81 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.006 1.322 . . . . 73.239999999999995 110.249 -177.868 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 42.3 mttp -61.48 -57.65 11.32 Favored 'General case' 0 C--O 1.232 0.175 0 O-C-N 121.584 -0.697 . . . . 72.510000000000005 110.352 171.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -71.98 -16.16 62.07 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 114.248 1.203 . . . . 71.040000000000006 114.248 -165.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -62.48 -50.82 69.92 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 127.561 2.344 . . . . 74.030000000000001 108.783 167.027 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.57 16.95 17.4 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 114.333 1.234 . . . . 65.200000000000003 114.333 -145.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -109.86 -6.97 15.07 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 116.301 1.963 . . . . 73.129999999999995 116.301 -154.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.9 ptt180 -62.64 -16.62 57.71 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 121.375 1.898 . . . . 73.230000000000004 115.319 -170.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -116.95 -13.4 10.64 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 126.346 1.859 . . . . 70.109999999999999 112.636 173.248 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.1 -8.32 11.64 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 121.575 1.989 . . . . 74.219999999999999 113.625 -175.583 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -104.68 -3.2 23.98 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 126.457 1.903 . . . . 73.120000000000005 114.697 179.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 35.6 tp -68.71 -35.3 76.99 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 123.759 0.824 . . . . 74.120000000000005 111.043 -176.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -57.09 -42.87 93.36 Favored Glycine 0 C--O 1.221 -0.715 0 CA-C-O 118.78 -1.011 . . . . 53.219999999999999 110.72 166.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -64.77 -16.74 63.42 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 118.924 1.362 . . . . 74.329999999999998 112.369 -176.041 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 14.2 t90 -80.64 -63.7 1.35 Allowed 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.955 0.902 . . . . 74.129999999999995 109.137 164.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.7 -29.67 27.94 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.577 1.551 . . . . 63.119999999999997 114.189 -174.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.02 -61.51 2.22 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 125.927 1.691 . . . . 65.200000000000003 111.385 -177.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.85 -15.53 58.09 Favored Glycine 0 CA--C 1.531 1.082 0 CA-C-N 118.709 0.686 . . . . 71.040000000000006 113.153 -177.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 19.8 mt -76.69 -43.91 35.81 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.789 1.236 . . . . 72.200000000000003 109.215 173.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 24.2 mt -71.33 1.66 5.89 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.955 2.102 . . . . 70.200000000000003 112.001 165.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.05 0.5 44.02 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.763 1.649 . . . . 65.200000000000003 114.278 -177.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -65.51 127.52 32.17 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 125.386 1.474 . . . . 72.340000000000003 107.431 173.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.6 p -140.69 147.52 39.38 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.408 -0.59 . . . . 73.040000000000006 109.408 -179.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 82.27 -129.89 9.35 Favored Glycine 0 C--N 1.33 0.23 0 N-CA-C 111.17 -0.772 . . . . 74.319999999999993 111.17 172.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -70.04 -28.31 65.36 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.353 -0.61 . . . . 71.040000000000006 109.353 179.305 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -62.49 -41.29 98.7 Favored 'General case' 0 CA--C 1.514 -0.424 0 C-N-CA 125.181 1.392 . . . . 71.230000000000004 111.131 177.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.85 -57.26 7.35 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 107.385 -1.339 . . . . 72.409999999999997 107.385 172.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.07 -51.85 29.06 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 118.62 0.645 . . . . 74.200000000000003 112.116 -175.449 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.47 -38.65 90.64 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.009 1.323 . . . . 74.420000000000002 111.799 -179.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -62.73 -44.1 97.08 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.923 0.889 . . . . 74.420000000000002 110.289 174.392 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.4 -27.11 68.78 Favored 'General case' 0 CA--C 1.53 0.182 0 O-C-N 121.299 -0.875 . . . . 74.400000000000006 112.992 -176.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 9.2 mt -60.28 -49.02 79.27 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 119.031 0.832 . . . . 71.319999999999993 108.861 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.5 t -76.25 6.19 5.85 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 125.155 1.382 . . . . 74.329999999999998 112.04 179.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 98.6 t -119.48 94.04 2.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 C-N-CA 125.355 1.462 . . . . 73.109999999999999 108.41 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.5 p -140.93 157.46 22.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 106.533 -1.654 . . . . 73.010000000000005 106.533 155.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 13.4 t -171.49 -170.77 0.84 Allowed 'General case' 0 C--O 1.239 0.547 0 C-N-CA 126.233 1.813 . . . . 53.5 106.562 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 49.1 m -134.91 46.85 2.4 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.224 1.41 . . . . 73.0 110.07 -177.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -60.23 149.53 32.9 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 123.367 0.667 . . . . 73.010000000000005 111.92 -176.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 52.32 158.58 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 131.053 3.741 . . . . 74.239999999999995 112.615 -173.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 68.31 -24.46 0.13 Allowed 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 125.672 1.589 . . . . 70.310000000000002 113.328 -176.879 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -67.17 157.0 86.62 Favored Pre-proline 0 C--O 1.242 0.676 0 CA-C-N 119.308 0.958 . . . . 72.230000000000004 110.512 162.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -85.27 63.94 6.0 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 123.122 2.548 . . . . 73.400000000000006 111.865 -166.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -132.07 -170.99 12.7 Favored Glycine 0 CA--C 1.525 0.704 0 C-N-CA 126.472 1.987 . . . . 65.030000000000001 109.61 178.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -120.66 -74.76 0.6 Allowed 'General case' 0 C--O 1.233 0.228 0 N-CA-C 107.498 -1.297 . . . . 70.340000000000003 107.498 176.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -106.64 4.08 27.53 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.958 1.303 . . . . 74.120000000000005 112.431 178.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -72.81 -15.25 61.63 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.908 1.283 . . . . 45.43 113.749 -151.287 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 67.5 t -106.33 -41.57 6.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 O-C-N 120.331 -1.481 . . . . 73.400000000000006 109.684 168.266 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -49.6 -37.59 28.36 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.282 1.033 . . . . 74.230000000000004 111.438 176.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.0 -28.25 16.3 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.647 1.579 . . . . 72.140000000000001 113.932 175.329 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -86.25 -41.6 14.48 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 108.529 -0.915 . . . . 62.100000000000001 108.529 -176.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.21 -52.82 11.26 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.407 0.683 . . . . 74.340000000000003 110.728 -178.722 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.34 -21.92 66.75 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 125.17 1.388 . . . . 74.010000000000005 111.356 -175.362 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.25 -41.84 96.77 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 118.461 0.573 . . . . 73.219999999999999 111.001 169.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.02 -53.33 15.15 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 107.954 -1.128 . . . . 70.239999999999995 107.954 177.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 65.5 mt -83.91 33.12 0.48 Allowed 'General case' 0 C--O 1.233 0.218 0 C-N-CA 125.551 1.54 . . . . 74.319999999999993 111.794 -179.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -67.64 121.06 15.08 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 106.429 -1.693 . . . . 74.329999999999998 106.429 175.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 85.44 -0.27 88.4 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 124.977 1.275 . . . . 74.120000000000005 113.756 -173.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -135.6 -5.28 2.25 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 118.744 1.272 . . . . 73.439999999999998 113.224 -161.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -164.07 122.4 1.85 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-N 119.99 1.268 . . . . 65.230000000000004 110.531 179.024 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.85 161.27 29.13 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.334 1.054 . . . . 64.0 108.896 175.196 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -49.08 -52.66 24.41 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 126.01 1.724 . . . . 73.329999999999998 108.664 165.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -66.78 -8.39 28.05 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.177 1.391 . . . . 72.120000000000005 112.225 -171.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 17.9 m -111.88 -44.18 3.5 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 126.512 1.925 . . . . 73.439999999999998 110.319 -179.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 74.5 mt -52.46 -56.46 6.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-N 119.654 1.115 . . . . 74.340000000000003 108.276 172.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -56.5 -29.95 62.43 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 123.515 0.726 . . . . 74.310000000000002 112.015 -175.125 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -84.16 -50.18 8.16 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 124.435 1.094 . . . . 65.239999999999995 109.242 -174.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.8 tppt? -60.17 -36.36 77.4 Favored 'General case' 0 N--CA 1.463 0.19 0 O-C-N 121.749 -0.594 . . . . 72.329999999999998 111.313 -173.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 28.7 mtt -54.26 -52.81 60.2 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.864 0.466 . . . . 71.040000000000006 109.775 173.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 79.3 t -61.78 -30.65 48.88 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 125.376 1.47 . . . . 74.0 110.854 -177.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 62.1 tt0 -69.5 -52.4 26.87 Favored 'General case' 0 CA--C 1.53 0.186 0 O-C-N 121.062 -1.024 . . . . 71.310000000000002 110.274 174.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 38.9 mt -67.52 -24.86 65.61 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.309 1.044 . . . . 73.420000000000002 110.44 -176.284 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 42.0 ttp180 -56.93 -33.39 66.93 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 124.955 1.302 . . . . 72.109999999999999 110.605 174.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -68.26 -47.88 66.53 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 118.533 -0.746 . . . . 74.239999999999995 111.11 177.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 31.0 m -56.0 -81.87 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 126.582 1.953 . . . . 71.329999999999998 110.098 -178.305 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 43.55 -75.03 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.306 1 C-N-CA 132.874 4.47 . . . . 74.409999999999997 113.983 165.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 20.0 ptt-85 -66.6 -40.24 88.77 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.235 -0.893 . . . . 74.230000000000004 109.727 -177.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -59.78 -36.16 76.13 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-O 117.973 -1.013 . . . . 71.140000000000001 110.589 -177.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -57.98 -42.18 84.56 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 118.981 0.81 . . . . 74.230000000000004 111.291 -177.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 24.1 mm -56.81 -45.49 83.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-N 119.775 1.171 . . . . 74.329999999999998 109.6 176.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 27.8 mt -74.15 -17.53 16.99 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 C-N-CA 124.379 1.072 . . . . 74.530000000000001 110.075 -177.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 21.0 t -87.38 -0.9 57.46 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.142 1.777 . . . . 74.120000000000005 110.578 172.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 78.8 mt-10 -132.12 42.61 3.12 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 126.325 1.85 . . . . 74.329999999999998 107.536 -166.143 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.0 mt . . . . . 0 C--O 1.251 1.18 0 N-CA-C 105.328 -2.101 . . . . 74.430000000000007 105.328 169.647 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.471 0.602 0 N-CA-C 106.843 -1.54 . . . . 75.530000000000001 106.843 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.3 m -150.5 101.34 2.95 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 107.843 -1.169 . . . . 64.109999999999999 107.843 -174.044 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 10.9 p -140.27 120.85 14.21 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 123.958 0.903 . . . . 74.219999999999999 108.587 -173.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -159.32 174.13 15.23 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.379 1.472 . . . . 74.5 107.916 170.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -64.86 -168.53 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 129.544 3.138 . . . . 75.409999999999997 113.179 -176.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -56.66 115.43 2.54 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 125.295 1.438 . . . . 62.200000000000003 111.426 -177.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.8 mtm180 -122.08 165.59 15.82 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 125.974 1.71 . . . . 74.400000000000006 108.618 -178.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.62 169.78 3.7 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 124.954 1.302 . . . . 73.099999999999994 114.132 -166.705 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.15 157.74 3.31 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 113.659 -1.609 . . . . 74.140000000000001 112.628 -162.316 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -124.3 61.37 1.12 Allowed 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 124.573 1.149 . . . . 71.540000000000006 110.46 -165.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -149.57 177.07 10.07 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.356 1.462 . . . . 74.540000000000006 112.809 -176.427 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . 0.285 5.1 pt-20 44.65 -84.98 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 128.998 2.919 . . . . 73.310000000000002 114.318 -178.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.91 -22.1 64.02 Favored 'General case' 0 N--CA 1.462 0.163 0 O-C-N 121.243 -0.911 . . . . 74.329999999999998 113.214 176.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 3.4 mptt -64.96 -19.52 66.0 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-O 117.034 -1.46 . . . . 75.129999999999995 113.798 171.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -54.29 -39.83 67.3 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 121.699 2.045 . . . . 64.140000000000001 112.278 -177.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.65 -11.47 45.1 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.451 1.1 . . . . 74.329999999999998 113.467 177.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 -104.24 164.05 11.99 Favored 'General case' 0 N--CA 1.445 -0.705 0 C-N-CA 126.732 2.013 . . . . 74.420000000000002 108.422 177.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 51.34 -154.93 0.15 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.402 1.081 . . . . 74.129999999999995 108.571 -176.02 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -133.99 -19.83 1.99 Allowed 'General case' 0 C--O 1.222 -0.363 0 C-N-CA 125.038 1.335 . . . . 72.129999999999995 109.086 148.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -44.21 -43.37 7.15 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 127.437 2.295 . . . . 61.329999999999998 111.959 177.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 11.9 mt -67.83 -44.15 77.91 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 125.649 1.58 . . . . 63.200000000000003 111.56 -176.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -83.88 -20.72 32.58 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 123.6 0.76 . . . . 74.420000000000002 111.813 -178.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.29 -55.13 19.9 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 124.257 1.023 . . . . 75.140000000000001 109.081 -169.606 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.7 pttp -45.01 -53.44 7.75 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 124.793 1.237 . . . . 75.420000000000002 113.36 176.369 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.83 -57.1 11.31 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.11 0.964 . . . . 72.519999999999996 110.335 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -78.16 13.42 1.48 Allowed 'General case' 0 C--O 1.242 0.684 0 C-N-CA 124.568 1.147 . . . . 74.420000000000002 112.76 -176.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.1 3.21 2.63 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 124.823 1.249 . . . . 75.430000000000007 112.656 -173.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.94 7.48 13.22 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.655 1.116 . . . . 74.230000000000004 113.994 -173.185 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 20.3 ptt-85 -60.19 -33.69 72.57 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 121.025 1.738 . . . . 72.230000000000004 109.874 177.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -70.63 -12.5 61.6 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 120.547 -1.346 . . . . 72.120000000000005 112.606 -179.762 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -81.71 -50.7 8.98 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 120.41 1.459 . . . . 75.239999999999995 109.516 -175.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.29 -13.37 62.35 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 115.633 -0.712 . . . . 75.439999999999998 112.452 -179.693 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 17.0 mt -58.36 -32.18 68.31 Favored 'General case' 0 N--CA 1.468 0.448 0 O-C-N 120.645 -1.284 . . . . 63.240000000000002 111.457 171.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -72.98 -6.56 68.22 Favored Glycine 0 CA--C 1.528 0.882 0 O-C-N 121.25 -0.906 . . . . 54.439999999999998 112.28 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -83.09 -20.52 34.72 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 120.94 -1.329 . . . . 73.340000000000003 111.822 171.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 36.7 t90 -74.68 -82.06 0.07 Allowed 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.336 1.054 . . . . 74.329999999999998 108.668 179.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.68 -17.25 21.0 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.211 1.404 . . . . 55.049999999999997 113.791 -171.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -51.66 -55.44 19.42 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.174 0.59 . . . . 71.340000000000003 110.363 172.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -62.26 -41.98 99.72 Favored Glycine 0 CA--C 1.527 0.814 0 N-CA-C 111.276 -0.73 . . . . 62.43 111.276 -175.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.0 mp -56.56 -34.11 66.8 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.57 1.548 . . . . 73.549999999999997 111.695 176.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 71.8 mt -94.54 4.37 53.94 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.766 2.027 . . . . 73.409999999999997 112.456 176.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 76.41 42.58 22.39 Favored Glycine 0 CA--C 1.527 0.833 0 O-C-N 120.849 -1.157 . . . . 74.209999999999994 113.109 176.314 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 30.5 mttm -127.34 132.66 50.18 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 126.358 1.863 . . . . 74.530000000000001 108.038 176.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 45.3 p -134.45 -179.1 5.37 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 124.797 1.239 . . . . 71.430000000000007 108.094 164.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 46.49 -123.08 6.92 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 125.398 1.475 . . . . 73.519999999999996 113.318 173.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -63.49 -31.42 72.58 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 117.405 0.602 . . . . 72.239999999999995 112.372 -174.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -77.07 -40.26 46.79 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.677 0.751 . . . . 75.349999999999994 110.846 -177.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.12 -33.3 74.2 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.846 -0.616 . . . . 75.140000000000001 110.272 168.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 7.0 ttm-85 -58.24 -55.95 28.4 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.417 -0.957 . . . . 75.450000000000003 108.417 173.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.68 -43.01 80.05 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.852 1.261 . . . . 74.310000000000002 111.103 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -60.67 -41.92 96.05 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.347 1.059 . . . . 75.129999999999995 111.344 175.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.97 -0.49 18.92 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 120.476 -1.39 . . . . 74.150000000000006 113.345 -178.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.4 mt -79.42 5.31 13.02 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 120.782 1.628 . . . . 74.409999999999997 112.331 177.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.31 -22.46 1.75 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.534 1.133 . . . . 64.319999999999993 112.466 -174.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 35.6 m -64.43 -12.08 11.66 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 N-CA-C 115.526 1.676 . . . . 74.530000000000001 115.526 -171.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 9.9 t -88.23 115.85 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 N-CA-C 107.935 -1.135 . . . . 73.540000000000006 107.935 -170.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.2 t -139.8 -53.69 0.54 Allowed 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 126.304 1.841 . . . . 73.25 106.359 -178.21 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.7 t 64.62 50.67 2.07 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.264 1.426 . . . . 74.109999999999999 110.432 176.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -132.08 117.68 18.66 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 104.251 -2.5 . . . . 74.450000000000003 104.251 -178.288 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.404 ' CZ ' ' HB3' ' A' ' 86' ' ' ARG . 0.2 OUTLIER -176.9 38.24 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.687 1.595 . . . . 74.099999999999994 109.491 177.16 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -119.07 -8.35 10.21 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 120.352 -1.468 . . . . 61.439999999999998 111.366 -163.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -140.63 162.42 49.17 Favored Pre-proline 0 CA--C 1.54 0.589 0 C-N-CA 125.528 1.531 . . . . 64.5 111.325 -171.735 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -73.2 -9.86 23.7 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 123.952 3.102 . . . . 71.319999999999993 113.701 -174.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -105.08 16.09 46.65 Favored Glycine 0 CA--C 1.526 0.75 0 C-N-CA 124.847 1.213 . . . . 74.349999999999994 111.801 178.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -93.88 4.39 54.0 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.314 1.057 . . . . 71.120000000000005 111.397 -179.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -53.96 -38.26 64.8 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 119.505 1.048 . . . . 71.319999999999993 112.085 -172.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -59.45 -25.38 64.33 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-O 119.033 -0.508 . . . . 75.140000000000001 111.298 -177.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.413 ' HA ' ' HE3' ' A' ' 71' ' ' LYS . 57.3 t -63.16 -36.74 77.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-N 119.255 0.934 . . . . 55.109999999999999 110.305 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -89.74 -19.1 25.17 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 123.797 0.839 . . . . 72.109999999999999 110.189 -179.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.5 -36.17 79.74 Favored 'General case' 0 CA--C 1.522 -0.133 0 N-CA-C 115.154 1.539 . . . . 74.540000000000006 115.154 -167.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.413 ' HE3' ' HA ' ' A' ' 68' ' ' VAL . 0.0 OUTLIER -68.74 -53.44 21.93 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 106.635 -1.617 . . . . 74.140000000000001 106.635 -175.508 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -47.6 -61.39 1.96 Allowed 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 126.102 1.761 . . . . 71.150000000000006 109.064 172.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.89 -42.98 76.77 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 124.154 0.909 . . . . 43.240000000000002 111.405 -171.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -75.53 -35.64 60.68 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.776 1.028 . . . . 75.209999999999994 113.776 -179.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -73.75 -44.07 57.28 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 120.904 -1.123 . . . . 63.520000000000003 109.419 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 12.6 tp -86.04 13.76 7.21 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 128.332 2.653 . . . . 73.209999999999994 110.681 -179.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -55.73 123.08 12.94 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 125.407 1.483 . . . . 74.25 108.43 -178.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 98.75 -11.43 62.72 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 124.787 1.184 . . . . 63.549999999999997 113.728 -174.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.5 mtmm -128.71 6.6 5.62 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 119.058 1.429 . . . . 74.140000000000001 112.534 -171.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -146.92 174.32 11.61 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.997 0.919 . . . . 75.519999999999996 109.735 170.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -130.35 156.8 44.1 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 125.329 1.452 . . . . 73.310000000000002 107.595 -178.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 68.3 mm-40 -66.26 -20.76 66.2 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 125.207 1.403 . . . . 74.140000000000001 112.425 -177.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 21.8 pt-20 -94.78 -22.77 17.86 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 120.929 -1.107 . . . . 54.210000000000001 112.371 170.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.5 m -79.38 -40.71 29.45 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.028 0.931 . . . . 63.210000000000001 110.583 -172.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 77.6 mt -56.65 -57.34 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 CA-C-N 119.524 1.056 . . . . 75.340000000000003 108.507 -177.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.404 ' HB3' ' CZ ' ' A' ' 60' ' ' PHE . 0.1 OUTLIER -59.87 -41.11 90.81 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-N 118.15 0.432 . . . . 73.540000000000006 112.123 -179.646 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.51 -44.78 85.31 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 122.967 0.507 . . . . 74.209999999999994 110.385 -179.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.73 -26.17 61.43 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.861 0.864 . . . . 75.510000000000005 112.465 -179.482 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 21.9 mtt -73.1 -41.2 64.3 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 119.014 0.825 . . . . 74.140000000000001 110.803 177.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 11.9 t -73.11 -31.19 33.99 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.137 0.975 . . . . 75.120000000000005 110.129 178.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -48.61 -57.71 5.8 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 126.074 1.75 . . . . 72.239999999999995 111.769 -174.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.93 25.3 0.12 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.767 1.627 . . . . 71.120000000000005 114.138 -179.41 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 3.4 mtt-85 -50.54 -48.28 57.35 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 125.61 1.564 . . . . 74.299999999999997 113.539 -177.408 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.17 -38.88 21.75 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 123.924 0.89 . . . . 75.329999999999998 109.939 177.374 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.8 m -50.8 -39.09 51.98 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.561 1.544 . . . . 75.310000000000002 110.817 -179.122 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.3 -38.63 77.43 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.14 -0.975 . . . . 73.540000000000006 113.591 178.352 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -86.24 -27.02 24.71 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.313 0.96 . . . . 75.519999999999996 112.156 175.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -66.84 -48.91 67.42 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.99 0.916 . . . . 75.530000000000001 111.78 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -59.59 -29.25 67.83 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 118.297 0.498 . . . . 64.239999999999995 111.918 -169.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 42.3 mm -67.39 -32.42 57.22 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 124.488 1.115 . . . . 74.5 112.351 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 51.3 mt -88.95 -21.85 6.76 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 N-CA-C 108.529 -0.915 . . . . 75.420000000000002 108.529 176.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 4.3 t -71.34 -37.31 71.71 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.973 -0.454 . . . . 62.140000000000001 109.804 172.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -135.53 76.04 1.59 Allowed 'General case' 0 C--O 1.236 0.367 0 C-N-CA 127.012 2.125 . . . . 74.439999999999998 105.549 -165.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 9.1 mt . . . . . 0 C--O 1.247 0.951 0 C-N-CA 127.602 2.361 . . . . 74.510000000000005 107.896 -177.416 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.0 ttm . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 109.305 -0.628 . . . . 64.140000000000001 109.305 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -76.65 175.1 9.64 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 108.741 -0.837 . . . . 74.400000000000006 108.741 154.373 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -124.38 -53.24 1.71 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 127.525 2.33 . . . . 72.299999999999997 107.323 165.106 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 55.5 t80 70.86 77.19 0.18 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 127.411 2.285 . . . . 72.120000000000005 108.675 -177.556 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . 0.339 0.0 OUTLIER 45.56 -171.18 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 130.357 3.463 . . . . 71.299999999999997 111.326 -163.893 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -162.91 113.0 1.4 Allowed 'General case' 0 C--O 1.236 0.391 0 C-N-CA 126.188 1.795 . . . . 75.430000000000007 106.368 171.148 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -107.1 -175.28 2.75 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.62 1.168 . . . . 73.239999999999995 110.066 -169.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.6 pm0 -55.77 174.58 0.11 Allowed 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 122.229 1.014 . . . . 73.5 113.138 167.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.3 mtm180 -90.03 -67.55 0.84 Allowed 'General case' 0 N--CA 1.469 0.495 0 O-C-N 120.657 -1.277 . . . . 72.209999999999994 111.824 -174.531 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 44.64 71.1 0.28 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.869 2.068 . . . . 71.530000000000001 111.291 176.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -134.63 8.19 3.58 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.233 1.813 . . . . 75.540000000000006 110.719 -168.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -67.72 108.4 2.92 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 107.972 -1.121 . . . . 75.439999999999998 107.972 -174.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.15 14.33 5.41 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.242 1.417 . . . . 72.299999999999997 114.101 -179.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 13.3 mttt -85.15 -3.81 58.94 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.132 1.773 . . . . 72.519999999999996 113.44 176.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -68.46 -32.65 72.82 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 120.732 -1.23 . . . . 63.299999999999997 110.321 -165.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -79.91 14.24 1.87 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.043 1.737 . . . . 71.519999999999996 113.309 171.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -127.47 -21.41 3.83 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.983 1.265 . . . . 72.209999999999994 114.123 -164.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -152.58 168.13 26.58 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.745 1.157 . . . . 74.540000000000006 110.361 176.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -69.88 -46.0 66.43 Favored 'General case' 0 C--O 1.224 -0.281 0 O-C-N 121.608 -0.682 . . . . 73.420000000000002 111.295 171.169 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -45.61 -54.55 7.52 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.349 1.46 . . . . 64.120000000000005 112.119 -166.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.671 ' CD2' ' H ' ' A' ' 21' ' ' LEU . 0.1 OUTLIER -63.77 -39.48 94.37 Favored 'General case' 0 N--CA 1.436 -1.134 0 O-C-N 120.869 -1.144 . . . . 74.540000000000006 111.441 -175.542 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -61.65 -42.94 99.6 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.859 0.863 . . . . 73.200000000000003 110.872 174.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -55.24 -39.76 70.11 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.705 0.802 . . . . 74.230000000000004 109.95 172.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.07 -40.21 73.22 Favored 'General case' 0 C--N 1.342 0.247 0 O-C-N 120.625 -1.297 . . . . 73.109999999999999 112.351 173.351 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.26 -47.76 72.66 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 119.465 1.029 . . . . 73.519999999999996 111.716 174.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -58.23 -30.4 66.48 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 121.41 0.624 . . . . 75.5 110.578 177.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -99.09 25.2 6.98 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 126.677 1.991 . . . . 73.430000000000007 110.856 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.9 mmt-85 -114.4 -6.75 12.91 Favored 'General case' 0 N--CA 1.463 0.223 0 O-C-N 120.852 -1.155 . . . . 75.310000000000002 111.303 165.014 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 30.9 ptt-85 -60.6 -29.92 69.5 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 119.632 1.105 . . . . 75.340000000000003 112.197 -176.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -94.92 -13.32 25.51 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 123.864 0.865 . . . . 72.230000000000004 112.401 177.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -59.84 4.58 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 120.451 1.478 . . . . 74.530000000000001 110.032 178.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.5 mp -69.26 -25.53 64.32 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.51 -0.768 . . . . 74.450000000000003 109.91 -166.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 60.6 mt -51.96 -33.13 36.37 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.176 0.99 . . . . 74.349999999999994 112.69 173.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -75.24 -36.12 46.36 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 110.124 -1.191 . . . . 72.310000000000002 110.124 -179.113 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -69.17 -23.2 63.91 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.468 1.507 . . . . 72.25 111.486 -179.29 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 19.0 t90 -67.79 -78.52 0.06 Allowed 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.406 1.082 . . . . 75.310000000000002 108.477 166.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.5 -26.06 53.23 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 124.481 1.113 . . . . 61.020000000000003 113.242 -168.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -45.84 -54.22 8.46 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.309 0.958 . . . . 74.319999999999993 111.186 170.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.82 -44.12 97.33 Favored Glycine 0 CA--C 1.53 0.97 0 N-CA-C 111.558 -0.617 . . . . 54.109999999999999 111.558 -176.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.5 mp -58.47 -51.64 69.0 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 126.695 1.998 . . . . 73.329999999999998 110.61 176.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.4 mp -54.93 -42.19 71.97 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.678 1.191 . . . . 75.319999999999993 111.304 174.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 112.21 24.83 4.96 Favored Glycine 0 CA--C 1.519 0.307 0 C-N-CA 124.519 1.057 . . . . 64.109999999999999 112.225 -175.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 33.0 mttm -97.31 137.89 35.62 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 126.89 2.076 . . . . 75.450000000000003 107.249 172.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 36.4 p -139.42 167.91 21.03 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 123.806 0.842 . . . . 64.329999999999998 109.011 -178.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 54.04 -130.72 44.23 Favored Glycine 0 CA--C 1.521 0.469 0 C-N-CA 124.747 1.165 . . . . 75.239999999999995 110.81 173.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -71.39 -22.3 61.89 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 118.335 -0.84 . . . . 74.129999999999995 112.878 -179.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -64.16 -47.05 81.36 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.99 1.268 . . . . 74.409999999999997 110.599 175.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.54 -46.61 88.37 Favored 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 125.052 1.341 . . . . 64.340000000000003 109.76 173.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 6.3 ttm-85 -57.22 -50.5 72.68 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.624 0.77 . . . . 73.109999999999999 111.008 177.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.44 -29.51 70.19 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 126.535 1.934 . . . . 75.430000000000007 111.807 -178.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 82.5 t80 -73.31 -40.97 64.09 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.105 0.962 . . . . 75.409999999999997 109.516 171.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.16 7.18 0.61 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.55 1.14 . . . . 74.439999999999998 113.536 177.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 42.2 mt -88.28 -15.36 36.0 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.183 0.993 . . . . 72.219999999999999 111.863 172.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.9 t -125.01 3.65 8.0 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 119.211 0.914 . . . . 73.510000000000005 111.654 -169.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 5.9 p -62.7 -26.87 41.78 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 O-C-N 120.362 -1.461 . . . . 74.510000000000005 112.648 169.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 4.9 m -72.33 117.76 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.569 0 C-N-CA 127.017 2.127 . . . . 72.510000000000005 110.829 -173.482 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.438 HG22 ' H ' ' A' ' 58' ' ' SER . 0.7 OUTLIER -144.34 -85.69 0.13 Allowed 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 127.339 2.256 . . . . 72.430000000000007 107.106 175.217 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.438 ' H ' HG22 ' A' ' 57' ' ' THR . 10.0 m -161.23 -177.11 5.82 Favored 'General case' 0 N--CA 1.452 -0.373 1 C-N-CA 131.726 4.01 . . . . 75.239999999999995 105.059 174.886 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -101.44 -179.17 3.95 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 126.304 1.841 . . . . 74.329999999999998 108.636 168.338 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -135.21 144.91 47.19 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 125.334 1.453 . . . . 74.540000000000006 108.886 177.082 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -157.28 -11.6 0.09 Allowed 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 123.757 0.823 . . . . 73.140000000000001 112.861 -173.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -157.75 165.59 18.36 Favored Pre-proline 0 CA--C 1.553 1.065 0 CA-C-N 120.564 1.529 . . . . 74.230000000000004 110.638 178.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -85.17 71.75 4.82 Favored 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 122.706 2.271 . . . . 74.409999999999997 113.254 -155.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -159.38 -49.77 0.01 OUTLIER Glycine 0 CA--C 1.526 0.735 0 C-N-CA 123.71 0.672 . . . . 72.549999999999997 111.665 165.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -81.2 17.28 1.32 Allowed 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.028 1.331 . . . . 72.510000000000005 111.622 -175.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -61.85 82.05 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.692 1.597 . . . . 75.030000000000001 109.054 168.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -139.15 -5.21 1.46 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.851 1.26 . . . . 63.109999999999999 112.381 179.009 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.8 p -93.78 -61.76 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 C-N-CA 124.663 1.185 . . . . 73.450000000000003 109.14 175.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -54.02 -30.82 49.09 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.435 1.494 . . . . 74.439999999999998 110.384 175.619 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.07 -32.87 16.72 Favored 'General case' 0 C--N 1.341 0.23 0 C-N-CA 126.57 1.948 . . . . 72.239999999999995 113.255 -171.765 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.8 mmtt -108.29 -32.97 7.25 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 118.327 -0.844 . . . . 75.209999999999994 110.946 175.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.36 -47.35 66.18 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.189 0.596 . . . . 75.409999999999997 110.7 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -57.01 -37.16 71.3 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 119.095 -0.478 . . . . 74.329999999999998 112.13 -178.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -80.23 -43.31 21.64 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.258 1.023 . . . . 74.140000000000001 111.532 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.15 -38.84 80.66 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 122.36 1.076 . . . . 72.439999999999998 109.194 178.319 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 9.2 tp -102.55 21.16 15.75 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 128.109 2.564 . . . . 74.329999999999998 111.071 -175.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 47.2 tt0 -52.48 114.95 1.54 Allowed 'General case' 0 C--O 1.233 0.234 0 C-N-CA 125.734 1.613 . . . . 63.130000000000003 109.919 -177.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.94 -3.66 81.03 Favored Glycine 0 CA--C 1.532 1.111 0 CA-C-O 118.432 -1.205 . . . . 71.340000000000003 113.112 175.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -118.59 3.74 11.73 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 126.701 2.001 . . . . 75.430000000000007 111.893 -172.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -142.68 173.18 11.77 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 126.765 2.026 . . . . 72.230000000000004 106.868 173.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -120.47 161.13 21.78 Favored 'General case' 0 C--O 1.24 0.554 0 N-CA-C 105.764 -1.939 . . . . 72.319999999999993 105.764 163.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -55.28 -53.65 53.45 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 123.589 0.756 . . . . 63.039999999999999 110.052 174.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -67.43 -19.25 65.35 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.41 -0.359 . . . . 75.209999999999994 110.655 -174.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 19.6 m -87.5 -39.7 14.94 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 124.788 1.235 . . . . 75.310000000000002 111.504 178.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 89.2 mt -56.79 -55.41 20.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-N 121.636 2.016 . . . . 75.439999999999998 108.377 171.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.65 -7.91 8.65 Favored 'General case' 0 N--CA 1.462 0.166 0 N-CA-C 112.553 0.575 . . . . 73.209999999999994 112.553 -179.107 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -122.5 42.26 3.21 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 125.567 1.547 . . . . 54.310000000000002 107.958 176.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -118.53 -41.27 2.83 Favored 'General case' 0 C--N 1.341 0.207 0 O-C-N 121.648 -0.658 . . . . 74.109999999999999 111.578 166.115 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -63.7 -44.51 93.45 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.28 0.632 . . . . 71.230000000000004 111.421 -175.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 42.2 t -67.76 -31.28 51.64 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 C-N-CA 125.332 1.453 . . . . 64.129999999999995 111.839 179.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.69 -60.36 3.78 Favored 'General case' 0 C--O 1.231 0.126 0 O-C-N 120.561 -1.337 . . . . 72.420000000000002 109.821 -169.266 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.88 16.9 1.68 Allowed 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 124.383 1.073 . . . . 75.530000000000001 112.103 -178.694 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 14.6 ttm180 -49.08 -44.78 42.29 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.451 1.101 . . . . 71.510000000000005 111.006 171.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.32 -58.62 7.52 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 118.713 -0.661 . . . . 73.310000000000002 109.961 175.095 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 5.8 m -52.57 -51.3 60.42 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.483 1.113 . . . . 74.5 110.538 -175.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -63.04 -23.68 67.56 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 113.682 0.994 . . . . 75.329999999999998 113.682 -176.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.2 -68.89 0.54 Allowed 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 106.064 -1.828 . . . . 71.530000000000001 106.064 165.679 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -44.97 -49.15 11.34 Favored 'General case' 0 CA--C 1.518 -0.278 0 C-N-CA 128.124 2.57 . . . . 71.519999999999996 113.197 -167.465 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -52.18 -35.72 49.71 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-O 117.919 -1.039 . . . . 75.530000000000001 112.27 -174.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 14.5 mm -57.94 -54.35 33.17 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 120.071 1.305 . . . . 75.519999999999996 111.056 -178.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 80.8 mt -62.63 -19.46 22.91 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 C-N-CA 123.67 0.788 . . . . 74.230000000000004 109.422 178.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.28 5.39 39.96 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 126.867 2.067 . . . . 71.129999999999995 113.153 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -121.26 11.82 10.87 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.94 1.696 . . . . 73.540000000000006 110.589 -175.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 35.2 mt . . . . . 0 C--O 1.248 1.007 0 C-N-CA 127.822 2.449 . . . . 73.400000000000006 110.733 -172.999 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 ptm . . . . . 0 N--CA 1.475 0.786 0 N-CA-C 113.574 0.953 . . . . 72.120000000000005 113.574 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.2 p -142.7 169.6 17.27 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 120.269 1.395 . . . . 71.549999999999997 108.475 178.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.85 15.28 2.29 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 120.75 -1.219 . . . . 71.439999999999998 112.956 -172.677 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 41.0 m-85 -65.75 -60.05 3.28 Favored 'General case' 0 C--O 1.234 0.287 0 O-C-N 120.715 -1.241 . . . . 73.109999999999999 112.261 -173.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.85 -55.44 6.65 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.344 0.974 . . . . 72.010000000000005 109.657 -173.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 45.8 t0 48.27 84.21 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 129.622 3.169 . . . . 65.109999999999999 112.911 175.079 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.0 mmt180 -137.06 126.75 25.41 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 125.09 1.356 . . . . 74.439999999999998 110.054 -166.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -102.51 -20.05 14.65 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.033 0.933 . . . . 73.129999999999995 112.309 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -88.45 -179.47 6.09 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 118.581 0.628 . . . . 71.439999999999998 110.152 177.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 56.83 36.46 27.75 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 126.567 1.947 . . . . 74.239999999999995 112.66 175.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -63.27 -0.72 0.87 Allowed 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 115.069 1.507 . . . . 60.210000000000001 115.069 176.661 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.426 ' C ' ' H ' ' A' ' 14' ' ' LYS . 8.2 pt-20 -59.56 108.15 0.69 Allowed 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 127.666 2.386 . . . . 61.149999999999999 109.444 -173.489 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 55.8 -8.23 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 128.609 2.763 . . . . 70.019999999999996 115.806 -168.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.426 ' H ' ' C ' ' A' ' 12' ' ' GLU . 34.7 mttt -62.78 -23.29 67.15 Favored 'General case' 0 C--O 1.224 -0.254 0 C-N-CA 125.673 1.589 . . . . 73.409999999999997 113.137 -174.845 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -53.29 -29.36 32.92 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 119.651 1.114 . . . . 70.340000000000003 113.965 -176.01 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -97.83 2.62 49.53 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.715 0.806 . . . . 73.120000000000005 113.096 -178.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.4 m170 -125.45 -62.19 1.22 Allowed 'General case' 0 C--O 1.237 0.428 0 C-N-CA 125.929 1.692 . . . . 73.239999999999995 109.077 -170.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -85.93 112.14 20.89 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 106.793 -1.558 . . . . 74.010000000000005 106.793 174.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.53 -36.55 78.99 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-O 118.104 -0.951 . . . . 74.329999999999998 110.987 -175.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.448 ' H ' ' CD ' ' A' ' 20' ' ' GLU . 3.4 mp0 -54.5 -41.51 69.69 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.737 1.153 . . . . 65.129999999999995 111.368 -172.417 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.421 ' HA ' ' HE3' ' A' ' 24' ' ' LYS . 32.8 mt -64.01 -31.93 73.29 Favored 'General case' 0 C--O 1.233 0.234 0 O-C-N 121.599 -0.688 . . . . 72.349999999999994 111.989 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -84.83 -32.99 22.99 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 125.908 1.683 . . . . 74.040000000000006 110.861 176.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -55.14 -50.52 69.05 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 125.799 1.64 . . . . 74.319999999999993 109.183 -170.118 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.421 ' HE3' ' HA ' ' A' ' 21' ' ' LEU . 13.7 ptpt -52.05 -46.02 64.93 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.58 0.752 . . . . 74.439999999999998 111.992 175.247 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.21 -36.93 80.29 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 124.285 1.034 . . . . 63.439999999999998 111.016 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -71.49 -17.32 62.35 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.673 1.589 . . . . 64.129999999999995 111.201 176.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -123.97 25.58 7.89 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.573 1.949 . . . . 54.329999999999998 113.683 -169.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.321 0.0 OUTLIER -137.03 11.98 3.08 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 115.087 1.514 . . . . 74.010000000000005 115.087 177.421 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.8 ptt-85 -60.87 -18.71 57.77 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.955 1.465 . . . . 73.200000000000003 114.955 176.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -94.81 -24.02 17.24 Favored 'General case' 0 C--O 1.225 -0.217 0 CA-C-N 120.476 1.489 . . . . 72.140000000000001 110.671 172.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.39 -55.4 21.98 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 119.879 1.218 . . . . 73.209999999999994 111.132 -177.18 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.466 HD12 HE22 ' A' ' 99' ' ' GLN . 1.5 pt? -63.7 -20.7 65.93 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.07 -0.968 . . . . 72.329999999999998 113.307 -174.266 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.4 -38.33 90.65 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.37 1.468 . . . . 70.420000000000002 110.085 -176.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.48 -33.79 88.18 Favored Glycine 0 CA--C 1.527 0.82 0 CA-C-O 119.561 -0.577 . . . . 74.420000000000002 111.774 178.16 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -65.3 -38.33 89.87 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 117.866 0.833 . . . . 72.329999999999998 110.679 -177.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 28.8 t90 -60.51 -60.65 3.48 Favored 'General case' 0 C--O 1.228 -0.071 0 N-CA-C 108.291 -1.003 . . . . 74.030000000000001 108.291 177.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.05 -45.97 64.91 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 118.816 -0.611 . . . . 63.109999999999999 111.297 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -45.73 -57.5 4.21 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.209 1.004 . . . . 72.230000000000004 112.387 179.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.97 -32.08 80.84 Favored Glycine 0 CA--C 1.529 0.944 0 N-CA-C 112.069 -0.412 . . . . 75.299999999999997 112.069 -176.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 80.7 mt -71.07 -48.05 54.81 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 124.139 0.975 . . . . 74.409999999999997 110.66 178.212 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.6 mp -52.83 -31.66 40.23 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 124.859 1.263 . . . . 74.0 111.386 168.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 101.22 8.75 46.51 Favored Glycine 0 CA--C 1.526 0.781 0 C-N-CA 125.748 1.642 . . . . 55.240000000000002 112.394 -177.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.428 ' HE3' ' CD1' ' A' ' 51' ' ' TYR . 48.5 mttm -72.39 127.69 33.35 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 106.554 -1.647 . . . . 74.109999999999999 106.554 167.758 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 17.7 p -144.5 170.02 16.84 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.707 -0.849 . . . . 73.140000000000001 108.707 177.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.53 -131.84 15.19 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 109.205 -1.558 . . . . 73.049999999999997 109.205 -177.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -76.47 -30.8 57.45 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 118.843 -0.598 . . . . 64.120000000000005 111.003 177.347 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -57.6 -41.31 80.98 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 119.576 1.08 . . . . 72.329999999999998 111.585 -176.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.1 -46.52 90.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.645 -1.161 . . . . 73.239999999999995 111.387 174.405 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.8 ttt85 -57.48 -55.09 39.3 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 124.904 1.282 . . . . 71.409999999999997 109.165 178.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.65 -43.7 97.28 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 126.653 1.981 . . . . 72.109999999999999 111.376 -178.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.428 ' CD1' ' HE3' ' A' ' 43' ' ' LYS . 43.5 t80 -61.71 -44.39 97.02 Favored 'General case' 0 C--N 1.333 -0.13 0 O-C-N 121.709 -0.619 . . . . 74.409999999999997 109.995 174.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.53 -25.27 62.28 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 121.243 -0.91 . . . . 54.32 112.766 -175.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 37.7 mt -64.47 -21.04 66.54 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.766 1.227 . . . . 73.230000000000004 114.045 -173.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.9 t -100.71 -5.85 25.9 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.305 0.957 . . . . 74.299999999999997 111.009 -173.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 6.3 t -93.45 82.87 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 O-C-N 120.403 -1.436 . . . . 74.200000000000003 109.535 -164.112 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 3.7 m -132.93 87.8 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.96 0 C-N-CA 127.57 2.348 . . . . 65.409999999999997 110.156 -177.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.0 t -155.57 133.01 11.01 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 106.022 -1.844 . . . . 73.319999999999993 106.022 -169.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.2 t -161.26 76.24 0.53 Allowed 'General case' 0 C--O 1.232 0.138 0 CA-C-N 120.327 1.421 . . . . 71.439999999999998 108.473 -172.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.529 ' H ' ' CG2' ' A' ' 68' ' ' VAL . 26.9 m-20 -144.68 90.47 2.08 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 106.91 -1.515 . . . . 72.540000000000006 106.91 -163.054 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -154.86 -3.9 0.15 Allowed 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.55 1.54 . . . . 74.540000000000006 111.418 -169.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -64.06 -43.71 94.67 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 120.695 -1.253 . . . . 53.439999999999998 111.791 -161.526 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -132.6 163.24 52.09 Favored Pre-proline 0 C--O 1.235 0.33 0 C-N-CA 126.176 1.79 . . . . 64.5 110.298 -176.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -80.55 64.3 8.87 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.352 2.701 . . . . 72.439999999999998 111.631 -172.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -134.5 -70.66 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 107.789 -2.124 . . . . 73.409999999999997 107.789 171.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.23 -55.1 37.85 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 125.641 1.576 . . . . 71.430000000000007 111.691 -159.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 52.95 11.41 0.21 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 129.178 2.991 . . . . 71.420000000000002 115.719 169.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -74.87 -23.21 58.37 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 113.01 0.744 . . . . 62.299999999999997 113.01 -158.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.529 ' CG2' ' H ' ' A' ' 59' ' ' ASP . 18.0 t -71.2 -62.33 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.219 0 C-N-CA 124.064 0.945 . . . . 70.319999999999993 108.662 177.003 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -60.12 -32.92 71.46 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-O 118.695 -0.669 . . . . 73.219999999999999 110.808 -165.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 25.7 ttp180 -48.42 -58.14 5.07 Favored 'General case' 0 CA--C 1.517 -0.311 0 C-N-CA 123.489 0.716 . . . . 74.230000000000004 110.955 172.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.5 mmtp -74.1 -43.6 57.02 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.884 -0.413 . . . . 62.299999999999997 109.884 -177.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.12 -58.72 7.4 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 124.071 0.948 . . . . 73.099999999999994 110.252 -171.266 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.19 -34.43 70.35 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 118.489 -0.767 . . . . 65.129999999999995 111.486 -175.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.62 -33.6 62.62 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 119.412 1.005 . . . . 64.120000000000005 112.299 176.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.49 -27.67 67.2 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.95 -1.094 . . . . 65.439999999999998 109.488 172.594 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.6 tp -120.48 22.85 11.12 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 127.013 2.125 . . . . 74.129999999999995 111.782 -165.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -48.45 114.18 0.91 Allowed 'General case' 0 C--O 1.233 0.199 0 C-N-CA 127.584 2.354 . . . . 72.040000000000006 108.829 173.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 77.54 6.22 86.56 Favored Glycine 0 CA--C 1.538 1.503 0 N-CA-C 114.636 0.614 . . . . 71.140000000000001 114.636 174.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 5.4 pttm -129.28 3.94 5.19 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 119.032 1.416 . . . . 72.239999999999995 113.556 -174.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -139.8 -162.44 1.34 Allowed 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.752 1.221 . . . . 74.230000000000004 108.426 164.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -136.17 147.19 47.58 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 125.595 1.558 . . . . 72.129999999999995 107.772 -176.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -69.16 -15.67 63.46 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.792 0.837 . . . . 65.409999999999997 113.239 -176.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -104.95 -2.08 25.01 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.57 1.148 . . . . 72.040000000000006 112.723 171.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.1 m -101.37 -35.9 9.06 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 121.059 -1.025 . . . . 74.420000000000002 112.982 -175.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 22.7 mt -55.09 -53.99 28.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 119.192 0.905 . . . . 72.109999999999999 109.342 -178.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -50.14 -51.36 43.93 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 124.026 0.931 . . . . 74.439999999999998 109.507 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -73.37 -9.13 58.38 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 124.404 1.082 . . . . 73.239999999999995 112.6 -172.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -84.79 -65.21 1.03 Allowed 'General case' 0 CA--C 1.519 -0.243 0 O-C-N 120.184 -1.573 . . . . 75.310000000000002 107.977 178.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 3.2 ptt? -61.74 -33.78 74.65 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 113.178 0.807 . . . . 73.439999999999998 113.178 -170.006 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 96.3 t -65.18 -49.19 80.41 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.223 0 C-N-CA 123.917 0.887 . . . . 74.329999999999998 109.497 176.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -62.06 -36.57 82.04 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 121.034 -1.041 . . . . 71.209999999999994 110.932 -173.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 83.2 mt -65.93 -6.11 11.43 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 125.424 1.489 . . . . 63.310000000000002 112.113 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -53.56 -51.82 61.69 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 120.191 1.359 . . . . 74.200000000000003 111.866 -178.009 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -78.95 -9.15 59.43 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.204 0.602 . . . . 74.200000000000003 112.563 -175.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 31.7 m -64.57 -38.21 90.22 Favored 'General case' 0 C--O 1.226 -0.165 0 O-C-N 120.827 -1.171 . . . . 62.439999999999998 110.108 -179.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.514 ' HA ' HE21 ' A' ' 99' ' ' GLN . . . -64.32 -27.06 68.77 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 120.834 -1.166 . . . . 62.039999999999999 113.276 -170.169 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 12.7 tpt85 -65.02 -53.96 37.87 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.53 1.132 . . . . 74.439999999999998 108.713 173.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -63.07 -56.18 19.17 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 124.385 1.074 . . . . 75.040000000000006 110.893 -177.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . 0.514 HE21 ' HA ' ' A' ' 96' ' ' ALA . 11.1 pt20 -63.67 -18.5 64.03 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.541 1.136 . . . . 72.319999999999993 113.27 -164.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 11.6 mm -87.09 -38.53 12.27 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.156 0 C-N-CA 125.767 1.627 . . . . 73.450000000000003 110.076 177.351 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 76.6 mt -71.84 -28.3 30.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 O-C-N 121.027 -1.046 . . . . 74.109999999999999 108.325 172.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 2.9 t -73.12 -43.72 61.28 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.57 0.748 . . . . 73.319999999999993 109.434 177.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -132.81 82.85 2.02 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 106.015 -1.846 . . . . 75.120000000000005 106.015 -174.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.497 HD13 ' H ' ' A' ' 104' ' ' ILE . 2.0 mp . . . . . 0 C--O 1.253 1.244 0 N-CA-C 106.626 -1.62 . . . . 71.150000000000006 106.626 173.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.7 ttt . . . . . 0 N--CA 1.468 0.43 0 CA-C-O 117.918 -1.039 . . . . 74.109999999999999 109.381 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 61.4 m -54.83 108.9 0.44 Allowed 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.677 1.126 . . . . 75.109999999999999 110.864 179.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 14.2 t -155.0 151.93 29.05 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.502 1.121 . . . . 75.120000000000005 108.351 164.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -152.32 102.91 2.8 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 105.093 -2.188 . . . . 75.219999999999999 105.093 162.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -139.44 20.26 2.56 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 126.212 1.805 . . . . 73.430000000000007 110.339 -166.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 75.01 -56.84 0.62 Allowed 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 129.831 3.252 . . . . 72.129999999999995 110.808 174.088 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.5 mtt180 -69.89 164.11 24.49 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 125.342 1.457 . . . . 74.519999999999996 108.431 164.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -161.12 -55.85 0.05 Allowed 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 115.746 -0.661 . . . . 71.340000000000003 110.474 -156.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.4 ptp85 -130.56 150.89 51.55 Favored 'General case' 0 CA--C 1.497 -1.067 0 C-N-CA 125.157 1.383 . . . . 74.439999999999998 113.045 -154.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -148.31 81.28 1.47 Allowed 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 113.112 -1.858 . . . . 72.540000000000006 109.749 -157.058 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -56.51 -32.21 64.84 Favored 'General case' 0 C--O 1.206 -1.233 0 CA-C-O 117.748 -1.12 . . . . 73.129999999999995 113.362 166.511 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . 0.263 11.0 pt-20 43.99 58.36 3.69 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-N 121.088 1.767 . . . . 64.150000000000006 111.911 -177.422 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 55.84 12.21 0.83 Allowed 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 127.667 2.387 . . . . 70.120000000000005 116.219 -172.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 11.7 mmtt -70.61 -7.26 42.8 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 119.908 -1.745 . . . . 73.310000000000002 113.867 174.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.3 m-30 -59.71 -32.5 70.59 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 121.197 1.817 . . . . 70.430000000000007 111.122 176.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -73.95 15.6 0.29 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.642 1.177 . . . . 73.340000000000003 113.54 176.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -153.31 178.04 10.21 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 125.268 1.427 . . . . 73.420000000000002 109.774 -164.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 51.07 -162.46 0.07 Allowed 'General case' 0 C--O 1.236 0.362 0 C-N-CA 128.077 2.551 . . . . 70.239999999999995 111.974 168.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -145.46 8.98 1.19 Allowed 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 125.945 1.698 . . . . 73.030000000000001 110.971 169.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -72.14 -52.37 16.96 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-N 119.288 0.949 . . . . 65.150000000000006 109.725 169.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.724 ' CD2' ' H ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER -69.69 -46.02 66.99 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 124.658 1.183 . . . . 72.420000000000002 112.288 -169.578 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 39.4 t-20 -58.43 -41.43 85.01 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 124.218 1.007 . . . . 64.239999999999995 110.942 -175.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -47.98 -51.84 22.18 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.832 2.053 . . . . 74.230000000000004 111.748 177.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 3.7 mttp -55.51 -57.65 11.03 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 108.917 -0.772 . . . . 72.510000000000005 108.917 172.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.98 2.96 0.92 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.441 1.496 . . . . 74.129999999999995 113.983 -176.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -98.41 -28.47 13.62 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 120.504 -1.372 . . . . 72.25 110.388 171.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -128.87 34.7 4.43 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 120.714 -1.241 . . . . 62.109999999999999 113.451 -159.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.12 -6.29 7.22 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 115.262 1.578 . . . . 73.140000000000001 115.262 -172.356 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 76.5 mtt85 -53.89 -22.93 11.06 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 120.109 1.322 . . . . 72.230000000000004 113.535 176.529 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -95.17 -17.6 21.64 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 113.151 0.797 . . . . 71.510000000000005 113.151 177.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.6 ttt180 -56.03 -56.37 21.6 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.548 1.067 . . . . 71.329999999999998 110.784 -179.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -70.67 -16.28 62.79 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 114.085 1.142 . . . . 74.329999999999998 114.085 -176.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 12.4 mt -61.9 -25.9 67.84 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.564 1.074 . . . . 74.450000000000003 110.521 167.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.13 -37.42 92.83 Favored Glycine 0 N--CA 1.442 -0.947 0 CA-C-O 119.268 -0.74 . . . . 72.230000000000004 111.963 173.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -65.84 -27.64 68.39 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 118.544 1.172 . . . . 73.239999999999995 110.694 179.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 28.9 t90 -71.77 -62.14 1.53 Allowed 'General case' 0 CA--C 1.534 0.354 0 O-C-N 121.213 -0.929 . . . . 72.310000000000002 109.25 171.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -54.85 -48.95 72.23 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 113.692 0.997 . . . . 74.25 113.692 -176.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -47.58 -50.38 24.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 119.252 0.933 . . . . 72.340000000000003 111.731 175.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -65.34 -7.13 31.08 Favored Glycine 0 CA--C 1.534 1.265 0 C-N-CA 125.337 1.446 . . . . 72.109999999999999 114.611 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 18.3 mt -102.93 -45.85 4.84 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 126.316 1.846 . . . . 75.109999999999999 109.731 172.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.8 mp -62.33 -10.59 11.6 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 127.099 2.16 . . . . 71.329999999999998 114.805 -176.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 89.03 34.41 8.88 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 110.875 -0.89 . . . . 71.310000000000002 110.875 -179.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 16.2 mttm -117.45 143.98 45.48 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 106.755 -1.572 . . . . 73.510000000000005 106.755 172.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 10.2 p -141.92 172.18 13.04 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 107.128 -1.434 . . . . 75.430000000000007 107.128 167.13 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 60.73 -142.98 48.3 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 111.742 -0.543 . . . . 74.299999999999997 111.742 175.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -60.98 -32.02 71.59 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.05 0.389 . . . . 64.400000000000006 112.05 -177.105 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -59.92 -47.19 86.8 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 124.514 1.126 . . . . 73.5 111.199 177.404 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.59 -45.42 94.17 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.29 -0.868 . . . . 74.120000000000005 110.69 172.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.9 ttt180 -58.59 -50.29 74.34 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 123.995 0.918 . . . . 75.340000000000003 111.083 -176.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.19 -48.74 80.44 Favored 'General case' 0 C--O 1.233 0.184 0 C-N-CA 126.984 2.113 . . . . 73.430000000000007 111.412 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 72.3 t80 -63.67 -37.95 89.28 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.474 -0.766 . . . . 73.519999999999996 110.656 176.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.2 -14.25 61.59 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 120.858 -1.151 . . . . 75.439999999999998 112.741 177.259 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 22.8 mt -70.08 -31.98 69.82 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 120.169 1.35 . . . . 63.32 110.405 172.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 17.0 p -90.35 -20.06 23.3 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 120.929 -1.107 . . . . 54.109999999999999 111.247 -171.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 57.5 t -68.85 88.35 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 125.787 1.635 . . . . 73.530000000000001 108.615 168.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 20.1 t -134.83 138.97 48.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 106.773 -1.565 . . . . 74.120000000000005 106.773 148.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 66.3 p -154.47 167.99 28.19 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 128.437 2.695 . . . . 74.420000000000002 107.362 175.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.5 m -163.42 100.38 0.93 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 125.997 1.719 . . . . 71.049999999999997 106.726 169.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -156.1 45.72 0.45 Allowed 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 119.74 1.155 . . . . 61.409999999999997 113.453 161.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -132.55 -12.87 3.02 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 120.945 -1.097 . . . . 72.409999999999997 111.576 179.54 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -65.85 -19.05 65.74 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.949 -1.094 . . . . 73.409999999999997 110.794 174.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -145.91 155.78 51.65 Favored Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 126.375 1.87 . . . . 72.040000000000006 108.536 -163.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -73.74 101.16 1.35 Allowed 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 122.942 2.428 . . . . 65.120000000000005 111.968 -161.131 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -109.22 169.0 13.55 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 124.879 1.228 . . . . 65.030000000000001 113.243 -173.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.482 ' CG ' ' H ' ' A' ' 66' ' ' GLU . 7.1 p-10 -84.06 -82.06 0.17 Allowed 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 105.955 -1.869 . . . . 71.010000000000005 105.955 173.475 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.482 ' H ' ' CG ' ' A' ' 65' ' ' ASP . 9.1 tt0 -162.61 81.19 0.51 Allowed 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 119.911 1.232 . . . . 74.439999999999998 109.662 -178.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -111.26 -60.8 1.79 Allowed 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 118.316 -0.85 . . . . 62.450000000000003 110.907 -171.597 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.5 p -79.13 -53.62 13.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 C-N-CA 123.559 0.744 . . . . 74.120000000000005 110.536 176.483 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -56.62 -35.42 68.28 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-O 118.745 -0.645 . . . . 73.319999999999993 109.855 -175.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -48.05 -59.27 3.5 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.078 0.951 . . . . 74.239999999999995 111.578 174.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -72.44 -37.93 68.44 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 118.819 -0.61 . . . . 73.340000000000003 110.058 -175.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.58 -47.27 70.27 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 119.152 0.887 . . . . 74.230000000000004 110.544 -176.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.69 -16.76 63.92 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.473 1.109 . . . . 72.319999999999993 111.121 179.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -77.28 -47.42 20.13 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.013 0.824 . . . . 60.109999999999999 110.843 168.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.95 -24.08 67.71 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.473 1.109 . . . . 73.219999999999999 111.203 177.467 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 79.3 mt -117.17 31.43 6.75 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 126.345 1.858 . . . . 74.450000000000003 111.478 177.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -55.78 117.92 4.09 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 107.211 -1.403 . . . . 72.120000000000005 107.211 168.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 95.63 -10.54 68.76 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 126.317 1.913 . . . . 73.540000000000006 113.713 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.2 mtpp -126.7 1.52 6.78 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 119.696 1.748 . . . . 72.25 113.756 -165.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -151.0 174.31 13.29 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 119.043 0.838 . . . . 73.239999999999995 110.356 172.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -140.47 168.82 18.89 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 127.26 2.224 . . . . 70.310000000000002 105.798 174.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -57.98 -46.16 85.62 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.007 0.923 . . . . 74.310000000000002 111.64 -171.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -76.35 -16.47 59.74 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-O 119.485 -0.293 . . . . 73.420000000000002 110.903 -174.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 95.1 m -70.14 -56.81 5.91 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 107.947 -1.131 . . . . 74.549999999999997 107.947 165.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 47.8 mt -60.38 -55.96 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 C-N-CA 124.482 1.113 . . . . 74.340000000000003 109.938 -171.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.69 -28.08 63.47 Favored 'General case' 0 N--CA 1.456 -0.126 0 O-C-N 122.076 -0.39 . . . . 73.439999999999998 111.524 -175.01 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.62 -46.88 13.76 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.794 0.837 . . . . 74.420000000000002 110.285 -179.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.52 -40.52 75.18 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 122.939 0.495 . . . . 74.219999999999999 110.329 -165.292 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 9.5 mtt -61.26 -43.86 98.18 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 119.143 -0.456 . . . . 71.319999999999993 110.845 -179.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 49.8 t -65.41 -34.89 73.53 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 125.18 1.392 . . . . 74.340000000000003 110.656 -176.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 -55.82 -54.65 41.9 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 108.748 -0.834 . . . . 74.519999999999996 108.748 178.072 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 42.6 mt -71.89 -1.97 16.24 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 126.563 1.945 . . . . 74.129999999999995 112.601 -172.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 27.5 ttp180 -57.13 -52.15 66.46 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 123.912 0.885 . . . . 74.25 110.625 -175.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.85 -49.79 73.51 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.355 1.062 . . . . 74.530000000000001 110.028 177.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.8 m -52.63 -49.99 64.05 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 129.563 3.145 . . . . 71.519999999999996 109.927 -174.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -53.3 -34.88 59.15 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.577 0.751 . . . . 72.430000000000007 111.637 -179.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 9.1 mtm180 -79.01 -45.58 19.93 Favored 'General case' 0 C--O 1.233 0.233 0 O-C-N 121.107 -0.995 . . . . 72.150000000000006 109.032 -177.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -60.35 -39.24 86.46 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 125.0 1.32 . . . . 72.150000000000006 111.164 178.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -56.54 -42.49 78.61 Favored 'General case' 0 C--O 1.221 -0.43 0 C-N-CA 124.577 1.151 . . . . 74.450000000000003 112.715 -177.033 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.5 mm -58.62 -44.9 90.6 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-N 119.996 1.271 . . . . 74.109999999999999 108.979 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 86.9 mt -73.46 -9.72 13.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 124.809 1.244 . . . . 73.219999999999999 110.056 -179.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -109.38 16.77 22.1 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.918 1.687 . . . . 45.350000000000001 109.705 177.105 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -122.63 18.11 10.37 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.51 1.924 . . . . 72.450000000000003 108.491 177.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 61.8 mt . . . . . 0 C--O 1.251 1.16 0 CA-C-O 115.859 -2.02 . . . . 74.329999999999998 106.593 173.951 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.477 0.889 0 N-CA-C 116.792 2.145 . . . . 72.230000000000004 116.792 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -45.93 106.6 0.08 Allowed 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.017 1.727 . . . . 71.450000000000003 112.714 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 54.57 -5.32 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 128.525 2.73 . . . . 73.510000000000005 116.392 -171.547 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 48.7 mttt -58.0 -26.97 63.07 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 127.071 2.148 . . . . 62.149999999999999 113.952 -168.231 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -63.73 -9.42 14.21 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 114.106 1.15 . . . . 74.530000000000001 114.106 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -132.92 39.09 3.34 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 119.336 0.971 . . . . 24.440000000000001 110.143 173.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -146.44 -65.1 0.29 Allowed 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 107.057 -1.46 . . . . 64.420000000000002 107.057 169.219 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -67.04 158.05 31.99 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 127.052 2.141 . . . . 61.219999999999999 111.004 -172.704 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -89.04 -57.75 2.79 Favored 'General case' 0 C--O 1.223 -0.311 0 N-CA-C 108.811 -0.811 . . . . 73.540000000000006 108.811 163.069 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -49.58 -50.96 40.38 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.701 1.0 . . . . 40.210000000000001 113.701 -162.197 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 15.0 mt -76.43 -26.56 55.6 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 113.509 0.929 . . . . 75.129999999999995 113.509 -178.665 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -65.69 -51.35 60.11 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.975 1.31 . . . . 72.510000000000005 107.591 175.216 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -44.4 -49.24 9.76 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 128.936 2.895 . . . . 73.450000000000003 111.359 -171.164 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.1 pttp -53.7 -51.61 62.72 Favored 'General case' 0 C--O 1.233 0.234 0 O-C-N 121.258 -0.901 . . . . 62.539999999999999 111.984 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.85 -30.4 50.97 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 113.283 0.845 . . . . 61.450000000000003 113.283 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -53.56 -41.25 66.3 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.704 1.602 . . . . 60.119999999999997 108.692 176.144 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.18 -86.03 0.32 Allowed 'General case' 0 C--N 1.345 0.389 0 CA-C-O 118.674 -0.679 . . . . 54.229999999999997 109.273 178.493 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.455 ' HB3' ' HB1' ' A' ' 96' ' ' ALA . 0.1 OUTLIER 48.61 -24.98 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.201 1 C-N-CA 132.121 4.168 . . . . 74.439999999999998 118.559 179.02 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.99 -36.81 13.37 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 128.516 2.726 . . . . 75.409999999999997 114.202 -167.576 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -107.67 -19.65 13.48 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.159 0.984 . . . . 72.530000000000001 110.155 -174.85 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.73 -32.16 71.44 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.973 1.309 . . . . 73.129999999999995 110.969 -176.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.503 ' CD1' HD23 ' A' ' 92' ' ' LEU . 0.2 OUTLIER -90.17 -5.71 56.14 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.912 0.885 . . . . 75.239999999999995 112.76 -175.288 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.432 HD11 ' HB2' ' A' ' 89' ' ' MET . 13.1 mt -81.19 -28.44 34.93 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 119.383 0.992 . . . . 60.340000000000003 113.464 -170.527 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -69.92 -34.32 71.18 Favored Glycine 0 C--O 1.223 -0.572 0 N-CA-C 109.089 -1.604 . . . . 51.25 109.089 169.355 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -65.2 -19.29 65.9 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 118.628 1.214 . . . . 62.43 112.295 176.391 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 32.1 t90 -77.13 -66.21 0.85 Allowed 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 125.594 1.558 . . . . 61.240000000000002 109.363 167.17 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.41 -31.18 61.65 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 118.407 -0.806 . . . . 61.119999999999997 112.805 -174.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -46.76 -63.29 1.06 Allowed 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 125.656 1.582 . . . . 34.299999999999997 110.567 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -55.63 -44.86 86.18 Favored Glycine 0 C--N 1.336 0.535 0 N-CA-C 111.235 -0.746 . . . . 55.030000000000001 111.235 -178.167 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 28.4 mt -62.85 -36.03 81.91 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.491 0.716 . . . . 73.439999999999998 111.814 -177.749 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 77.8 mt -82.7 1.17 39.96 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.114 1.766 . . . . 62.109999999999999 112.495 176.35 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 84.24 12.18 76.74 Favored Glycine 0 CA--C 1.527 0.797 0 C-N-CA 125.202 1.382 . . . . 74.450000000000003 113.915 177.626 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -87.78 133.07 33.94 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.852 1.261 . . . . 75.209999999999994 107.969 -177.591 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 33.0 p -140.84 167.84 21.22 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 125.966 1.706 . . . . 51.539999999999999 107.883 -179.025 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 56.19 -134.69 50.43 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 111.476 -0.65 . . . . 55.210000000000001 111.476 175.619 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -68.3 -26.96 65.9 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 117.59 0.695 . . . . 74.25 111.542 178.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.24 -35.56 77.57 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 123.606 0.762 . . . . 72.219999999999999 110.474 176.324 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.61 -48.02 24.05 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.178 -0.675 . . . . 54.149999999999999 109.178 173.09 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -62.49 -47.57 83.37 Favored 'General case' 0 C--O 1.226 -0.141 0 N-CA-C 109.846 -0.427 . . . . 71.310000000000002 109.846 -168.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.87 -42.83 84.96 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.454 1.102 . . . . 73.450000000000003 110.511 -177.584 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 31.6 t80 -58.32 -46.33 86.4 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 122.669 0.387 . . . . 72.109999999999999 110.274 175.573 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.17 -36.44 68.33 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 121.465 -0.772 . . . . 45.409999999999997 111.75 178.184 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 44.2 mt -75.17 10.14 1.68 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.292 1.437 . . . . 55.009999999999998 112.259 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.7 t -133.68 34.52 3.42 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 120.098 1.317 . . . . 72.430000000000007 111.248 169.312 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 81.4 t -132.18 85.33 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 O-C-N 121.081 -1.012 . . . . 72.120000000000005 108.853 177.207 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 16.4 t -151.1 122.54 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 124.615 1.166 . . . . 54.530000000000001 109.5 170.037 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 6.5 t -149.17 -38.97 0.15 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.202 1.001 . . . . 75.439999999999998 111.445 162.065 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.5 m . . . . . 0 CA--C 1.542 0.64 0 C-N-CA 126.312 1.845 . . . . 73.239999999999995 112.958 -176.125 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.514 ' OD2' ' HE2' ' A' ' 71' ' ' LYS . 0.6 OUTLIER . . . . . 0 N--CA 1.465 0.298 0 CA-C-O 118.777 -0.63 . . . . 74.329999999999998 110.225 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 72.4 t -57.07 -43.81 81.89 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 CA-C-N 120.304 1.411 . . . . 73.409999999999997 111.342 -173.171 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -56.91 -53.97 51.89 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.694 1.198 . . . . 54.049999999999997 109.185 175.624 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 26.8 ttm-85 -53.83 -42.18 68.19 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 125.679 1.591 . . . . 74.150000000000006 112.067 178.595 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.514 ' HE2' ' OD2' ' A' ' 67' ' ' ASP . 5.5 mptp? -75.25 -47.61 27.25 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 118.322 0.51 . . . . 74.329999999999998 109.749 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 16.3 mt -59.55 -44.33 93.27 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 117.689 -1.148 . . . . 74.510000000000005 110.444 -179.311 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.22 -18.79 64.86 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.988 1.267 . . . . 60.109999999999999 112.364 -177.293 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -87.4 -52.67 5.24 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.513 1.125 . . . . 62.240000000000002 110.371 170.213 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -60.18 -48.08 83.25 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 121.044 -1.035 . . . . 72.129999999999995 110.012 -174.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.8 tp -91.32 15.62 11.71 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 130.348 3.459 . . . . 64.340000000000003 111.577 -175.194 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -55.87 109.87 0.64 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.488 1.515 . . . . 72.319999999999993 109.88 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 110.05 -4.38 30.25 Favored Glycine 0 CA--C 1.528 0.847 0 C-N-CA 125.425 1.488 . . . . 52.409999999999997 112.511 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -133.05 -5.76 3.08 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.046 1.338 . . . . 73.319999999999993 113.275 -171.463 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -146.33 130.07 17.08 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.507 0.67 . . . . 52.539999999999999 110.602 169.01 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.39 161.13 25.88 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 126.262 1.825 . . . . 74.409999999999997 107.616 164.498 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -58.54 -45.13 89.56 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.973 0.892 . . . . 71.310000000000002 109.35 175.348 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -70.52 -27.89 64.53 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.689 0.796 . . . . 74.120000000000005 112.373 179.294 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 47.6 m -68.28 -36.19 79.0 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.665 0.786 . . . . 65.420000000000002 110.209 175.45 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 10.4 mt -69.65 -60.83 2.05 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 CA-C-N 119.937 1.244 . . . . 60.439999999999998 108.566 169.348 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.55 -18.5 65.4 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 114.173 1.175 . . . . 73.120000000000005 114.173 -164.81 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -91.91 -31.27 15.73 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 119.208 0.913 . . . . 62.240000000000002 110.419 178.181 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -64.34 -66.86 0.49 Allowed 'General case' 0 CA--C 1.514 -0.419 0 CA-C-N 119.21 0.914 . . . . 71.519999999999996 111.028 -173.405 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.432 ' HB2' HD11 ' A' ' 33' ' ' LEU . 5.3 ptt? -66.66 -14.91 63.06 Favored 'General case' 0 N--CA 1.462 0.162 0 N-CA-C 113.592 0.96 . . . . 54.149999999999999 113.592 -162.878 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 37.4 t -45.67 -49.2 4.29 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 C-N-CA 127.019 2.128 . . . . 72.140000000000001 111.794 166.391 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -82.0 -21.26 37.16 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 119.502 1.046 . . . . 72.510000000000005 111.838 -169.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.503 HD23 ' CD1' ' A' ' 32' ' ' LEU . 7.0 mp -66.47 -7.37 19.19 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 126.855 2.062 . . . . 73.430000000000007 111.454 -168.687 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 30.3 mtp180 -54.39 -42.17 70.08 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 122.95 0.5 . . . . 71.340000000000003 110.408 168.165 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.3 -52.59 8.93 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.617 0.767 . . . . 61.420000000000002 110.293 174.834 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.0 m -52.84 -29.59 28.77 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.048 0.939 . . . . 74.530000000000001 112.039 -177.523 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.455 ' HB1' ' HB3' ' A' ' 28' ' ' ARG . . . -55.18 -50.87 68.25 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 125.647 1.579 . . . . 44.520000000000003 114.135 177.65 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 9.3 ptt180 -75.47 -41.56 55.29 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 109.566 -0.531 . . . . 74.230000000000004 109.566 178.867 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -48.78 -55.87 10.28 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 126.687 1.995 . . . . 60.210000000000001 111.711 177.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -64.28 -25.39 68.03 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.792 0.724 . . . . 73.140000000000001 112.523 -174.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.8 mm -77.36 -44.58 30.26 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.254 0 O-C-N 120.707 -1.246 . . . . 71.340000000000003 109.452 176.826 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 91.8 mt -71.67 -10.46 13.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 C-N-CA 124.844 1.258 . . . . 75.510000000000005 110.501 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 10.7 t -86.72 -56.14 3.54 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.926 1.29 . . . . 60.119999999999997 108.65 170.581 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 66.8 mt-10 -101.61 56.87 0.83 Allowed 'General case' 0 C--O 1.236 0.385 0 N-CA-C 106.881 -1.525 . . . . 65.430000000000007 106.881 -168.438 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 83.6 mt . . . . . 0 C--O 1.25 1.107 0 C-N-CA 123.816 0.847 . . . . 71.430000000000007 109.038 -172.202 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . 0.327 1.1 p-80 . . . . . 0 CA--C 1.546 0.801 0 N-CA-C 113.637 0.976 . . . . 73.400000000000006 113.637 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 44.75 90.38 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.358 1.863 . . . . 70.439999999999998 113.988 177.272 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 60.69 -3.54 0.14 Allowed 'General case' 0 C--O 1.237 0.397 0 C-N-CA 128.2 2.6 . . . . 74.540000000000006 115.786 -166.13 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -60.56 -13.73 15.8 Favored 'General case' 0 C--O 1.218 -0.594 0 O-C-N 120.488 -1.382 . . . . 74.340000000000003 112.507 159.043 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -48.6 -41.05 29.61 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.868 1.213 . . . . 72.510000000000005 112.198 163.334 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -82.54 -41.83 19.15 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 118.401 0.546 . . . . 54.399999999999999 111.217 174.202 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -72.41 -44.63 62.18 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.245 1.018 . . . . 54.399999999999999 112.704 -167.507 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -120.08 105.62 11.19 Favored 'General case' 0 CA--C 1.517 -0.316 0 C-N-CA 127.088 2.155 . . . . 62.43 105.59 -175.146 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.36 -14.52 56.81 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 113.087 0.773 . . . . 51.200000000000003 113.087 -172.32 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -64.11 -35.72 81.67 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.952 0.901 . . . . 64.129999999999995 109.683 175.591 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.8 mt -70.85 -37.69 73.13 Favored 'General case' 0 C--O 1.234 0.265 0 O-C-N 120.881 -1.137 . . . . 74.409999999999997 111.086 174.265 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -60.01 -50.5 73.51 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 118.946 -0.55 . . . . 74.120000000000005 110.153 172.444 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -52.61 -56.91 12.08 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 126.103 1.761 . . . . 74.140000000000001 109.68 -178.703 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -45.12 -49.14 12.02 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 124.731 1.212 . . . . 63.439999999999998 111.407 -179.273 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -76.82 -40.18 48.83 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.055 0.761 . . . . 62.119999999999997 113.055 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -66.78 -19.03 65.66 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.063 -1.023 . . . . 73.5 110.256 178.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -90.15 13.88 13.93 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 127.656 2.382 . . . . 72.430000000000007 112.289 170.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.6 mmt85 -108.77 -30.37 8.2 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 120.065 1.302 . . . . 71.510000000000005 112.411 172.508 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.3 ptt85 -57.43 -15.95 8.13 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 115.582 1.697 . . . . 65.510000000000005 115.582 -169.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -121.3 -15.09 8.2 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 126.218 1.807 . . . . 74.140000000000001 111.168 -178.45 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.62 -22.56 65.33 Favored 'General case' 0 N--CA 1.471 0.591 0 O-C-N 120.698 -1.251 . . . . 74.239999999999995 111.64 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.447 HD12 ' H ' ' A' ' 32' ' ' LEU . 0.1 OUTLIER -106.17 -14.17 15.22 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.575 1.55 . . . . 71.150000000000006 114.128 -171.873 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.52 -34.35 17.01 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 125.422 1.489 . . . . 53.140000000000001 113.355 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -61.81 -24.34 64.42 Favored Glycine 0 CA--C 1.526 0.732 0 CA-C-O 118.386 -1.23 . . . . 63.140000000000001 113.379 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -65.24 -31.0 71.93 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.687 2.243 . . . . 63.43 112.488 -177.393 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.431 ' CD1' ' HE3' ' A' ' 88' ' ' LYS . 22.9 t90 -63.8 -72.37 0.14 Allowed 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 125.6 1.56 . . . . 73.239999999999995 108.492 175.02 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.47 -17.13 63.56 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 124.916 1.287 . . . . 60.140000000000001 113.917 -176.638 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -54.34 -57.41 11.37 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 119.352 0.978 . . . . 60.350000000000001 109.066 173.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.65 -38.25 93.49 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 111.347 -0.701 . . . . 75.109999999999999 111.347 -179.452 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.5 mp -61.22 -38.37 86.37 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.495 -1.003 . . . . 74.040000000000006 111.064 178.127 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 95.6 mt -89.14 5.84 42.76 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 127.04 2.136 . . . . 73.450000000000003 113.068 176.218 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 74.54 9.65 82.18 Favored Glycine 0 CA--C 1.534 1.226 0 C-N-CA 125.388 1.47 . . . . 44.240000000000002 114.424 177.217 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.9 mttt -85.82 137.96 32.4 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 119.341 1.57 . . . . 52.549999999999997 106.983 173.251 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 37.0 p -138.85 -178.0 5.13 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.664 -0.865 . . . . 75.230000000000004 108.664 168.451 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 47.47 -117.28 3.22 Favored Glycine 0 CA--C 1.524 0.619 0 C-N-CA 125.288 1.423 . . . . 31.239999999999998 112.941 174.321 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -82.65 -16.59 47.69 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.015 1.726 . . . . 75.140000000000001 112.686 -172.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -76.14 -48.8 19.27 Favored 'General case' 0 CA--C 1.512 -0.486 0 O-C-N 120.912 -1.118 . . . . 62.240000000000002 109.016 169.231 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -56.81 -42.99 80.51 Favored 'General case' 0 N--CA 1.445 -0.72 0 N-CA-C 108.748 -0.834 . . . . 61.119999999999997 108.748 175.365 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.3 ttm-85 -51.42 -47.72 62.91 Favored 'General case' 0 N--CA 1.437 -1.107 0 N-CA-C 112.96 0.726 . . . . 75.329999999999998 112.96 173.186 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.69 -49.25 66.69 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 118.091 0.405 . . . . 73.450000000000003 110.435 -178.037 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -52.34 -44.93 65.45 Favored 'General case' 0 N--CA 1.457 -0.093 0 C-N-CA 123.435 0.694 . . . . 72.230000000000004 110.696 175.656 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.46 -30.82 63.36 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 118.421 -0.8 . . . . 43.409999999999997 112.623 -174.791 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 18.0 mt -75.5 -3.89 36.63 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.2 1.0 . . . . 64.25 111.861 -175.187 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.6 t -133.3 49.27 2.31 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.589 1.156 . . . . 63.149999999999999 109.575 179.655 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 2.0 t -127.98 12.98 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 O-C-N 120.857 -1.152 . . . . 71.450000000000003 110.669 173.151 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 4.5 m -74.24 53.21 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 125.938 1.695 . . . . 64.549999999999997 112.144 176.194 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.1 t -79.76 60.82 3.52 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.275 1.43 . . . . 65.140000000000001 108.912 178.4 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.3 m . . . . . 0 C--O 1.238 0.497 0 N-CA-C 109.919 -0.4 . . . . 64.25 109.919 169.602 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.464 0.273 0 N-CA-C 112.431 0.53 . . . . 64.25 112.431 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 78.3 t -57.99 -43.62 85.25 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 123.823 0.849 . . . . 65.530000000000001 110.315 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -76.27 -32.51 58.85 Favored 'General case' 0 C--O 1.233 0.224 0 O-C-N 121.118 -0.989 . . . . 74.109999999999999 109.546 -179.084 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -50.56 -50.38 53.71 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 125.071 1.348 . . . . 71.219999999999999 112.089 -172.438 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -71.7 -23.6 61.67 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 119.301 0.955 . . . . 63.520000000000003 111.515 -171.213 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 9.5 mt -74.75 -61.31 1.92 Allowed 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.25 -1.019 . . . . 74.219999999999999 108.25 168.262 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.12 -37.6 64.5 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.293 1.037 . . . . 53.039999999999999 113.09 -173.13 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.18 -38.79 87.78 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 123.29 0.636 . . . . 74.209999999999994 111.491 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -74.52 -56.88 4.35 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 122.858 1.313 . . . . 72.25 108.43 175.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.4 tp -77.15 16.67 0.54 Allowed 'General case' 0 CA--C 1.534 0.329 1 C-N-CA 131.836 4.054 . . . . 64.209999999999994 113.963 -168.861 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 55.6 tt0 -52.4 122.33 8.6 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 127.14 2.176 . . . . 70.540000000000006 110.464 -174.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 102.27 -15.43 56.3 Favored Glycine 0 CA--C 1.53 1.01 0 C-N-CA 127.249 2.357 . . . . 31.120000000000001 113.034 178.837 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 35.3 mtmt -126.06 -5.46 6.75 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 119.276 1.538 . . . . 70.120000000000005 114.88 -158.514 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -154.74 126.43 7.52 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 120.57 1.532 . . . . 73.349999999999994 110.026 171.084 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.14 163.52 27.77 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.72 1.208 . . . . 74.319999999999993 110.573 -178.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 77.0 mt-10 -48.56 -59.22 3.68 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 124.642 1.177 . . . . 73.340000000000003 110.433 170.853 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -68.29 -20.73 64.78 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.813 -0.631 . . . . 64.140000000000001 112.114 -175.117 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 18.8 m -80.16 -40.71 26.77 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.788 1.635 . . . . 61.210000000000001 110.032 176.121 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 77.4 mt -59.71 -56.56 16.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 C-N-CA 124.788 1.235 . . . . 64.299999999999997 107.689 173.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.81 -47.3 80.57 Favored 'General case' 0 C--N 1.341 0.199 0 O-C-N 123.614 0.571 . . . . 64.5 110.998 -174.847 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.54 -43.27 89.2 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.273 0.629 . . . . 54.439999999999998 111.559 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.431 ' HE3' ' CD1' ' A' ' 36' ' ' TRP . 12.3 tptp -66.7 -39.03 87.89 Favored 'General case' 0 C--O 1.223 -0.29 0 O-C-N 121.265 -0.897 . . . . 74.019999999999996 111.216 -176.003 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 18.0 ptp -72.14 -31.4 65.94 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 119.073 -1.051 . . . . 61.509999999999998 112.369 -174.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 71.9 t -49.97 -47.15 23.69 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 123.47 0.708 . . . . 65.109999999999999 109.233 167.182 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -50.58 -45.41 57.2 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.136 1.374 . . . . 62.329999999999998 113.501 -163.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -75.6 11.89 1.18 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.213 1.19 . . . . 65.420000000000002 114.213 -173.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 3.3 tpt85 -49.91 -53.07 28.38 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.844 1.258 . . . . 72.400000000000006 111.3 -178.677 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -63.01 -50.28 71.31 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 123.823 0.849 . . . . 61.210000000000001 109.999 175.739 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.8 m -50.18 -45.65 53.66 Favored 'General case' 0 C--N 1.333 -0.125 0 C-N-CA 125.912 1.685 . . . . 74.319999999999993 110.147 -173.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -54.63 -40.65 69.15 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 124.305 1.042 . . . . 71.150000000000006 112.676 -177.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -81.68 -40.32 23.01 Favored 'General case' 0 C--N 1.341 0.202 0 CA-C-O 117.463 -1.256 . . . . 74.140000000000001 111.929 172.622 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -52.35 -41.78 63.34 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 119.391 0.996 . . . . 73.439999999999998 110.834 -179.137 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 -56.27 -50.14 72.21 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 118.966 0.803 . . . . 73.120000000000005 112.024 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 43.8 mm -68.07 -42.74 85.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 123.353 0.661 . . . . 73.430000000000007 110.26 -175.339 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 24.1 mt -66.38 -21.14 28.25 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 N-CA-C 109.036 -0.727 . . . . 74.25 109.036 177.036 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 33.8 t -89.54 -6.07 56.68 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.584 1.154 . . . . 62.219999999999999 111.783 177.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -122.72 35.79 4.8 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 125.818 1.647 . . . . 72.030000000000001 108.812 -171.793 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 21.8 mm . . . . . 0 C--O 1.252 1.19 0 N-CA-C 107.46 -1.311 . . . . 74.209999999999994 107.46 172.687 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.573 0 N-CA-C 108.514 -0.921 . . . . 63.439999999999998 108.514 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 64.6 95.17 0.05 Allowed 'General case' 0 C--O 1.235 0.341 0 C-N-CA 126.87 2.068 . . . . 72.319999999999993 111.063 174.277 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 57.71 0.21 0.1 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 127.729 2.412 . . . . 64.129999999999995 114.21 -166.061 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 18.5 mmtm -66.33 -16.73 64.29 Favored 'General case' 0 C--O 1.221 -0.433 0 O-C-N 120.194 -1.566 . . . . 73.439999999999998 112.988 -178.268 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -50.22 -28.33 7.4 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 125.612 1.565 . . . . 72.409999999999997 114.826 173.132 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.95 -15.67 63.71 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.632 0.604 . . . . 71.239999999999995 112.632 178.373 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 64.4 t-80 -130.28 141.57 50.6 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 126.138 1.775 . . . . 74.120000000000005 108.129 -164.083 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 59.51 -175.84 0.1 Allowed 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.839 1.256 . . . . 74.150000000000006 109.532 -160.248 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -119.37 -19.07 8.39 Favored 'General case' 0 C--O 1.225 -0.21 0 O-C-N 121.146 -0.971 . . . . 74.349999999999994 111.883 164.078 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.88 -41.86 83.4 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.613 0.765 . . . . 73.140000000000001 110.516 -170.635 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.0 mt -71.96 -46.4 57.54 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 108.672 -0.862 . . . . 71.25 108.672 -175.465 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -61.45 -43.84 98.16 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 124.538 1.135 . . . . 73.439999999999998 111.977 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -58.79 -36.9 75.19 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 124.185 0.994 . . . . 74.140000000000001 111.014 -177.793 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.06 -29.65 44.97 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.821 0.848 . . . . 72.129999999999995 111.498 178.844 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.786 ' HB1' ' HA ' ' A' ' 97' ' ' ARG . . . -74.53 -54.06 8.24 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 124.717 1.207 . . . . 61.229999999999997 112.049 178.263 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.8 tp10 -55.87 -32.97 64.15 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.588 -0.695 . . . . 72.329999999999998 109.886 174.596 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -75.34 8.56 2.66 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.513 1.125 . . . . 70.349999999999994 112.31 178.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.2 mmt180 -87.91 -23.71 23.84 Favored 'General case' 0 C--O 1.231 0.111 0 O-C-N 120.656 -1.278 . . . . 74.209999999999994 111.142 166.557 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.3 ptt180 -67.19 -23.0 65.71 Favored 'General case' 0 C--N 1.344 0.364 0 CA-C-N 120.976 1.716 . . . . 54.299999999999997 115.185 -149.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -110.45 -12.33 14.4 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-O 118.222 -0.894 . . . . 73.420000000000002 112.02 170.503 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.46 -55.01 31.74 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 125.057 1.343 . . . . 74.0 110.405 171.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -66.22 -9.61 33.84 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.859 1.059 . . . . 73.299999999999997 113.859 -172.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.7 tp -56.33 -31.93 64.2 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 126.946 2.098 . . . . 65.329999999999998 111.291 171.68 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.49 -31.71 81.68 Favored Glycine 0 CA--C 1.532 1.141 0 O-C-N 121.252 -0.905 . . . . 74.430000000000007 112.325 176.59 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -68.86 -26.99 65.42 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.797 1.298 . . . . 74.239999999999995 110.768 -178.646 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 20.6 t90 -68.6 -65.26 0.72 Allowed 'General case' 0 N--CA 1.462 0.144 0 C-N-CA 124.87 1.268 . . . . 74.340000000000003 109.152 173.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.18 -41.36 71.83 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 118.765 -0.636 . . . . 63.119999999999997 111.878 -174.342 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -44.87 -60.8 1.87 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.523 1.129 . . . . 65.010000000000005 112.92 -178.728 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.65 -30.4 77.52 Favored Glycine 0 CA--C 1.528 0.898 0 CA-C-N 118.577 0.626 . . . . 72.340000000000003 112.58 -175.378 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 56.9 mt -68.13 -41.51 81.58 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.131 0.972 . . . . 72.129999999999995 110.012 175.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.8 mp -69.96 -1.84 10.81 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 126.387 1.875 . . . . 50.329999999999998 113.72 168.678 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 74.5 4.22 69.08 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 125.54 1.543 . . . . 65.319999999999993 113.679 -179.648 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 53.1 mttm -76.12 128.75 35.61 Favored 'General case' 0 CA--C 1.524 -0.033 0 CA-C-N 119.875 1.838 . . . . 71.430000000000007 106.856 170.757 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 p -134.72 166.29 23.29 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 123.823 0.849 . . . . 64.310000000000002 109.066 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 55.21 -129.74 46.42 Favored Glycine 0 CA--C 1.525 0.663 0 C-N-CA 123.667 0.651 . . . . 33.130000000000003 112.057 176.721 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -61.1 -36.2 79.05 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 124.645 1.178 . . . . 72.430000000000007 111.005 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.42 -37.33 86.88 Favored 'General case' 0 N--CA 1.465 0.303 0 O-C-N 121.179 -0.95 . . . . 70.319999999999993 111.296 177.394 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.44 -43.43 63.8 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 123.112 0.565 . . . . 74.310000000000002 109.858 177.434 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.5 ptp180 -65.6 -46.09 80.66 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 109.279 -0.637 . . . . 64.310000000000002 109.279 -173.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.25 -36.6 84.19 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.681 1.192 . . . . 62.310000000000002 111.542 -178.869 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -65.23 -45.8 83.18 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.646 0.779 . . . . 74.409999999999997 110.588 173.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -69.36 -14.95 63.2 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 114.211 1.189 . . . . 71.019999999999996 114.211 -174.031 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 64.3 mt -58.44 -20.54 45.77 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 119.432 1.014 . . . . 71.140000000000001 112.759 -176.515 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.0 t -135.32 32.12 3.13 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.352 1.061 . . . . 71.400000000000006 110.586 -168.748 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 95.0 t -113.61 99.57 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 N-CA-C 106.446 -1.687 . . . . 74.310000000000002 106.446 177.328 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 9.6 p -156.12 135.88 3.99 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 N-CA-C 107.089 -1.449 . . . . 71.230000000000004 107.089 164.49 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.7 t 177.21 155.77 0.29 Allowed 'General case' 0 C--O 1.235 0.341 0 C-N-CA 128.353 2.661 . . . . 73.239999999999995 105.477 172.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.2 p . . . . . 0 C--O 1.237 0.402 0 CA-C-N 119.012 0.824 . . . . 73.099999999999994 108.966 167.401 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.546 0.823 0 N-CA-C 116.195 1.924 . . . . 70.329999999999998 116.195 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 2.1 p -70.12 -57.49 7.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 C-N-CA 126.923 2.089 . . . . 52.509999999999998 109.388 174.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -63.48 -18.54 63.89 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 124.949 1.3 . . . . 74.430000000000007 112.282 -179.823 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -44.91 -46.81 11.14 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 119.967 1.258 . . . . 74.310000000000002 112.431 -172.418 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.1 mppt? -78.85 -1.4 34.82 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.163 0.985 . . . . 74.140000000000001 112.918 -174.491 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 72.1 mt -104.51 -54.33 2.54 Favored 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 126.265 1.826 . . . . 53.109999999999999 108.285 168.622 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.33 -54.15 44.21 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 126.133 1.773 . . . . 72.319999999999993 111.352 -170.091 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -76.18 -19.31 58.56 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 111.881 0.326 . . . . 74.299999999999997 111.881 -177.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.37 -50.79 35.21 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 108.007 -1.109 . . . . 71.030000000000001 108.007 173.748 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 79.9 mt -80.62 43.35 0.66 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 129.144 2.978 . . . . 70.420000000000002 110.573 175.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -52.56 104.25 0.09 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.729 1.611 . . . . 70.0 109.76 177.19 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 69.03 14.15 67.79 Favored Glycine 0 CA--C 1.533 1.179 0 CA-C-O 118.799 -1.001 . . . . 63.020000000000003 113.844 -177.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 25.0 mtmm -113.46 -11.19 13.13 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.287 1.543 . . . . 74.409999999999997 112.055 178.009 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -148.69 138.93 22.42 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.204 -1.035 . . . . 64.010000000000005 108.204 165.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.41 161.82 25.9 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 125.787 1.635 . . . . 62.210000000000001 109.407 176.386 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 85.0 mt-10 -59.83 -46.31 89.66 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.46 0.704 . . . . 74.439999999999998 110.091 175.434 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -74.01 -15.18 61.1 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 121.379 -0.826 . . . . 70.319999999999993 111.311 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.6 m -74.46 -32.88 62.74 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 117.785 -1.102 . . . . 54.43 109.975 171.124 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 11.7 mt -58.5 -60.31 2.47 Favored 'Isoleucine or valine' 0 C--O 1.239 0.516 0 CA-C-N 120.624 1.557 . . . . 74.310000000000002 108.874 177.685 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -53.37 -39.73 64.41 Favored 'General case' 0 C--N 1.343 0.314 0 O-C-N 124.679 1.237 . . . . 72.0 109.978 -178.68 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.25 -45.51 76.49 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 119.625 -0.226 . . . . 50.399999999999999 110.567 -176.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.36 -38.31 71.59 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.592 0.589 . . . . 74.340000000000003 112.592 -163.019 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 33.1 mtt -66.93 -0.73 3.31 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.251 -0.905 . . . . 44.409999999999997 112.684 176.165 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 46.6 t -120.58 -29.15 1.76 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 C-N-CA 126.482 1.913 . . . . 63.039999999999999 110.132 -178.568 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -55.67 -48.66 74.69 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.368 1.467 . . . . 74.430000000000007 109.007 175.822 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 15.3 mt -77.43 4.51 10.8 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.013 1.116 . . . . 54.310000000000002 114.013 -176.314 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 63.9 ttt180 -66.28 -20.64 66.16 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 120.654 -1.279 . . . . 61.240000000000002 113.543 -166.531 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -88.27 -46.19 9.42 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 119.658 1.117 . . . . 43.210000000000001 110.355 170.69 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 52.4 m -50.38 -36.19 31.51 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.261 1.024 . . . . 65.439999999999998 110.532 177.189 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -46.13 -49.58 16.54 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.22 1.008 . . . . 51.350000000000001 113.037 175.826 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.786 ' HA ' ' HB1' ' A' ' 25' ' ' ALA . 15.9 ptt-85 -79.88 -37.82 34.01 Favored 'General case' 0 C--N 1.342 0.259 0 CA-C-N 118.421 0.555 . . . . 64.450000000000003 110.911 -179.336 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -56.72 -38.11 71.9 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 124.572 1.149 . . . . 70.310000000000002 110.426 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -57.38 -36.73 71.63 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 119.203 0.911 . . . . 74.209999999999994 112.441 -175.167 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.9 mm -72.62 -48.47 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 CA-C-N 120.196 1.362 . . . . 64.230000000000004 107.885 177.619 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 70.1 mt -61.02 -13.63 7.9 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 C-N-CA 126.031 1.732 . . . . 71.329999999999998 110.745 -177.438 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -120.79 10.69 11.0 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.972 1.309 . . . . 62.439999999999998 112.106 -178.18 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 84.4 mt-10 -121.76 22.39 10.5 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.703 1.201 . . . . 73.329999999999998 110.446 174.079 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 35.2 mm . . . . . 0 C--O 1.256 1.407 0 C-N-CA 128.66 2.784 . . . . 73.120000000000005 110.599 -170.526 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.54 0.579 0 N-CA-C 114.84 1.422 . . . . 60.240000000000002 114.84 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -81.17 -85.6 0.1 Allowed 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.125 -0.985 . . . . 73.120000000000005 108.868 171.498 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.97 -14.76 61.08 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.95 0.722 . . . . 61.539999999999999 112.95 -174.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 25.2 mmtm -64.04 -12.22 36.57 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 118.227 -0.892 . . . . 74.120000000000005 113.154 -179.663 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -62.23 -17.26 57.84 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 120.622 1.555 . . . . 74.510000000000005 113.578 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -93.59 17.46 11.65 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.901 0.88 . . . . 75.510000000000005 111.825 173.487 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -143.37 -64.91 0.39 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.806 1.643 . . . . 75.450000000000003 110.813 -174.826 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -86.59 123.29 31.61 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 124.52 1.128 . . . . 75.329999999999998 111.406 -166.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.0 -33.99 75.66 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.386 1.074 . . . . 74.209999999999994 110.894 178.767 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -59.82 -24.39 64.13 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.869 0.867 . . . . 75.519999999999996 111.32 -175.429 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 48.7 mt -84.65 -46.07 11.86 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 124.992 1.317 . . . . 63.020000000000003 109.398 -179.317 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -50.6 -51.39 48.89 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.62 1.568 . . . . 62.340000000000003 108.68 176.299 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.79 -46.91 88.68 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 124.297 1.039 . . . . 71.409999999999997 111.606 -178.004 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -66.52 -39.26 88.54 Favored 'General case' 0 N--CA 1.44 -0.938 0 O-C-N 119.632 -1.917 . . . . 63.450000000000003 109.628 -177.097 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.8 -44.79 95.24 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 118.068 0.394 . . . . 74.340000000000003 111.894 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.3 tm-20 -53.61 -38.47 64.02 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.388 0.613 . . . . 75.010000000000005 110.307 173.714 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -78.24 1.76 20.52 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.945 0.898 . . . . 63.350000000000001 113.38 -175.739 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.4 mmt-85 -80.23 -19.08 47.74 Favored 'General case' 0 N--CA 1.464 0.245 0 O-C-N 120.268 -1.52 . . . . 72.450000000000003 110.95 164.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 45.2 mtp180 -52.95 -41.94 64.99 Favored 'General case' 0 C--N 1.342 0.279 0 N-CA-C 114.587 1.328 . . . . 72.030000000000001 114.587 -169.245 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -95.23 -31.02 13.69 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 123.813 0.695 . . . . 60.420000000000002 111.671 -177.626 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -44.6 -52.57 7.99 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.047 1.339 . . . . 74.239999999999995 111.536 -178.182 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.98 -5.08 44.59 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 114.805 1.409 . . . . 74.430000000000007 114.805 -169.441 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 25.7 tp -71.52 -32.52 68.29 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 127.141 2.176 . . . . 72.200000000000003 110.508 171.134 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -57.19 -48.59 78.78 Favored Glycine 0 C--N 1.34 0.793 0 N-CA-C 110.568 -1.013 . . . . 63.420000000000002 110.568 173.127 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -63.88 -30.13 71.24 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 124.807 1.243 . . . . 63.329999999999998 112.803 -170.259 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 9.1 t90 -63.89 -71.6 0.17 Allowed 'General case' 0 C--O 1.231 0.117 0 N-CA-C 107.446 -1.316 . . . . 72.120000000000005 107.446 171.478 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.1 -32.35 34.77 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 125.496 1.518 . . . . 72.040000000000006 112.394 -173.596 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -45.17 -52.95 8.75 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 119.383 0.992 . . . . 73.430000000000007 111.53 174.123 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.58 -42.22 97.64 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 111.63 -0.588 . . . . 73.209999999999994 111.63 -178.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.6 mp -61.68 -46.29 90.35 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 125.365 1.466 . . . . 74.319999999999993 109.988 177.72 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.2 mp -63.2 -28.49 70.08 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.89 0.876 . . . . 42.43 110.478 175.183 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 104.21 20.38 10.49 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 126.237 1.875 . . . . 63.32 112.181 176.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 39.7 mttm -89.97 133.26 34.9 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 107.461 -1.311 . . . . 74.430000000000007 107.461 169.352 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.6 p -132.71 162.28 31.84 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 123.577 0.751 . . . . 55.420000000000002 109.479 165.677 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.51 -135.75 22.51 Favored Glycine 0 N--CA 1.448 -0.508 0 N-CA-C 110.322 -1.111 . . . . 33.149999999999999 110.322 175.049 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -66.22 -27.22 67.81 Favored 'General case' 0 C--O 1.226 -0.175 0 O-C-N 122.297 -0.531 . . . . 60.310000000000002 112.389 -177.515 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -56.61 -50.08 73.04 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.997 1.319 . . . . 75.239999999999995 109.123 174.322 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.13 -40.14 71.6 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 125.44 1.496 . . . . 72.030000000000001 110.299 -177.457 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.7 ttt85 -59.84 -49.96 75.68 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 123.334 0.654 . . . . 60.340000000000003 109.596 177.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.62 -44.78 95.92 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.153 0.981 . . . . 55.240000000000002 110.684 -178.527 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 88.6 t80 -57.08 -39.02 74.15 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.498 1.119 . . . . 73.239999999999995 111.099 175.218 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.85 -4.19 30.24 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 120.59 -1.319 . . . . 61.439999999999998 113.229 178.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 12.9 mt -84.62 -0.07 52.01 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 120.547 1.522 . . . . 62.229999999999997 112.145 176.228 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 12.0 t -130.49 37.72 3.82 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 120.621 1.555 . . . . 52.32 112.054 -173.525 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 1.8 p -134.88 99.0 2.37 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 O-C-N 121.021 -1.049 . . . . 73.439999999999998 110.552 -175.612 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.2 p -159.59 109.36 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 124.147 0.979 . . . . 55.399999999999999 113.246 166.402 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.4 t -149.45 57.9 1.0 Allowed 'General case' 0 CA--C 1.554 1.098 0 O-C-N 121.202 -0.936 . . . . 44.240000000000002 111.246 177.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.4 t . . . . . 0 CA--C 1.542 0.641 0 O-C-N 120.218 -1.551 . . . . 61.049999999999997 110.026 -175.059 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.5 t0 . . . . . 0 N--CA 1.469 0.512 0 N-CA-C 112.868 0.692 . . . . 62.119999999999997 112.868 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.2 t -55.19 -59.44 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-N 118.761 0.71 . . . . 75.439999999999998 109.499 174.551 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -57.59 -36.51 71.83 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.497 0.719 . . . . 75.040000000000006 110.612 -178.486 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.6 tpt180 -58.88 -26.58 64.41 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 124.489 1.116 . . . . 72.120000000000005 112.439 -178.338 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.7 mmmt -99.41 -43.84 6.41 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 118.488 0.585 . . . . 75.329999999999998 109.505 175.061 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -57.44 -54.8 42.7 Favored 'General case' 0 C--O 1.223 -0.341 0 C-N-CA 124.857 1.263 . . . . 75.010000000000005 110.204 -174.627 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.09 -4.0 15.46 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 114.006 1.113 . . . . 32.030000000000001 114.006 -178.741 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -87.19 -57.47 2.95 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 108.399 -0.963 . . . . 74.200000000000003 108.399 166.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.05 -43.3 70.09 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 125.068 1.347 . . . . 74.439999999999998 110.653 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.3 tp -110.88 19.85 18.13 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 126.841 2.056 . . . . 75.439999999999998 111.512 -165.153 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 69.5 tt0 -48.64 118.9 2.76 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 126.007 1.723 . . . . 71.219999999999999 108.284 172.022 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 81.11 -0.58 87.21 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 125.517 1.532 . . . . 75.120000000000005 114.78 178.588 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 11.3 mtpp -119.54 1.88 11.18 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 118.899 1.35 . . . . 75.239999999999995 111.785 -172.438 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -148.68 -163.08 1.7 Allowed 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 125.654 1.582 . . . . 75.230000000000004 107.194 168.679 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -145.65 158.2 43.88 Favored 'General case' 0 CA--C 1.51 -0.562 0 C-N-CA 125.898 1.679 . . . . 60.340000000000003 108.05 -175.004 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -59.85 -42.52 93.83 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 118.577 0.626 . . . . 51.329999999999998 111.596 -178.466 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.92 -39.41 72.72 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.021 0.373 . . . . 75.430000000000007 111.128 176.723 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 53.7 m -59.81 -48.18 82.71 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.197 0.999 . . . . 75.200000000000003 110.819 177.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 64.6 mt -63.34 -50.41 78.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 108.447 -0.945 . . . . 73.129999999999995 108.447 -177.766 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.97 -40.44 97.73 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 120.703 -0.399 . . . . 74.25 110.071 -176.479 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.8 -54.82 41.82 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 118.156 -0.926 . . . . 71.030000000000001 110.37 176.324 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.21 -56.58 12.1 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 118.937 0.789 . . . . 73.209999999999994 111.698 -176.737 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 8.9 ptp -66.09 -26.88 67.68 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 119.468 -0.893 . . . . 61.119999999999997 111.603 -173.15 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 59.7 t -78.9 -51.99 16.07 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 O-C-N 121.089 -1.007 . . . . 75.340000000000003 110.432 176.646 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -61.1 -31.46 71.15 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.594 1.158 . . . . 73.310000000000002 112.305 -162.489 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 18.1 mt -75.63 1.1 15.36 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.57 1.548 . . . . 74.140000000000001 112.894 -177.815 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 30.4 ttt180 -50.89 -45.81 60.3 Favored 'General case' 0 C--N 1.34 0.195 0 C-N-CA 124.433 1.093 . . . . 60.310000000000002 111.008 177.645 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -56.21 -61.61 2.28 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.707 0.803 . . . . 71.049999999999997 110.961 174.807 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 10.9 m -49.26 -37.35 23.26 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 127.265 2.226 . . . . 75.219999999999999 111.993 -175.045 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -51.08 -30.7 16.66 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.623 1.169 . . . . 72.329999999999998 113.469 -178.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 34.2 ttp180 -69.2 -60.3 2.44 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 108.582 -0.896 . . . . 74.310000000000002 108.582 174.643 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 11.8 mp0 -55.52 -35.1 65.28 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 118.002 -0.999 . . . . 63.329999999999998 110.651 -173.207 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -50.63 -45.77 57.89 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-O 118.409 -0.805 . . . . 72.340000000000003 112.483 -178.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 45.7 mm -63.77 -46.37 94.66 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-N 119.33 0.968 . . . . 62.149999999999999 109.72 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 32.4 mt -70.11 -12.03 15.62 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 124.614 1.166 . . . . 74.519999999999996 109.452 179.399 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 13.1 t -108.21 10.2 27.93 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.93 1.692 . . . . 41.030000000000001 109.154 179.304 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -112.81 12.53 19.54 Favored 'General case' 0 C--O 1.232 0.162 0 O-C-N 119.93 -1.732 . . . . 72.329999999999998 109.941 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 31.8 mt . . . . . 0 C--O 1.251 1.163 0 N-CA-C 107.704 -1.221 . . . . 72.450000000000003 107.704 -178.619 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.678 0 N-CA-C 116.256 1.947 . . . . 61.310000000000002 116.256 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -61.96 119.58 9.12 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.984 0.914 . . . . 73.219999999999999 110.679 -177.54 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 56.06 -22.4 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 130.447 3.499 . . . . 42.539999999999999 116.883 -174.229 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 32.6 mmtt -50.01 -28.86 7.59 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 128.754 2.822 . . . . 63.229999999999997 113.37 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.49 -25.31 64.34 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 113.014 0.746 . . . . 72.129999999999995 113.014 -176.076 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.39 -8.13 43.82 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.152 0.797 . . . . 71.219999999999999 113.152 176.157 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 13.3 t-80 -145.06 -171.39 3.64 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 125.96 1.704 . . . . 74.040000000000006 108.03 -160.301 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 58.3 -164.19 0.19 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.228 1.411 . . . . 60.299999999999997 110.365 170.228 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -143.44 -39.18 0.32 Allowed 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.847 1.259 . . . . 63.020000000000003 110.756 167.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -54.67 -43.67 72.62 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 119.554 1.07 . . . . 64.239999999999995 111.586 -172.726 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 80.4 mt -75.1 -33.89 61.68 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 123.872 0.869 . . . . 74.439999999999998 112.444 177.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -69.93 -36.8 75.62 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.343 1.457 . . . . 72.099999999999994 110.698 -177.545 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -46.13 -35.96 5.47 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 128.458 2.703 . . . . 60.240000000000002 113.76 -173.06 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.09 -53.44 57.78 Favored 'General case' 0 C--O 1.225 -0.212 0 O-C-N 120.652 -1.28 . . . . 73.299999999999997 111.138 175.685 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.74 -39.41 84.25 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 118.985 0.811 . . . . 73.030000000000001 111.884 178.172 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -50.94 -37.57 45.15 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.73 1.212 . . . . 74.5 110.814 -176.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -110.08 -85.34 0.55 Allowed 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.607 -0.886 . . . . 74.540000000000006 108.607 178.767 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 50.37 -12.95 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 129.128 2.971 . . . . 73.239999999999995 117.414 -173.375 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 30.7 mtm180 -44.45 -48.59 9.99 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 126.958 2.103 . . . . 74.109999999999999 113.186 -158.651 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -100.25 -24.3 14.59 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 122.456 0.302 . . . . 62.119999999999997 111.257 -177.254 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -7.89 1.06 Allowed 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 126.949 2.1 . . . . 75.150000000000006 114.225 -173.126 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.415 ' H ' HD23 ' A' ' 32' ' ' LEU . 2.4 pt? -120.72 -15.16 8.45 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 119.872 1.215 . . . . 62.399999999999999 112.919 -178.424 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 12.3 tp -60.56 -21.14 62.23 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 127.707 2.403 . . . . 55.219999999999999 111.891 172.254 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -70.22 -42.29 66.87 Favored Glycine 0 C--O 1.224 -0.499 0 N-CA-C 110.48 -1.048 . . . . 61.039999999999999 110.48 175.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -61.82 -39.35 91.47 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.548 1.174 . . . . 71.219999999999999 110.663 179.193 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 36.1 t90 -55.03 -63.47 1.14 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.627 0.771 . . . . 75.140000000000001 109.375 172.646 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.83 -29.4 69.86 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.069 0.948 . . . . 54.350000000000001 113.337 -173.27 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -55.59 -54.46 43.82 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 124.317 1.047 . . . . 60.420000000000002 110.136 -177.011 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -67.37 -5.83 37.67 Favored Glycine 0 CA--C 1.532 1.117 0 CA-C-O 119.032 -0.871 . . . . 73.239999999999995 113.687 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 35.8 mt -90.93 -37.06 13.76 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 119.339 1.57 . . . . 63.020000000000003 110.42 171.376 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.416 HD23 ' HE2' ' A' ' 79' ' ' LYS . 47.2 mt -91.36 8.79 34.43 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.58 1.952 . . . . 73.150000000000006 113.163 -173.79 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 75.65 5.25 78.13 Favored Glycine 0 CA--C 1.527 0.786 0 CA-C-O 119.274 -0.737 . . . . 41.549999999999997 113.0 -177.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.1 mttm -78.91 119.66 22.41 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 119.072 1.436 . . . . 64.040000000000006 107.125 -179.311 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 67.1 p -135.29 175.95 9.12 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 107.789 -1.189 . . . . 64.140000000000001 107.789 159.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 58.12 -145.25 41.26 Favored Glycine 0 CA--C 1.532 1.096 0 N-CA-C 111.571 -0.612 . . . . 60.409999999999997 111.571 -172.69 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -58.0 -31.32 66.84 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.312 1.045 . . . . 72.340000000000003 111.348 -172.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -63.57 -42.86 98.29 Favored 'General case' 0 C--O 1.225 -0.224 0 C-N-CA 123.8 0.84 . . . . 73.030000000000001 110.966 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.3 -41.54 69.81 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.856 -0.794 . . . . 71.439999999999998 108.856 177.299 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.8 ptt-85 -73.07 -41.64 63.91 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 119.368 -0.933 . . . . 73.439999999999998 108.928 -169.088 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.18 -42.33 99.36 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 123.517 0.727 . . . . 74.129999999999995 110.958 176.263 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -58.1 -46.09 86.1 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.3 0.5 . . . . 75.329999999999998 110.318 173.152 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.97 -12.93 5.15 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.541 1.136 . . . . 75.230000000000004 113.226 176.73 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 56.3 mt -101.6 1.44 37.82 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.759 1.624 . . . . 75.349999999999994 112.63 -177.647 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.8 t -125.23 -9.77 7.02 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 119.501 1.046 . . . . 75.150000000000006 112.502 176.235 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 12.3 m -70.71 84.39 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 C-N-CA 126.13 1.772 . . . . 64.230000000000004 111.756 175.016 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 2.9 p -139.99 132.98 35.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 O-C-N 121.167 -0.958 . . . . 61.32 111.804 151.017 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.1 t -148.47 -164.86 2.12 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 106.058 -1.83 . . . . 74.310000000000002 106.058 162.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.543 0.677 0 C-N-CA 125.435 1.494 . . . . 75.129999999999995 112.303 -178.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 38.2 t70 . . . . . 0 CA--C 1.529 0.173 0 CA-C-O 118.91 -0.567 . . . . 72.319999999999993 109.665 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.3 p -60.22 -44.93 96.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-N 119.543 1.065 . . . . 72.439999999999998 111.198 179.178 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -62.08 -21.07 64.65 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 121.062 -1.024 . . . . 63.509999999999998 113.492 177.883 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -53.56 -38.85 64.25 Favored 'General case' 0 C--N 1.343 0.287 0 CA-C-N 119.124 0.875 . . . . 73.239999999999995 110.949 -174.602 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -66.96 -31.62 72.31 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.612 -0.514 . . . . 73.519999999999996 109.612 -171.12 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -78.2 -51.18 10.59 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-O 118.487 -0.768 . . . . 74.439999999999998 109.12 169.748 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.58 -40.83 72.53 Favored 'General case' 0 C--N 1.334 -0.107 0 C-N-CA 125.074 1.35 . . . . 74.25 113.214 -171.256 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.81 -17.07 62.18 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.355 1.062 . . . . 73.420000000000002 112.503 179.159 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -97.95 -55.02 2.91 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 108.782 -0.821 . . . . 74.519999999999996 108.782 -178.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.7 mt -78.71 40.4 0.38 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 127.43 2.292 . . . . 74.409999999999997 111.055 170.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -57.97 113.07 1.72 Allowed 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.836 1.254 . . . . 73.239999999999995 108.312 175.04 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 75.31 12.05 83.81 Favored Glycine 0 CA--C 1.528 0.884 0 C-N-CA 124.708 1.147 . . . . 52.219999999999999 112.949 -178.856 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.416 ' HE2' HD23 ' A' ' 41' ' ' LEU . 25.4 mtpp -133.02 -8.63 3.05 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.013 1.325 . . . . 74.239999999999995 112.153 -172.596 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -157.69 114.83 2.98 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.883 1.273 . . . . 73.140000000000001 108.25 163.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -67.44 170.65 7.1 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 124.72 1.208 . . . . 63.509999999999998 110.912 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -47.42 -55.74 8.36 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.123 1.769 . . . . 75.439999999999998 110.12 166.261 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -69.84 -30.48 67.99 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 122.967 0.507 . . . . 75.439999999999998 111.119 -176.504 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 30.5 m -65.09 -53.63 42.43 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 109.268 -0.642 . . . . 71.219999999999999 109.268 176.312 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 41.2 mt -61.74 -52.46 60.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 CA-C-N 119.575 1.079 . . . . 75.140000000000001 109.017 -178.324 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.04 -23.41 67.43 Favored 'General case' 0 C--N 1.34 0.157 0 N-CA-C 111.849 0.314 . . . . 75.120000000000005 111.849 -175.577 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.42 -54.73 5.21 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 108.717 -0.845 . . . . 35.530000000000001 108.717 174.02 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.9 tppm? -54.56 -57.1 12.73 Favored 'General case' 0 CA--C 1.512 -0.518 0 C-N-CA 125.948 1.699 . . . . 44.100000000000001 112.136 -171.127 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 5.2 ptm -59.56 -26.93 65.79 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 120.067 -0.653 . . . . 64.5 111.237 -175.147 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 59.7 t -88.25 -27.08 5.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 125.625 1.57 . . . . 64.530000000000001 111.832 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -55.52 -57.82 10.34 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 126.342 1.857 . . . . 73.099999999999994 108.053 172.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.2 pp -80.8 11.58 3.81 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.912 1.685 . . . . 73.219999999999999 113.275 -172.327 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -53.37 -50.99 63.91 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 120.945 -1.097 . . . . 74.219999999999999 110.971 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.99 -45.41 85.73 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.232 0.539 . . . . 75.439999999999998 110.694 175.181 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.9 m -50.92 -35.92 35.72 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.625 1.57 . . . . 51.130000000000003 111.517 -178.5 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -47.79 -45.57 29.61 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.26 1.424 . . . . 74.019999999999996 113.547 177.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -78.86 -43.44 25.08 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.807 1.185 . . . . 60.299999999999997 111.038 174.274 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.14 -31.91 67.65 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 124.434 1.094 . . . . 54.5 112.538 -175.131 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -61.73 -24.48 66.83 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.338 0.972 . . . . 71.319999999999993 112.448 177.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 26.7 mm -81.77 -38.38 15.92 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 C-N-CA 124.106 0.962 . . . . 43.119999999999997 110.03 175.354 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 23.0 mm -59.41 -27.17 36.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 123.733 0.813 . . . . 61.299999999999997 109.648 174.738 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.63 -17.41 61.67 Favored 'General case' 0 N--CA 1.44 -0.928 0 C-N-CA 125.889 1.675 . . . . 51.229999999999997 112.021 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -139.37 62.23 1.53 Allowed 'General case' 0 C--O 1.237 0.422 0 N-CA-C 106.403 -1.702 . . . . 60.0 106.403 -175.494 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 95.8 mt . . . . . 0 C--O 1.255 1.383 0 N-CA-C 107.089 -1.448 . . . . 71.010000000000005 107.089 162.582 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 11' ' ' HIS . . . . . 0.466 ' HA ' HD13 ' A' ' 21' ' ' LEU . 0.4 OUTLIER . . . . . 0 CA--C 1.541 0.603 0 N-CA-C 113.882 1.068 . . . . 74.099999999999994 113.882 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -50.1 109.26 0.28 Allowed 'General case' 0 C--O 1.238 0.451 0 C-N-CA 126.635 1.974 . . . . 74.200000000000003 109.708 175.791 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 48.43 33.58 4.06 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 126.969 2.108 . . . . 75.319999999999993 113.759 -175.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 26.2 mttt -114.4 -10.3 12.65 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.346 1.059 . . . . 71.230000000000004 113.175 174.403 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -66.15 -21.51 66.34 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 119.311 0.959 . . . . 75.530000000000001 112.863 -171.222 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -122.67 72.55 1.08 Allowed 'General case' 0 C--O 1.232 0.155 0 N-CA-C 107.261 -1.385 . . . . 63.310000000000002 107.261 162.186 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -164.44 -46.98 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.031 0.932 . . . . 74.219999999999999 110.48 173.627 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.58 161.27 13.71 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 121.52 -0.737 . . . . 64.530000000000001 111.488 -167.933 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -93.8 -38.67 11.14 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.199 0.999 . . . . 73.239999999999995 109.576 162.323 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -44.76 -62.14 1.32 Allowed 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.295 1.438 . . . . 73.540000000000006 111.041 -175.521 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.466 HD13 ' HA ' ' A' ' 11' ' ' HIS . 13.4 mt -84.31 -29.5 26.32 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 125.38 1.472 . . . . 51.109999999999999 110.735 -172.501 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 51.4 t30 -69.55 -21.45 63.63 Favored 'General case' 0 C--O 1.216 -0.689 0 CA-C-O 117.88 -1.057 . . . . 73.540000000000006 111.837 176.146 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -48.2 -55.24 10.94 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 120.214 1.37 . . . . 74.519999999999996 111.174 -170.843 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.5 pttm -56.44 -53.3 59.04 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 121.131 -0.981 . . . . 74.129999999999995 111.242 173.091 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.84 -11.51 27.92 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.306 1.042 . . . . 74.420000000000002 113.684 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -87.84 -14.45 39.47 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 120.545 -1.347 . . . . 75.120000000000005 110.469 176.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -153.81 92.12 1.53 Allowed 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.355 1.062 . . . . 72.400000000000006 110.416 178.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.743 ' HD3' ' HB1' ' A' ' 96' ' ' ALA . 0.0 OUTLIER -118.62 -17.51 9.26 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-O 118.389 -0.815 . . . . 64.310000000000002 111.903 169.16 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.74 -35.79 33.27 Favored 'General case' 0 C--N 1.342 0.257 0 CA-C-N 119.974 1.261 . . . . 75.140000000000001 113.344 -173.495 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -83.53 -22.02 32.54 Favored 'General case' 0 C--O 1.223 -0.309 0 CA-C-O 118.028 -0.987 . . . . 75.540000000000006 113.629 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.561 ' HD3' HD12 ' A' ' 32' ' ' LEU . 0.1 OUTLIER -64.02 -54.76 29.28 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 120.541 1.518 . . . . 73.239999999999995 109.778 166.94 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.561 HD12 ' HD3' ' A' ' 31' ' ' ARG . 3.0 mp -68.73 -24.77 64.51 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.596 0.758 . . . . 73.510000000000005 110.443 -167.761 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 mt -46.14 -38.51 8.28 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.664 1.185 . . . . 72.5 111.569 167.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -69.54 -40.17 78.46 Favored Glycine 0 C--N 1.34 0.774 0 O-C-N 121.419 -0.8 . . . . 73.129999999999995 112.465 177.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -64.2 -30.02 71.1 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 118.537 1.168 . . . . 74.420000000000002 111.667 -177.725 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 20.5 t90 -61.51 -77.24 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 108.421 -0.955 . . . . 75.099999999999994 108.421 166.058 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.72 -30.76 63.84 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.015 1.326 . . . . 71.129999999999995 113.867 -166.797 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.39 -54.99 24.77 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 123.943 0.897 . . . . 71.409999999999997 109.743 171.74 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -55.1 -45.45 81.94 Favored Glycine 0 CA--C 1.522 0.476 0 C-N-CA 124.195 0.902 . . . . 52.119999999999997 111.746 -178.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 9.0 mp -54.68 -41.89 70.75 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 125.695 1.598 . . . . 63.299999999999997 110.937 177.774 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.456 HD23 ' HE3' ' A' ' 79' ' ' LYS . 51.5 mt -87.87 6.03 37.49 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 126.303 1.841 . . . . 75.540000000000006 112.177 -178.336 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 73.51 15.47 79.14 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-O 119.108 -0.829 . . . . 50.009999999999998 112.83 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 52.2 mttt -89.07 127.3 35.69 Favored 'General case' 0 CA--C 1.519 -0.231 0 N-CA-C 106.443 -1.688 . . . . 72.239999999999995 106.443 174.105 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.3 p -141.28 169.72 17.08 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.684 -0.858 . . . . 73.420000000000002 108.684 177.533 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 55.94 -130.2 48.53 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 110.23 -1.148 . . . . 75.530000000000001 110.23 179.426 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.88 -29.16 66.3 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 112.174 0.435 . . . . 74.319999999999993 112.174 -174.355 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.62 -33.38 75.79 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 121.234 -0.916 . . . . 74.329999999999998 110.031 177.937 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.36 -40.44 62.13 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.488 0.715 . . . . 75.540000000000006 109.718 177.773 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.0 ptp180 -67.23 -44.24 79.98 Favored 'General case' 0 C--O 1.227 -0.124 0 N-CA-C 109.765 -0.458 . . . . 63.399999999999999 109.765 -178.096 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.59 -43.79 84.89 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 125.983 1.713 . . . . 75.510000000000005 110.131 176.278 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -60.85 -47.95 84.04 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 122.78 0.432 . . . . 64.200000000000003 111.299 173.472 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.46 -16.14 44.22 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.352 -0.842 . . . . 75.430000000000007 112.932 -176.737 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 50.1 mt -61.87 -11.37 12.55 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 119.462 1.028 . . . . 75.519999999999996 113.732 178.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 8.9 t -132.52 -3.17 3.37 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 120.351 1.432 . . . . 75.329999999999998 112.831 -172.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 6.0 p -80.05 11.45 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.932 0 O-C-N 120.668 -1.27 . . . . 64.420000000000002 113.107 -171.505 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 2.1 p -115.8 120.7 65.56 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.173 0 O-C-N 120.666 -1.271 . . . . 74.400000000000006 110.605 -164.577 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.405 HG23 HG22 ' A' ' 68' ' ' VAL . 5.9 t -161.98 -178.35 6.38 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 130.372 3.469 . . . . 63.140000000000001 105.615 -176.003 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.5 m . . . . . 0 CA--C 1.532 0.278 0 O-C-N 120.244 -1.535 . . . . 72.530000000000001 110.384 170.498 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 t70 . . . . . 0 C--O 1.233 0.192 0 CA-C-O 120.311 0.101 . . . . 62.409999999999997 110.848 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.405 HG22 HG23 ' A' ' 57' ' ' THR . 54.9 t -83.51 -35.82 11.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 109.05 -0.722 . . . . 64.310000000000002 109.05 177.029 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -58.85 -44.62 91.02 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-O 117.958 -1.02 . . . . 74.540000000000006 109.308 169.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.405 ' CZ ' ' HE3' ' A' ' 71' ' ' LYS . 34.2 ttp85 -45.68 -58.47 3.42 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.684 0.794 . . . . 75.519999999999996 111.57 -177.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.405 ' HE3' ' CZ ' ' A' ' 70' ' ' ARG . 1.0 OUTLIER -69.83 -40.1 76.07 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 118.38 -0.819 . . . . 75.239999999999995 111.44 -175.831 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 38.6 mt -64.88 -48.06 75.62 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-N 119.2 0.909 . . . . 61.509999999999998 110.695 -179.438 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.73 -28.71 67.06 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 124.961 1.304 . . . . 74.5 111.816 -179.473 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.99 -47.88 67.31 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 118.899 0.772 . . . . 62.210000000000001 110.659 172.233 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.55 -55.26 18.74 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 107.738 -1.208 . . . . 71.299999999999997 107.738 -178.774 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 87.0 mt -87.18 34.57 0.69 Allowed 'General case' 0 C--O 1.233 0.222 0 C-N-CA 127.416 2.286 . . . . 74.239999999999995 111.907 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -53.24 115.37 1.86 Allowed 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 107.251 -1.388 . . . . 75.319999999999993 107.251 171.023 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 87.37 4.24 80.87 Favored Glycine 0 CA--C 1.532 1.102 0 C-N-CA 124.929 1.252 . . . . 35.210000000000001 114.163 176.803 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.456 ' HE3' HD23 ' A' ' 41' ' ' LEU . 28.9 mtmm -133.64 5.34 3.68 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 125.134 1.374 . . . . 73.519999999999996 112.416 -174.696 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -144.62 177.73 8.48 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.052 1.341 . . . . 74.230000000000004 108.91 170.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -143.51 164.74 29.5 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 126.754 2.022 . . . . 75.400000000000006 107.319 177.669 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -58.93 -54.81 42.95 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 124.085 0.954 . . . . 71.540000000000006 110.666 176.264 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -71.96 -11.77 60.93 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 122.978 0.511 . . . . 74.140000000000001 111.943 -178.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 54.3 m -84.09 -52.07 6.58 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 108.498 -0.927 . . . . 41.299999999999997 108.498 174.804 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 71.8 mt -55.77 -46.65 79.86 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 120.23 1.377 . . . . 74.530000000000001 109.068 178.66 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.46 -28.92 60.95 Favored 'General case' 0 C--N 1.344 0.347 0 N-CA-C 112.55 0.574 . . . . 63.399999999999999 112.55 -177.527 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.3 -44.47 12.83 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 124.121 0.969 . . . . 73.310000000000002 109.952 176.263 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 6.3 tptt -66.59 -48.82 68.36 Favored 'General case' 0 CA--C 1.521 -0.149 0 C-N-CA 125.98 1.712 . . . . 72.319999999999993 111.738 -166.623 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.44 -29.02 69.66 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.13 0.877 . . . . 72.430000000000007 111.183 -178.491 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 57.1 t -72.92 -31.12 34.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 123.805 0.842 . . . . 54.100000000000001 110.562 174.519 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.06 -53.75 54.08 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 126.981 2.112 . . . . 72.109999999999999 112.946 -162.717 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -67.24 22.82 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 127.988 2.515 . . . . 63.509999999999998 113.88 -171.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 6.7 ppt_? -65.3 -25.68 67.73 Favored 'General case' 0 N--CA 1.466 0.368 0 O-C-N 120.139 -1.601 . . . . 74.400000000000006 113.58 -169.176 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.85 -47.19 9.25 Favored 'General case' 0 C--N 1.332 -0.172 0 O-C-N 121.026 -1.047 . . . . 74.109999999999999 109.044 178.254 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.8 m -55.14 -29.66 58.22 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.79 1.236 . . . . 65.400000000000006 110.891 175.533 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.743 ' HB1' ' HD3' ' A' ' 28' ' ' ARG . . . -56.59 -45.54 81.34 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.826 1.25 . . . . 32.219999999999999 112.49 173.169 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 26.1 ttt-85 -63.36 -51.83 64.29 Favored 'General case' 0 CA--C 1.517 -0.292 0 O-C-N 120.828 -1.17 . . . . 73.519999999999996 108.663 175.575 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.62 -55.41 32.38 Favored 'General case' 0 N--CA 1.444 -0.754 0 O-C-N 125.022 1.451 . . . . 74.319999999999993 110.669 -168.478 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -57.51 -42.28 82.5 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-O 118.732 -0.652 . . . . 74.420000000000002 112.427 -174.675 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 39.4 mm -64.25 -39.75 86.62 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-N 119.903 1.229 . . . . 53.039999999999999 110.541 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 61.8 mt -71.37 -11.74 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 O-C-N 121.5 -0.75 . . . . 71.400000000000006 109.355 178.173 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.16 4.91 34.57 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.26 1.424 . . . . 74.200000000000003 111.579 176.009 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 80.5 mt-10 -124.52 29.18 6.37 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 125.198 1.399 . . . . 75.430000000000007 108.791 -174.698 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.6 mm . . . . . 0 C--O 1.251 1.163 0 N-CA-C 105.54 -2.022 . . . . 74.239999999999995 105.54 169.532 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . 0.32 0.1 OUTLIER . . . . . 0 N--CA 1.475 0.784 0 N-CA-C 113.467 0.914 . . . . 73.510000000000005 113.467 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.9 114.1 14.14 Favored 'General case' 0 N--CA 1.444 -0.759 0 O-C-N 119.751 -1.843 . . . . 73.129999999999995 108.061 -171.909 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 60.81 31.67 20.07 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.896 2.078 . . . . 65.420000000000002 114.862 -174.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -100.11 -25.33 14.32 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 115.429 1.64 . . . . 74.129999999999995 115.429 -177.392 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -74.99 0.32 16.25 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 114.705 1.372 . . . . 73.530000000000001 114.705 -166.0 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -113.11 25.47 11.34 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.577 1.081 . . . . 65.510000000000005 110.085 173.549 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -151.38 174.65 13.09 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 124.925 1.29 . . . . 64.409999999999997 108.656 -179.422 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 60.85 -160.11 0.31 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.635 1.174 . . . . 74.319999999999993 108.852 171.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -137.11 -35.81 0.68 Allowed 'General case' 0 C--N 1.332 -0.173 0 O-C-N 120.375 -1.453 . . . . 73.109999999999999 111.237 161.398 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -47.83 -54.44 12.45 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.245 1.018 . . . . 74.430000000000007 112.712 -170.557 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.4 mt -77.74 -29.91 51.33 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.852 -0.53 . . . . 61.329999999999998 111.739 -172.245 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -63.52 -49.48 73.34 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 108.974 -0.75 . . . . 74.340000000000003 108.974 174.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -55.7 -39.5 71.12 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.949 0.899 . . . . 70.519999999999996 110.934 -178.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -44.8 -48.36 10.95 Favored 'General case' 0 C--N 1.344 0.336 0 C-N-CA 124.281 1.032 . . . . 61.100000000000001 111.777 173.664 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.433 ' HB1' ' HA ' ' A' ' 97' ' ' ARG . . . -64.72 -49.15 71.99 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.565 1.146 . . . . 74.129999999999995 111.441 -178.266 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -71.0 -18.09 62.61 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 121.975 -0.453 . . . . 71.510000000000005 110.982 -176.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -113.37 55.06 0.72 Allowed 'General case' 0 C--O 1.237 0.41 0 C-N-CA 125.265 1.426 . . . . 74.200000000000003 109.025 -176.555 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.4 mmt-85 -121.97 -7.66 8.91 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 126.048 1.739 . . . . 53.009999999999998 112.261 172.069 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 36.8 mtm-85 -53.38 -53.85 45.24 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 119.599 1.091 . . . . 71.430000000000007 112.192 -168.24 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -82.34 -15.23 53.6 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.501 -0.75 . . . . 74.430000000000007 112.604 -167.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.83 -14.21 59.65 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 119.033 0.833 . . . . 61.420000000000002 112.808 -169.013 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -127.83 3.65 6.02 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.973 2.109 . . . . 54.399999999999999 112.027 -171.334 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 56.7 tp -56.41 -30.13 62.41 Favored 'General case' 0 N--CA 1.461 0.1 0 C-N-CA 128.607 2.763 . . . . 72.310000000000002 111.807 174.315 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.403 ' HA3' ' HA ' ' A' ' 52' ' ' ALA . . . -45.8 -46.81 13.81 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 124.791 1.186 . . . . 71.430000000000007 113.016 170.154 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -63.0 -22.49 66.89 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.768 1.227 . . . . 71.230000000000004 111.938 -172.795 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.438 ' CD2' ' HG2' ' A' ' 88' ' ' LYS . 5.8 t90 -64.07 -72.66 0.14 Allowed 'General case' 0 C--N 1.343 0.307 0 N-CA-C 107.913 -1.143 . . . . 71.239999999999995 107.913 168.882 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.93 -29.2 62.89 Favored 'General case' 0 C--O 1.221 -0.441 0 C-N-CA 126.314 1.846 . . . . 52.240000000000002 112.193 -171.824 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -47.36 -49.27 24.86 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.987 0.812 . . . . 23.510000000000002 111.52 -179.24 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.46 -35.9 91.75 Favored Glycine 0 CA--C 1.534 1.242 0 CA-C-N 118.352 0.523 . . . . 62.219999999999999 112.869 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.413 HD12 ' N ' ' A' ' 40' ' ' LEU . 3.2 mp -64.98 -39.29 93.26 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.649 1.58 . . . . 71.430000000000007 109.339 178.654 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.9 mp -73.04 -9.68 58.98 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 127.324 2.25 . . . . 50.0 112.977 172.569 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 71.44 29.7 67.76 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 125.806 1.67 . . . . 75.209999999999994 112.188 -176.734 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -111.22 139.06 46.91 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 119.551 1.676 . . . . 62.299999999999997 107.228 170.746 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.1 p -135.73 175.87 9.2 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 107.254 -1.387 . . . . 75.319999999999993 107.254 168.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 60.48 -126.74 41.99 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.487 -1.045 . . . . 72.430000000000007 110.487 173.537 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -78.29 -34.69 48.65 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 123.974 0.91 . . . . 75.409999999999997 110.512 -170.165 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.79 -35.2 79.82 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.773 0.829 . . . . 55.399999999999999 109.621 173.309 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.32 -42.06 69.08 Favored 'General case' 0 C--N 1.339 0.109 0 O-C-N 121.961 -0.462 . . . . 64.510000000000005 111.15 170.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.0 ttm180 -55.79 -47.43 77.12 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.436 0.694 . . . . 62.329999999999998 111.603 -176.309 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.76 -50.6 73.19 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.357 0.526 . . . . 73.129999999999995 110.203 -178.24 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -53.31 -42.78 67.0 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.693 1.197 . . . . 70.430000000000007 111.477 173.416 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.403 ' HA ' ' HA3' ' A' ' 34' ' ' GLY . . . -60.25 -24.62 65.03 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 124.071 0.948 . . . . 72.319999999999993 113.519 -178.438 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 43.9 mt -84.68 -14.8 47.42 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 118.05 -0.976 . . . . 73.329999999999998 111.977 -171.416 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 11.7 t -102.77 -28.14 12.27 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 119.989 1.268 . . . . 63.5 112.273 -173.216 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 1.6 p -72.43 96.57 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.325 0 C-N-CA 127.31 2.244 . . . . 64.120000000000005 109.892 172.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 11.0 p -148.97 152.42 12.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 C-N-CA 125.421 1.488 . . . . 73.510000000000005 108.701 152.419 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.449 HG23 HG23 ' A' ' 68' ' ' VAL . 0.1 OUTLIER -149.24 -85.91 0.09 Allowed 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 118.219 -0.896 . . . . 73.340000000000003 108.826 155.836 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.9 t . . . . . 0 C--O 1.226 -0.133 0 CA-C-N 120.012 1.278 . . . . 64.530000000000001 108.367 179.733 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 117.886 -1.054 . . . . 64.209999999999994 111.125 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.449 HG23 HG23 ' A' ' 57' ' ' THR . 14.1 p -63.06 -32.46 56.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 121.115 1.779 . . . . 73.540000000000006 110.646 178.666 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -78.1 -18.12 56.08 Favored 'General case' 0 C--O 1.221 -0.408 0 N-CA-C 116.084 1.883 . . . . 65.099999999999994 116.084 176.541 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 22.1 ttt180 -55.36 -57.37 12.14 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 122.375 2.352 . . . . 70.200000000000003 114.286 -169.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -74.57 3.33 7.9 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 122.989 0.516 . . . . 65.540000000000006 111.559 -174.457 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 18.1 tp -112.78 -63.94 1.37 Allowed 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 127.872 2.469 . . . . 65.519999999999996 108.465 -174.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -51.29 -40.37 58.81 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 127.02 2.128 . . . . 73.129999999999995 111.418 177.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -76.27 -27.01 56.5 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 112.87 0.692 . . . . 74.400000000000006 112.87 -179.203 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.55 -9.22 59.5 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.693 0.797 . . . . 65.409999999999997 110.492 172.252 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 69.0 mt -116.48 34.99 4.75 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 128.723 2.809 . . . . 73.109999999999999 110.916 177.579 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -54.55 110.93 0.7 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.157 1.383 . . . . 53.109999999999999 108.618 176.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 86.2 2.64 85.51 Favored Glycine 0 CA--C 1.529 0.956 0 C-N-CA 125.439 1.495 . . . . 41.030000000000001 114.957 -179.261 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -127.24 1.25 6.41 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 118.871 1.336 . . . . 74.310000000000002 112.193 -165.728 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -147.64 -172.85 4.13 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.733 1.213 . . . . 63.43 109.498 172.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.519 ' H ' ' HB ' ' A' ' 84' ' ' THR . 33.0 m-20 -146.84 170.38 17.16 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 126.976 2.11 . . . . 73.109999999999999 105.799 165.668 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -55.13 -47.55 74.89 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.227 1.011 . . . . 61.140000000000001 110.356 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -82.88 -24.21 33.28 Favored 'General case' 0 CA--C 1.534 0.354 0 O-C-N 121.333 -0.854 . . . . 70.510000000000005 111.339 -177.026 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.519 ' HB ' ' H ' ' A' ' 81' ' ' ASP . 79.5 m -64.29 -39.13 93.3 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 120.737 -1.227 . . . . 70.400000000000006 108.909 172.345 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 96.8 mt -61.15 -50.33 80.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 O-C-N 121.116 -0.99 . . . . 50.119999999999997 109.345 173.733 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.53 -32.26 73.83 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 118.966 -1.094 . . . . 61.520000000000003 111.087 -174.985 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.09 -53.05 60.87 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 109.203 -0.666 . . . . 73.519999999999996 109.203 172.299 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.438 ' HG2' ' CD2' ' A' ' 36' ' ' TRP . 0.0 OUTLIER -60.66 -44.88 95.94 Favored 'General case' 0 N--CA 1.463 0.178 0 O-C-N 120.956 -1.09 . . . . 74.140000000000001 113.366 -173.101 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 59.7 mtt -59.92 -20.97 60.36 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 118.662 0.665 . . . . 71.430000000000007 111.828 178.576 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 66.4 t -98.3 -25.51 4.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 125.028 1.331 . . . . 74.439999999999998 110.542 -176.692 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -60.19 -54.03 50.63 Favored 'General case' 0 N--CA 1.463 0.201 0 O-C-N 120.75 -1.219 . . . . 61.399999999999999 108.56 173.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 4.0 pp -73.97 7.01 2.88 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.45 1.1 . . . . 73.420000000000002 112.85 -178.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 21.5 ttt-85 -56.24 -50.46 71.24 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 120.011 -1.681 . . . . 73.420000000000002 112.692 -176.441 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.34 -31.91 72.98 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 119.409 1.004 . . . . 73.5 112.388 -178.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 73.7 m -47.42 -36.64 10.15 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.284 1.434 . . . . 64.519999999999996 110.147 178.072 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -53.94 -46.65 71.61 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 124.983 1.313 . . . . 51.200000000000003 113.192 -175.37 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.433 ' HA ' ' HB1' ' A' ' 25' ' ' ALA . 15.6 ptt-85 -82.72 -34.78 27.15 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 120.541 -0.464 . . . . 63.399999999999999 111.364 178.761 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -59.29 -41.24 88.5 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.242 1.017 . . . . 65.439999999999998 109.634 -179.023 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 60.8 mm-40 -50.18 -49.92 50.91 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 126.463 1.905 . . . . 74.099999999999994 112.645 174.534 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 21.6 mm -59.61 -48.31 87.85 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-N 118.925 0.784 . . . . 65.329999999999998 109.047 178.677 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 97.7 mt -68.38 -5.16 4.01 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 C-N-CA 126.846 2.058 . . . . 63.420000000000002 110.888 -178.216 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -103.74 -17.86 14.92 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 125.419 1.488 . . . . 73.099999999999994 111.381 175.849 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -132.55 46.0 2.68 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 125.026 1.331 . . . . 70.400000000000006 109.324 -168.135 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 24.5 mt . . . . . 0 C--O 1.249 1.027 0 C-N-CA 130.277 3.431 . . . . 73.400000000000006 108.197 -176.455 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.539 0.547 0 N-CA-C 115.719 1.748 . . . . 73.209999999999994 115.719 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -45.0 -42.75 8.56 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 115.921 1.823 . . . . 72.239999999999995 115.921 -162.414 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -129.12 -1.16 5.17 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.969 1.308 . . . . 62.43 112.096 169.268 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.1 mtpt -63.57 -19.97 65.26 Favored 'General case' 0 C--O 1.223 -0.295 0 O-C-N 121.016 -1.052 . . . . 51.009999999999998 113.634 -171.252 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -49.22 -33.24 12.18 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 127.415 2.286 . . . . 73.299999999999997 114.559 -173.767 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.59 -20.67 63.63 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.154 0.582 . . . . 74.5 112.287 -178.49 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -113.98 -169.18 1.47 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 129.95 3.3 . . . . 70.540000000000006 105.915 178.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 57.94 -169.99 0.11 Allowed 'General case' 0 C--O 1.239 0.515 0 C-N-CA 124.516 1.126 . . . . 73.319999999999993 110.644 177.063 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -143.34 -48.06 0.3 Allowed 'General case' 0 C--N 1.333 -0.146 0 O-C-N 120.4 -1.437 . . . . 53.030000000000001 110.71 171.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 64.3 tt0 -60.55 -32.24 71.31 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.079 0.552 . . . . 72.140000000000001 110.937 -171.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 72.3 mt -71.81 -41.2 68.53 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.225 -0.922 . . . . 73.409999999999997 110.491 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -63.57 -42.72 98.29 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.3 1.04 . . . . 72.120000000000005 110.514 173.018 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -54.53 -41.55 69.83 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.001 0.92 . . . . 75.400000000000006 109.884 174.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.36 -16.66 6.01 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 117.267 -1.349 . . . . 64.219999999999999 114.1 175.452 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -97.01 -32.01 12.22 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 121.145 1.793 . . . . 70.540000000000006 113.642 173.287 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.0 tp10 -46.1 -43.09 14.5 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.805 1.642 . . . . 65.329999999999998 112.035 -176.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -91.42 26.3 2.31 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.046 1.338 . . . . 61.399999999999999 112.277 -167.598 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 2.8 mmt180 -112.23 2.73 16.75 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 120.569 -1.332 . . . . 73.430000000000007 111.924 177.837 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 19.3 mtt-85 -63.53 -23.92 67.59 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.332 1.423 . . . . 73.120000000000005 112.295 -175.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -135.11 -16.17 1.92 Allowed 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 117.067 -1.444 . . . . 63.530000000000001 114.559 173.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.07 6.88 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 128.112 2.565 . . . . 71.400000000000006 114.578 -173.117 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.443 HD13 HD22 ' A' ' 92' ' ' LEU . 0.3 OUTLIER -137.35 -1.7 2.08 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 127.456 2.302 . . . . 65.129999999999995 110.693 -166.956 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 52.3 tp -66.8 -30.75 71.03 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 127.104 2.162 . . . . 70.329999999999998 110.824 170.404 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -65.69 -43.8 93.62 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.924 -0.87 . . . . 52.130000000000003 110.924 170.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -65.08 -23.85 67.28 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 118.376 1.088 . . . . 71.519999999999996 111.996 -173.647 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 22.5 t90 -60.15 -69.28 0.22 Allowed 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 124.415 1.086 . . . . 74.230000000000004 108.97 168.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.0 -40.45 80.75 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 122.954 0.502 . . . . 72.409999999999997 111.699 -177.077 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.26 -54.72 27.7 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.669 1.187 . . . . 61.32 109.908 173.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -64.08 -36.44 93.25 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-N 117.866 0.303 . . . . 25.440000000000001 112.389 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 38.2 mt -62.63 -38.98 92.37 Favored 'General case' 0 C--O 1.233 0.225 0 O-C-N 120.766 -1.432 . . . . 65.439999999999998 110.696 176.277 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 92.5 mt -88.16 6.87 34.51 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 126.951 2.1 . . . . 63.140000000000001 113.282 -178.342 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 81.82 12.95 80.63 Favored Glycine 0 CA--C 1.531 1.093 0 CA-C-N 119.839 1.2 . . . . 72.099999999999994 113.996 171.82 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -90.83 149.47 21.95 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 126.026 1.73 . . . . 53.210000000000001 109.888 172.634 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.0 p -148.72 175.71 10.98 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 126.863 2.065 . . . . 71.5 110.054 178.236 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 58.08 -135.51 51.74 Favored Glycine 0 CA--C 1.525 0.667 0 C-N-CA 124.322 0.963 . . . . 71.099999999999994 111.72 172.456 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -51.62 -46.41 63.62 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.934 1.294 . . . . 73.340000000000003 111.163 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.8 -38.35 87.78 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.325 -0.852 . . . . 72.540000000000006 110.385 -173.647 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.0 -45.09 52.05 Favored 'General case' 0 N--CA 1.455 -0.22 0 O-C-N 121.887 -0.508 . . . . 34.409999999999997 111.075 171.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 52.0 mtm-85 -59.07 -55.23 37.69 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 118.058 -0.972 . . . . 73.430000000000007 112.633 -172.672 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.18 -34.39 77.92 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 118.331 -0.842 . . . . 52.32 110.196 -172.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -61.82 -45.47 93.69 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-O 121.835 0.826 . . . . 74.430000000000007 109.858 173.435 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.18 -26.61 68.44 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 120.563 -1.336 . . . . 73.420000000000002 113.277 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 41.3 mt -84.22 -12.82 54.16 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.757 1.223 . . . . 75.319999999999993 111.158 177.8 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 40.9 p -105.27 3.37 29.91 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 119.609 1.095 . . . . 75.400000000000006 111.699 175.714 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.2 t -118.1 98.68 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 C-N-CA 126.039 1.736 . . . . 72.239999999999995 108.191 -173.333 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 1.9 t -129.65 66.66 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 N-CA-C 107.658 -1.238 . . . . 54.439999999999998 107.658 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.278 6.6 t 51.28 -164.67 0.05 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.199 1.8 . . . . 74.430000000000007 111.425 -178.531 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.239 0.532 0 C-N-CA 129.253 3.021 . . . . 74.230000000000004 103.411 156.682 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.5 t70 . . . . . 0 N--CA 1.467 0.38 0 CA-C-O 118.94 -0.553 . . . . 61.43 110.362 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 7.1 p -61.74 -45.7 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 CA-C-N 119.091 0.859 . . . . 72.25 110.276 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.91 -23.05 67.11 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 115.037 1.495 . . . . 75.409999999999997 115.037 170.589 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 75.7 ttt-85 -63.12 -54.29 40.2 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 121.172 1.806 . . . . 70.430000000000007 110.604 -178.089 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -71.74 9.35 0.9 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.995 0.918 . . . . 63.299999999999997 111.567 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 69.0 mt -132.86 -5.07 3.16 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 124.794 1.238 . . . . 65.219999999999999 114.185 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -100.75 -79.65 0.5 Allowed 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.86 1.264 . . . . 74.310000000000002 108.053 173.385 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.02 -45.73 91.82 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 118.422 0.556 . . . . 65.200000000000003 110.339 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.77 -29.51 66.85 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.078 0.551 . . . . 74.219999999999999 110.858 -175.605 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.4 tp -111.7 19.35 18.14 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 127.085 2.154 . . . . 73.219999999999999 111.213 -166.313 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -44.56 126.82 5.69 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 127.075 2.15 . . . . 65.430000000000007 111.635 -169.39 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 86.54 -12.21 61.7 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 126.231 1.872 . . . . 74.230000000000004 113.579 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 32.2 mtmm -117.31 10.63 13.76 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.689 1.195 . . . . 71.510000000000005 110.445 -175.248 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -147.03 175.03 11.0 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 126.39 1.876 . . . . 71.340000000000003 110.02 177.683 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.505 ' H ' ' HB ' ' A' ' 84' ' ' THR . 2.8 m-20 -150.14 172.38 15.38 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 105.617 -1.994 . . . . 63.539999999999999 105.617 154.254 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -55.67 -52.03 65.25 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 124.672 1.189 . . . . 73.120000000000005 109.38 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -66.42 -29.98 70.25 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.821 0.848 . . . . 71.409999999999997 111.036 -178.301 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.505 ' HB ' ' H ' ' A' ' 81' ' ' ASP . 99.0 m -70.19 -44.48 68.6 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 118.541 -0.742 . . . . 65.409999999999997 109.193 -179.205 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 69.7 mt -55.15 -46.48 77.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 CA-C-N 119.829 1.195 . . . . 71.409999999999997 109.616 -175.762 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.98 -47.97 76.7 Favored 'General case' 0 C--N 1.347 0.496 0 CA-C-O 121.595 0.712 . . . . 72.209999999999994 109.568 -179.508 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -88.01 29.38 0.94 Allowed 'General case' 0 N--CA 1.443 -0.808 0 C-N-CA 125.552 1.541 . . . . 73.310000000000002 111.025 -176.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.31 -48.51 2.88 Favored 'General case' 0 CA--C 1.513 -0.466 0 O-C-N 121.111 -0.993 . . . . 62.539999999999999 109.132 158.349 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 27.0 mtm -57.49 -42.64 83.09 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 117.771 0.26 . . . . 74.340000000000003 111.052 -176.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 27.1 t -79.81 -31.88 13.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 124.347 1.059 . . . . 63.439999999999998 111.957 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -62.18 -24.81 67.41 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.883 1.273 . . . . 71.549999999999997 112.604 -170.789 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.443 HD22 HD13 ' A' ' 32' ' ' LEU . 20.8 mt -86.84 -1.05 57.48 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 114.941 1.46 . . . . 73.420000000000002 114.941 -165.151 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 73.6 mtp180 -56.45 -50.01 72.94 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 120.306 -1.496 . . . . 71.510000000000005 112.844 -171.432 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.02 -20.39 59.64 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 120.031 1.287 . . . . 62.43 112.105 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.6 m -56.5 -25.35 51.12 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.064 0.847 . . . . 74.420000000000002 110.373 176.502 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.13 -51.34 69.71 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 114.556 1.317 . . . . 74.430000000000007 114.556 176.544 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -74.93 -38.22 61.83 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 108.994 -0.743 . . . . 70.409999999999997 108.994 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.2 -53.68 54.28 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 124.955 1.302 . . . . 72.420000000000002 109.454 -175.739 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -58.29 -44.58 88.55 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-O 118.839 -0.601 . . . . 74.219999999999999 112.529 -174.62 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 16.9 mm -65.2 -42.02 93.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 119.079 0.854 . . . . 73.200000000000003 109.003 -178.141 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 98.0 mt -69.74 -15.71 19.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 N-CA-C 109.479 -0.563 . . . . 74.310000000000002 109.479 177.581 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -85.78 -11.0 54.62 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 126.012 1.725 . . . . 62.310000000000002 111.225 174.542 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 66.6 mt-10 -129.77 42.03 3.34 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 128.177 2.591 . . . . 61.340000000000003 108.925 -166.023 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 92.7 mt . . . . . 0 C--O 1.255 1.372 0 N-CA-C 108.697 -0.853 . . . . 71.510000000000005 108.697 -177.145 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 11' ' ' HIS . . . . . 0.497 ' HB3' HD13 ' A' ' 21' ' ' LEU . 0.7 OUTLIER . . . . . 0 CA--C 1.535 0.391 0 N-CA-C 113.325 0.861 . . . . 62.420000000000002 113.325 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -46.38 -42.46 15.02 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 128.87 2.868 . . . . 73.219999999999999 112.75 -172.832 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.07 13.82 13.03 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.8 1.24 . . . . 71.109999999999999 111.329 178.625 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 19.0 mttm -108.25 -13.24 14.94 Favored 'General case' 0 C--O 1.225 -0.199 0 C-N-CA 124.596 1.159 . . . . 54.439999999999998 112.398 176.227 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -64.35 -27.02 68.73 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 120.494 1.497 . . . . 74.030000000000001 110.86 170.288 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -86.94 26.24 1.18 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.698 1.599 . . . . 63.210000000000001 112.36 173.132 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -167.54 -167.94 0.96 Allowed 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 119.465 1.03 . . . . 74.030000000000001 109.965 -178.042 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 57.8 -160.7 0.24 Allowed 'General case' 0 C--O 1.238 0.474 0 C-N-CA 125.765 1.626 . . . . 72.239999999999995 110.499 165.412 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -140.19 -32.86 0.59 Allowed 'General case' 0 C--O 1.219 -0.532 0 O-C-N 120.985 -1.072 . . . . 72.329999999999998 111.029 160.297 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -49.31 -41.66 38.99 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 125.274 1.43 . . . . 64.540000000000006 111.985 -168.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.497 HD13 ' HB3' ' A' ' 11' ' ' HIS . 67.9 mt -91.62 -37.28 13.17 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 119.048 -0.501 . . . . 73.349999999999994 110.785 -176.266 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 27.0 t30 -53.33 -45.18 68.97 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 119.106 0.867 . . . . 63.240000000000002 110.539 170.666 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -60.87 -39.77 90.45 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 125.801 1.641 . . . . 73.140000000000001 110.499 -178.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -45.78 -44.92 14.36 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 121.181 -0.949 . . . . 75.019999999999996 110.964 171.204 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.581 ' HB1' ' HA ' ' A' ' 97' ' ' ARG . . . -75.31 -62.19 1.65 Allowed 'General case' 0 C--O 1.235 0.312 0 C-N-CA 126.208 1.803 . . . . 74.329999999999998 112.915 177.076 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -61.51 -16.54 48.48 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.741 1.216 . . . . 71.420000000000002 111.713 -173.329 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -119.49 37.39 4.18 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.331 1.852 . . . . 33.140000000000001 111.366 -177.651 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.13 6.12 4.2 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 121.289 -0.882 . . . . 60.329999999999998 112.634 168.387 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.2 ptt85 -63.36 -19.05 64.31 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 120.566 -1.334 . . . . 72.400000000000006 113.27 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -78.72 -20.36 50.24 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 119.803 1.183 . . . . 75.120000000000005 112.142 175.368 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.49 -19.06 63.75 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 120.323 1.419 . . . . 74.349999999999994 112.65 -168.338 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.19 2.14 9.18 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.709 2.004 . . . . 60.030000000000001 111.684 -168.495 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.5 mt -60.96 -28.8 69.24 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.702 1.201 . . . . 64.430000000000007 111.336 171.585 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -61.24 -37.2 93.61 Favored Glycine 0 C--O 1.223 -0.533 0 N-CA-C 111.317 -0.713 . . . . 61.229999999999997 111.317 -178.679 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -62.28 -33.51 74.78 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.419 1.088 . . . . 72.150000000000006 110.227 -170.189 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 10.2 t90 -62.65 -65.09 0.74 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.689 1.596 . . . . 64.109999999999999 110.044 170.268 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.26 -21.09 66.69 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.412 0.685 . . . . 61.119999999999997 112.481 -171.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -70.77 -55.3 8.9 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 125.024 1.33 . . . . 55.43 109.257 168.354 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -49.26 -45.07 35.16 Favored Glycine 0 CA--C 1.527 0.842 0 C-N-CA 124.231 0.919 . . . . 54.5 112.042 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 16.1 mt -61.06 -32.74 72.37 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.496 1.118 . . . . 74.329999999999998 113.89 179.355 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 95.7 mt -85.66 -3.45 58.89 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.365 1.066 . . . . 73.030000000000001 112.446 176.288 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.11 19.69 56.87 Favored Glycine 0 CA--C 1.526 0.763 0 CA-C-O 118.424 -1.209 . . . . 42.409999999999997 113.374 -175.233 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 14.3 mmtp -101.53 119.18 38.37 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 125.81 1.644 . . . . 72.430000000000007 108.655 177.832 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.8 p -152.6 135.56 15.57 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.433 0.693 . . . . 55.340000000000003 110.827 -179.707 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 87.59 -148.85 21.39 Favored Glycine 0 CA--C 1.533 1.2 0 N-CA-C 110.894 -0.883 . . . . 75.310000000000002 110.894 -164.23 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -63.96 -22.11 66.78 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.937 1.458 . . . . 73.019999999999996 114.937 -161.413 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.76 -51.29 23.44 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 108.253 -1.018 . . . . 74.230000000000004 108.253 175.31 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -56.51 -40.19 74.6 Favored 'General case' 0 C--N 1.344 0.334 0 O-C-N 121.69 -0.631 . . . . 71.310000000000002 109.886 171.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.02 -25.58 67.74 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.756 1.223 . . . . 75.319999999999993 113.002 179.623 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.05 -51.66 11.83 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 119.533 1.06 . . . . 74.010000000000005 109.663 169.708 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -60.15 -29.08 68.42 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.266 1.026 . . . . 64.349999999999994 112.822 -177.038 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.0 -18.97 49.92 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 120.461 -1.399 . . . . 55.420000000000002 112.513 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 22.0 mt -90.74 -15.38 30.33 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.126 0.97 . . . . 71.209999999999994 111.651 -168.339 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.8 t -95.92 -29.26 14.28 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.64 1.176 . . . . 63.340000000000003 111.411 -178.915 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 5.3 p -70.8 8.53 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 126.202 1.801 . . . . 43.509999999999998 114.374 -166.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 5.2 m -104.14 49.12 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 O-C-N 119.196 -2.19 . . . . 75.319999999999993 112.004 -163.575 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.4 t -58.74 -50.48 73.76 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 109.797 -0.446 . . . . 63.0 109.797 172.494 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.0 t . . . . . 0 CA--C 1.533 0.317 0 C-N-CA 124.539 1.136 . . . . 64.299999999999997 108.784 -167.56 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . 0.268 5.1 t70 . . . . . 0 CA--C 1.518 -0.278 0 CA-C-O 118.974 -0.536 . . . . 71.230000000000004 111.725 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 30.1 t -47.76 -63.57 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 125.448 1.499 . . . . 74.409999999999997 108.476 170.142 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -79.37 -5.23 54.12 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 115.011 1.486 . . . . 75.140000000000001 115.011 -179.382 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.2 ptt180 -54.07 -19.85 5.55 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 115.486 1.661 . . . . 74.299999999999997 115.486 -172.554 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -113.21 -10.84 13.33 Favored 'General case' 0 CA--C 1.516 -0.345 0 C-N-CA 124.034 0.934 . . . . 62.229999999999997 112.648 177.339 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 17.9 tp -94.34 -58.43 2.21 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.881 1.273 . . . . 73.120000000000005 108.086 -175.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.32 -49.14 70.38 Favored 'General case' 0 C--O 1.223 -0.291 0 C-N-CA 124.897 1.279 . . . . 43.119999999999997 109.529 170.1 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.9 -20.58 65.94 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 114.314 1.227 . . . . 53.399999999999999 114.314 -178.343 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.08 -52.75 8.26 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 106.954 -1.498 . . . . 62.43 106.954 170.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 90.5 mt -80.39 39.67 0.47 Allowed 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 127.264 2.225 . . . . 73.340000000000003 110.785 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 62.0 tt0 -55.67 113.26 1.39 Allowed 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 126.579 1.952 . . . . 75.010000000000005 107.504 173.714 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 80.19 6.95 88.95 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 124.491 1.043 . . . . 53.140000000000001 114.58 -177.569 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 27.2 mtmm -130.43 -2.58 4.36 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 118.779 1.29 . . . . 75.040000000000006 113.443 -176.619 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -151.33 106.68 3.33 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 119.993 1.269 . . . . 74.040000000000006 110.379 175.036 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -64.53 166.48 8.43 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 108.458 -0.942 . . . . 71.239999999999995 108.458 167.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -55.46 -39.47 70.39 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 120.85 -1.156 . . . . 64.409999999999997 110.47 177.335 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -75.73 -16.73 60.1 Favored 'General case' 0 CA--C 1.53 0.188 0 O-C-N 121.483 -0.761 . . . . 75.230000000000004 111.276 -177.823 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 96.3 m -68.75 -43.81 75.04 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 118.64 0.655 . . . . 54.119999999999997 109.625 170.741 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.1 mt -62.29 -57.08 13.7 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-N 119.9 1.227 . . . . 75.299999999999997 108.82 -176.463 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.96 -44.58 67.22 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 118.274 0.488 . . . . 74.109999999999999 111.528 178.932 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.28 -52.67 64.64 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 108.922 -0.77 . . . . 73.120000000000005 108.922 -177.225 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -63.85 -43.76 95.17 Favored 'General case' 0 CA--C 1.518 -0.285 0 C-N-CA 123.748 0.819 . . . . 72.319999999999993 112.869 -174.745 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 10.0 mtt -58.29 -42.92 87.65 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 118.887 0.767 . . . . 60.219999999999999 110.757 177.492 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 60.0 t -68.68 -40.24 81.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 124.086 0.954 . . . . 35.210000000000001 110.39 179.258 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -58.26 -52.5 65.34 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 119.655 1.116 . . . . 72.310000000000002 110.947 -173.293 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 22.3 mt -67.97 1.68 2.53 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.509 1.924 . . . . 60.210000000000001 112.765 -168.381 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -67.83 -19.39 65.05 Favored 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 125.307 1.443 . . . . 72.200000000000003 112.112 -176.146 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -76.81 -56.27 4.75 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 119.994 1.27 . . . . 63.229999999999997 109.293 172.176 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 55.3 m -51.21 -36.85 43.57 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.21 1.404 . . . . 64.129999999999995 110.566 177.488 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.33 -50.82 68.64 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.693 0.797 . . . . 60.229999999999997 113.033 175.284 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.581 ' HA ' ' HB1' ' A' ' 25' ' ' ALA . 12.1 ptm180 -76.87 -35.7 57.28 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 118.522 0.601 . . . . 74.019999999999996 110.645 -179.175 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -61.47 -37.99 85.62 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 124.955 1.302 . . . . 73.329999999999998 111.817 179.3 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -63.37 -20.76 65.81 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 119.235 0.925 . . . . 73.219999999999999 112.854 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 41.9 mm -79.34 -29.49 13.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 CA-C-N 119.328 0.967 . . . . 73.019999999999996 110.605 174.542 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 15.9 mm -61.14 -23.78 31.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 N-CA-C 108.641 -0.874 . . . . 75.049999999999997 108.641 167.196 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -93.76 9.65 36.25 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.523 0.729 . . . . 74.409999999999997 111.779 176.601 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 88.3 mt-10 -132.29 37.49 3.54 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.582 1.953 . . . . 73.349999999999994 108.886 -179.111 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 96.9 mt . . . . . 0 C--O 1.254 1.339 0 C-N-CA 125.779 1.631 . . . . 75.310000000000002 109.331 166.456 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.536 0.431 0 N-CA-C 115.444 1.646 . . . . 74.420000000000002 115.444 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.443 ' HG3' ' H ' ' A' ' 13' ' ' ALA . 7.0 pt-20 -44.94 -78.75 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.951 2.101 . . . . 73.099999999999994 113.306 -168.862 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.443 ' H ' ' HG3' ' A' ' 12' ' ' GLU . . . -81.56 -2.57 50.46 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.627 0.771 . . . . 72.0 112.655 -179.61 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 31.4 mttm -75.6 -11.04 59.93 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.115 0.966 . . . . 64.129999999999995 112.329 176.473 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -61.56 -27.04 68.34 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 120.536 1.516 . . . . 75.439999999999998 112.571 -174.643 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -86.86 16.0 5.3 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.583 1.553 . . . . 62.219999999999999 113.033 174.832 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 50.9 m-70 -140.69 -65.55 0.45 Allowed 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.077 1.751 . . . . 74.219999999999999 109.966 -173.415 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -84.24 84.78 7.5 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 126.047 1.739 . . . . 74.409999999999997 107.427 -172.23 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.87 -26.07 57.94 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 114.811 -1.086 . . . . 75.239999999999995 110.912 175.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.01 -34.19 77.84 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.505 1.122 . . . . 64.129999999999995 111.592 174.955 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 82.0 mt -77.51 -36.96 52.04 Favored 'General case' 0 C--O 1.232 0.184 0 O-C-N 120.215 -1.553 . . . . 73.299999999999997 109.451 173.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -66.52 -29.74 69.9 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 121.244 -0.91 . . . . 74.400000000000006 111.062 176.37 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -58.62 -45.9 88.22 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.809 1.244 . . . . 63.109999999999999 110.879 172.522 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.31 -30.92 13.07 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.773 0.829 . . . . 73.200000000000003 112.247 174.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.18 -24.65 34.86 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 113.73 1.011 . . . . 73.209999999999994 113.73 -174.669 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -79.84 -16.57 55.19 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 119.352 0.978 . . . . 62.439999999999998 110.972 173.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -74.26 -160.12 0.09 Allowed 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 126.389 1.876 . . . . 71.109999999999999 108.932 166.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.4 mmt180 59.7 -29.65 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 128.973 2.909 . . . . 44.32 115.818 -176.741 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.1 ptt180 -50.9 -12.86 0.12 Allowed 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 130.89 3.676 . . . . 75.420000000000002 116.114 -174.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 25.4 m120 -113.4 -23.57 9.79 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 119.574 1.079 . . . . 62.509999999999998 112.275 178.881 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.9 -44.45 91.23 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 120.9 1.682 . . . . 72.030000000000001 110.301 173.637 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -79.69 -13.39 59.51 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 113.451 0.908 . . . . 71.420000000000002 113.451 -171.206 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.43 HD11 ' HB2' ' A' ' 89' ' ' MET . 15.7 mt -62.02 -24.99 67.39 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.642 0.777 . . . . 70.430000000000007 111.681 173.45 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -57.55 -39.44 90.88 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.899 -0.88 . . . . 11.34 110.899 176.682 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -65.36 -35.05 79.81 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.631 1.215 . . . . 72.420000000000002 111.108 -179.008 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.5 ' CD1' ' HE2' ' A' ' 88' ' ' LYS . 56.4 t90 -66.19 -61.88 1.78 Allowed 'General case' 0 C--N 1.342 0.242 0 C-N-CA 123.738 0.815 . . . . 71.140000000000001 108.969 178.596 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.08 -39.95 83.71 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 119.123 -0.465 . . . . 74.409999999999997 110.985 -178.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.0 -50.31 73.09 Favored 'General case' 0 C--N 1.339 0.15 0 CA-C-N 118.981 0.81 . . . . 53.219999999999999 110.889 172.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -52.28 -50.4 46.86 Favored Glycine 0 C--N 1.335 0.504 0 C-N-CA 124.977 1.275 . . . . 71.329999999999998 110.96 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 91.4 mt -58.53 -51.34 70.28 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 123.816 0.846 . . . . 73.129999999999995 109.764 175.202 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 32.1 mt -66.19 -6.11 12.45 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 115.406 1.632 . . . . 65.25 115.406 -176.315 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 80.61 12.48 82.86 Favored Glycine 0 CA--C 1.529 0.929 0 CA-C-N 119.078 0.854 . . . . 54.350000000000001 112.626 -177.242 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 57.8 mttt -87.86 129.1 35.31 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 118.834 1.317 . . . . 64.519999999999996 108.4 170.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 61.2 p -144.53 160.43 41.14 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.825 0.85 . . . . 70.319999999999993 108.764 167.352 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.82 -145.33 32.41 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 110.488 -1.045 . . . . 53.140000000000001 110.488 -175.603 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -57.36 -35.23 69.69 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.741 1.217 . . . . 45.25 110.583 -178.587 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -54.21 -43.56 70.89 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.309 1.044 . . . . 53.439999999999998 111.24 175.161 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -77.59 -42.56 34.71 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 121.997 -0.439 . . . . 72.349999999999994 109.924 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.3 ptt180 -63.29 -46.07 88.46 Favored 'General case' 0 C--O 1.225 -0.186 0 N-CA-C 109.511 -0.551 . . . . 74.439999999999998 109.511 -174.261 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.59 -44.16 96.57 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 126.13 1.772 . . . . 54.229999999999997 110.212 -176.151 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 17.1 t80 -60.78 -55.5 32.34 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.281 0.632 . . . . 74.430000000000007 109.445 171.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.81 -5.52 2.08 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 125.416 1.486 . . . . 54.32 114.045 -176.389 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 45.5 mt -65.11 -34.38 78.27 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 120.708 -1.245 . . . . 71.239999999999995 110.369 169.551 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 13.8 t -133.98 73.45 1.5 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 122.51 1.147 . . . . 53.020000000000003 109.943 -165.511 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.6 m -136.03 12.98 0.97 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 126.023 1.729 . . . . 54.020000000000003 111.688 -178.143 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 16.0 t -82.78 90.23 2.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 O-C-N 120.626 -1.296 . . . . 44.219999999999999 109.99 -171.493 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 5.3 t -147.51 131.6 17.3 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 126.171 1.788 . . . . 74.319999999999993 106.554 176.717 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.6 p . . . . . 0 CA--C 1.521 -0.143 0 C-N-CA 124.113 0.965 . . . . 62.119999999999997 108.402 176.895 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.473 0.676 0 CA-C-O 122.328 1.061 . . . . 75.530000000000001 113.602 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 1.6 p -131.31 -57.67 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 C-N-CA 127.83 2.452 . . . . 62.450000000000003 107.655 179.035 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 46.9 t80 -55.78 -44.02 77.33 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 119.526 1.057 . . . . 62.549999999999997 109.56 172.174 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.3 ttt180 -62.1 -11.75 15.72 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 114.824 1.416 . . . . 62.539999999999999 114.824 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 55.8 mmtt -105.63 -48.79 3.57 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 120.04 1.291 . . . . 74.519999999999996 109.368 175.376 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 13.8 mt -70.72 -27.83 64.27 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 118.48 -0.771 . . . . 72.549999999999997 110.956 -172.156 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.05 -53.25 21.36 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-N 119.434 1.015 . . . . 53.109999999999999 108.529 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.92 -20.96 66.72 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 117.955 -1.021 . . . . 74.109999999999999 113.05 174.455 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.88 -56.78 6.15 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 103.741 -2.689 . . . . 63.539999999999999 103.741 170.187 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 97.2 mt -77.6 31.56 0.16 Allowed 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 127.135 2.174 . . . . 64.230000000000004 112.141 -174.47 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -57.06 105.15 0.2 Allowed 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 126.779 2.032 . . . . 64.349999999999994 109.306 174.44 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 101.84 -1.36 52.04 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 126.153 1.835 . . . . 65.230000000000004 114.788 -177.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 28.9 mtmm -133.24 10.96 4.17 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 126.027 1.731 . . . . 74.329999999999998 113.088 -177.175 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -151.33 176.04 11.64 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 121.842 0.83 . . . . 44.25 111.683 175.787 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.431 ' H ' ' HB ' ' A' ' 84' ' ' THR . 7.6 m-20 -140.65 163.68 32.22 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 127.582 2.353 . . . . 71.519999999999996 105.599 172.557 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -46.05 -61.78 1.61 Allowed 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 126.109 1.763 . . . . 62.310000000000002 110.358 169.138 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -67.57 -38.11 83.61 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.188 0.595 . . . . 51.409999999999997 111.821 -176.611 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.431 ' HB ' ' H ' ' A' ' 81' ' ' ASP . 28.5 m -55.57 -46.39 77.2 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.802 0.841 . . . . 64.409999999999997 110.895 174.508 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 7.5 mt -70.28 -56.84 9.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 120.181 1.355 . . . . 72.439999999999998 110.301 173.471 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.87 -17.65 61.82 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 119.676 1.126 . . . . 75.25 113.153 -170.272 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -88.99 -32.86 17.42 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 119.541 1.064 . . . . 72.519999999999996 112.823 171.403 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.5 ' HE2' ' CD1' ' A' ' 36' ' ' TRP . 57.7 tptt -63.64 -70.27 0.23 Allowed 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.718 1.207 . . . . 74.530000000000001 112.178 -169.458 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.43 ' HB2' HD11 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -61.02 -31.64 71.26 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 112.806 0.669 . . . . 75.129999999999995 112.806 -167.553 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 74.2 t -58.74 -38.76 73.95 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 C-N-CA 124.925 1.29 . . . . 71.540000000000006 109.428 176.209 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -73.4 -21.4 60.5 Favored 'General case' 0 C--O 1.232 0.181 0 O-C-N 121.67 -0.644 . . . . 72.439999999999998 111.336 -172.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 89.0 mt -72.25 8.17 1.44 Allowed 'General case' 0 C--O 1.227 -0.127 0 C-N-CA 123.785 0.834 . . . . 64.430000000000007 111.661 -170.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 38.1 ttp85 -57.88 -44.52 86.75 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 121.224 -0.923 . . . . 54.509999999999998 110.015 174.768 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.52 -50.24 74.68 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-N 118.466 0.576 . . . . 62.350000000000001 110.851 171.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -58.3 -36.91 74.04 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.609 -0.682 . . . . 61.450000000000003 110.713 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -71.23 -48.82 49.0 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.718 1.207 . . . . 33.119999999999997 111.754 -177.417 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -63.2 -30.22 71.41 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 117.723 0.238 . . . . 75.219999999999999 110.659 177.729 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -57.66 -53.56 56.75 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 125.565 1.546 . . . . 71.019999999999996 111.048 170.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -57.2 -16.76 8.87 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 114.037 1.125 . . . . 61.43 114.037 -174.521 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 50.0 mm -71.23 -61.86 1.52 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 118.927 0.785 . . . . 73.400000000000006 110.168 168.26 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 84.5 mt -67.71 -19.36 24.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 124.478 1.111 . . . . 72.239999999999995 110.48 -173.091 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -69.55 -16.38 63.41 Favored 'General case' 0 N--CA 1.429 -1.517 0 C-N-CA 124.247 1.019 . . . . 73.109999999999999 111.839 172.053 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -145.7 67.84 1.21 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-N 119.899 1.227 . . . . 64.239999999999995 109.867 -173.134 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 15.2 mm . . . . . 0 C--O 1.252 1.185 0 C-N-CA 125.249 1.42 . . . . 74.230000000000004 108.74 173.876 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.543 0.682 0 N-CA-C 115.249 1.574 . . . . 74.420000000000002 115.249 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -62.34 129.58 41.36 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 108.823 -0.806 . . . . 73.150000000000006 108.823 -177.114 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 57.26 -8.63 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 127.889 2.476 . . . . 70.340000000000003 115.535 -169.149 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -77.33 -25.13 50.85 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 119.93 1.241 . . . . 72.150000000000006 112.066 174.413 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.39 -17.6 59.53 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 114.18 1.178 . . . . 74.329999999999998 114.18 -169.614 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -126.28 40.29 3.76 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 125.622 1.569 . . . . 73.340000000000003 108.847 173.324 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -149.37 -75.54 0.16 Allowed 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 107.79 -1.189 . . . . 72.349999999999994 107.79 179.07 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.57 117.77 9.23 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 124.804 1.241 . . . . 74.25 108.631 -178.178 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.74 -31.13 72.2 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 124.168 0.987 . . . . 62.520000000000003 111.669 -173.392 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -60.74 -62.55 1.77 Allowed 'General case' 0 C--O 1.231 0.095 0 C-N-CA 125.717 1.607 . . . . 71.129999999999995 112.163 -177.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 36.0 mt -72.03 -32.81 67.49 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 121.788 -0.57 . . . . 64.230000000000004 109.481 -169.218 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 58.0 t-20 -53.57 -59.93 3.96 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 126.36 1.864 . . . . 74.109999999999999 108.744 169.4 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -56.22 -45.6 79.86 Favored 'General case' 0 CA--C 1.517 -0.298 0 C-N-CA 123.665 0.786 . . . . 73.319999999999993 111.483 179.416 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.37 -31.4 33.61 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 119.234 0.924 . . . . 74.340000000000003 112.268 -177.912 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -91.58 -53.97 4.09 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 125.274 1.43 . . . . 72.239999999999995 111.868 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -58.29 -25.12 61.46 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.73 -0.606 . . . . 74.310000000000002 110.962 179.004 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -106.88 7.54 30.16 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 125.094 1.358 . . . . 52.020000000000003 112.401 -177.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.47 -14.98 3.46 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 120.744 -1.223 . . . . 74.099999999999994 113.124 174.597 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 49.5 mtm180 -62.42 16.56 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 131.344 3.858 . . . . 74.340000000000003 116.113 -166.343 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -124.61 -70.05 0.77 Allowed 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 119.719 1.145 . . . . 70.409999999999997 108.819 165.336 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.451 ' HD2' ' H ' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -60.34 -19.83 56.98 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.467 1.284 . . . . 73.319999999999993 114.467 -165.828 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.18 -19.93 66.21 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 113.039 0.755 . . . . 74.120000000000005 113.039 174.291 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 20.9 tp -72.49 -27.53 62.33 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 126.436 1.894 . . . . 73.400000000000006 110.905 171.805 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.25 -53.66 38.12 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 108.469 -1.852 . . . . 42.219999999999999 108.469 164.928 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -63.59 -7.13 6.39 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.231 1.412 . . . . 71.239999999999995 113.791 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 22.6 t90 -86.02 -79.4 0.25 Allowed 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 107.37 -1.344 . . . . 72.329999999999998 107.37 165.662 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.37 -21.86 62.62 Favored 'General case' 0 C--O 1.225 -0.193 0 C-N-CA 124.804 1.242 . . . . 74.420000000000002 114.099 -167.341 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -54.09 -53.49 52.51 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.861 1.209 . . . . 74.5 109.866 176.523 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -54.74 -48.78 64.44 Favored Glycine 0 CA--C 1.524 0.644 0 C-N-CA 124.254 0.931 . . . . 63.340000000000003 111.771 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.0 mp -52.9 -39.56 62.85 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.523 1.529 . . . . 71.209999999999994 111.78 175.875 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 67.8 mt -86.8 1.44 52.3 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.704 1.602 . . . . 75.129999999999995 112.881 -177.444 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.79 29.64 25.81 Favored Glycine 0 CA--C 1.526 0.771 0 C-N-CA 124.391 0.996 . . . . 53.130000000000003 112.864 177.716 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.9 mttt -128.76 122.0 29.62 Favored 'General case' 0 CA--C 1.523 -0.092 0 C-N-CA 125.642 1.577 . . . . 64.340000000000003 108.566 -168.586 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.4 p -138.26 179.59 6.36 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 124.077 0.951 . . . . 64.540000000000006 109.387 175.854 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 52.46 -131.0 38.77 Favored Glycine 0 CA--C 1.523 0.579 0 C-N-CA 124.613 1.102 . . . . 42.009999999999998 111.414 178.132 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -61.8 -28.77 69.69 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 113.258 0.836 . . . . 61.530000000000001 113.258 -176.228 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -68.63 -47.56 66.31 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 122.61 1.195 . . . . 60.539999999999999 110.424 179.254 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.72 -36.54 81.25 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 114.721 -1.127 . . . . 61.140000000000001 111.079 172.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.5 ttm-85 -53.34 -52.28 59.72 Favored 'General case' 0 N--CA 1.444 -0.755 0 C-N-CA 123.712 0.805 . . . . 73.140000000000001 111.43 175.301 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.74 -45.04 94.55 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.413 0.551 . . . . 50.210000000000001 111.042 -177.518 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -54.23 -45.89 72.4 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.054 0.941 . . . . 74.310000000000002 110.051 175.154 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.97 -13.09 30.6 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 114.106 1.15 . . . . 52.200000000000003 114.106 179.415 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 18.3 mt -94.14 -14.58 25.52 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 120.905 -1.122 . . . . 73.5 110.773 179.432 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 12.5 t -110.24 29.06 8.02 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.067 1.747 . . . . 73.510000000000005 109.721 172.118 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 58.5 t -134.07 75.76 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 N-CA-C 107.337 -1.357 . . . . 44.030000000000001 107.337 170.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.481 HG12 ' H ' ' A' ' 57' ' ' THR . 1.6 t -137.36 168.19 21.63 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 C-N-CA 125.047 1.339 . . . . 73.400000000000006 107.744 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.481 ' H ' HG12 ' A' ' 56' ' ' VAL . 1.0 OUTLIER 67.2 -36.13 0.27 Allowed 'General case' 0 CA--C 1.553 1.078 1 C-N-CA 135.327 5.451 . . . . 61.530000000000001 116.186 -175.767 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 95.0 p . . . . . 0 C--N 1.345 0.383 0 C-N-CA 129.038 2.935 . . . . 73.129999999999995 111.985 -168.053 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.464 0.231 0 N-CA-C 109.904 -0.406 . . . . 72.530000000000001 109.904 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.3 p -67.0 -44.1 88.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 118.393 0.542 . . . . 70.5 110.648 -177.634 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -61.72 -33.34 73.87 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 121.493 -0.754 . . . . 74.329999999999998 111.231 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 17.5 tpp180 -51.82 -50.76 60.2 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 124.804 1.242 . . . . 72.400000000000006 111.341 -171.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.91 -26.8 22.53 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 119.455 -0.307 . . . . 70.340000000000003 111.073 -177.751 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -52.44 -61.41 2.29 Favored 'General case' 0 CA--C 1.52 -0.197 0 C-N-CA 123.974 0.91 . . . . 70.310000000000002 108.839 177.307 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.72 -36.45 80.97 Favored 'General case' 0 N--CA 1.456 -0.165 0 O-C-N 123.889 0.743 . . . . 54.340000000000003 111.931 -171.015 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.39 -45.13 85.24 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.03 0.443 . . . . 71.400000000000006 110.534 178.362 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -65.81 -48.13 72.73 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 122.131 0.967 . . . . 71.219999999999999 109.65 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 11.8 tp -87.2 10.34 17.24 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 127.35 2.26 . . . . 72.230000000000004 113.26 -169.065 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -47.54 111.13 0.38 Allowed 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 127.313 2.245 . . . . 60.009999999999998 110.446 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 106.1 -2.26 38.0 Favored Glycine 0 CA--C 1.524 0.629 0 C-N-CA 125.768 1.652 . . . . 74.400000000000006 113.599 177.225 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.35 -0.13 5.68 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 119.722 1.761 . . . . 61.439999999999998 112.475 -179.329 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -147.89 176.35 10.22 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 125.065 1.346 . . . . 54.399999999999999 108.88 176.874 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -141.57 170.8 15.05 Favored 'General case' 0 CA--C 1.511 -0.521 0 C-N-CA 125.464 1.506 . . . . 65.299999999999997 107.88 174.584 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -65.47 -52.76 50.71 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 125.59 1.556 . . . . 70.030000000000001 108.63 -177.739 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -67.38 -29.95 69.61 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.463 0.705 . . . . 74.540000000000006 110.34 178.434 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 5.0 m -65.46 -57.8 7.39 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.419 0.688 . . . . 73.209999999999994 110.271 173.497 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 21.1 mt -60.29 -53.05 54.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 CA-C-N 120.511 1.505 . . . . 72.519999999999996 109.269 -171.423 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -55.1 -37.58 67.02 Favored 'General case' 0 C--N 1.342 0.265 0 O-C-N 123.999 0.812 . . . . 71.219999999999999 110.858 -178.626 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -71.19 -47.91 54.75 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-O 118.375 -0.821 . . . . 61.299999999999997 109.285 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -50.51 -60.97 2.48 Favored 'General case' 0 CA--C 1.516 -0.345 0 C-N-CA 125.051 1.34 . . . . 73.219999999999999 109.295 -177.517 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . 0.282 0.0 OUTLIER -59.16 -38.35 79.53 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 120.271 -0.572 . . . . 61.329999999999998 111.928 -165.747 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 32.0 t -70.29 -53.16 24.32 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 125.249 1.42 . . . . 64.140000000000001 110.558 174.275 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -63.69 -26.15 68.53 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 120.178 -1.576 . . . . 65.239999999999995 111.769 -168.736 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 44.9 mt -64.6 8.95 0.09 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.856 1.662 . . . . 71.5 113.753 177.616 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -45.0 -64.11 0.78 Allowed 'General case' 0 C--N 1.34 0.195 0 C-N-CA 127.588 2.355 . . . . 73.209999999999994 113.13 -177.569 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.25 -20.2 28.81 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 118.966 0.803 . . . . 62.439999999999998 111.41 178.245 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.2 m -57.56 -30.04 64.91 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 120.858 -1.151 . . . . 74.519999999999996 110.242 174.364 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -54.18 -36.39 63.35 Favored 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 124.929 1.292 . . . . 52.240000000000002 114.253 170.949 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 18.5 ptt180 -90.78 -24.41 20.34 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 117.606 -1.188 . . . . 70.400000000000006 111.671 179.189 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -56.4 -59.28 5.2 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 119.044 0.838 . . . . 65.420000000000002 109.108 169.508 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -58.07 -20.63 40.94 Favored 'General case' 0 C--O 1.223 -0.315 0 N-CA-C 114.636 1.347 . . . . 74.5 114.636 -168.607 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 8.4 mm -89.19 -35.36 7.58 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 O-C-N 120.696 -1.253 . . . . 64.530000000000001 110.016 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 97.0 mt -66.96 -30.32 49.22 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 N-CA-C 108.579 -0.897 . . . . 73.109999999999999 108.579 168.717 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 2.2 t -71.69 -43.0 66.75 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.067 1.347 . . . . 74.319999999999993 109.413 178.175 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -129.49 70.2 1.42 Allowed 'General case' 0 C--O 1.234 0.288 0 C-N-CA 125.778 1.631 . . . . 73.340000000000003 107.508 -169.206 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 76.7 mt . . . . . 0 C--O 1.248 0.975 0 C-N-CA 126.533 1.933 . . . . 54.43 110.76 -176.007 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.464 0.259 0 N-CA-C 115.432 1.641 . . . . 64.409999999999997 115.432 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -53.78 121.37 7.75 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.647 1.112 . . . . 75.319999999999993 109.12 174.498 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 48.51 -0.23 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 129.577 3.151 . . . . 63.399999999999999 117.248 -176.601 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.3 mmtt -76.59 -6.77 53.36 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 125.58 1.552 . . . . 73.409999999999997 112.808 -173.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -58.85 -36.0 73.87 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 119.449 1.022 . . . . 72.319999999999993 111.809 177.946 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.79 16.75 0.08 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.59 1.956 . . . . 64.430000000000007 113.399 178.22 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 44.8 t-80 -152.15 -73.49 0.14 Allowed 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 123.508 0.723 . . . . 75.510000000000005 109.94 -163.327 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -83.73 145.39 28.76 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 123.811 0.844 . . . . 72.530000000000001 108.841 -170.765 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.41 -50.57 9.29 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-O 117.945 -1.026 . . . . 75.329999999999998 109.771 175.269 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -44.94 -42.85 8.51 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 126.489 1.915 . . . . 75.329999999999998 113.392 -178.508 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 82.8 mt -76.38 -28.9 56.93 Favored 'General case' 0 C--N 1.33 -0.274 0 O-C-N 120.908 -1.12 . . . . 64.420000000000002 111.004 -174.266 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -80.03 -28.81 39.28 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.716 2.006 . . . . 73.439999999999998 111.212 171.056 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -56.63 -48.67 77.01 Favored 'General case' 0 C--O 1.226 -0.142 0 C-N-CA 126.929 2.092 . . . . 74.439999999999998 109.696 -171.521 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.45 -41.71 63.53 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 118.526 -0.75 . . . . 60.509999999999998 112.537 175.481 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.15 -54.27 43.56 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 124.515 1.126 . . . . 44.439999999999998 111.153 178.818 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -66.19 -11.26 48.51 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 112.647 0.61 . . . . 72.340000000000003 112.647 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -121.3 32.59 5.86 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.42 1.488 . . . . 60.329999999999998 111.335 -177.499 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -120.01 17.5 12.5 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.057 1.343 . . . . 72.140000000000001 112.86 178.304 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 71.7 mtm-85 -71.23 -48.82 48.94 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 120.296 -1.503 . . . . 74.109999999999999 111.825 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 30.3 m120 -62.19 -27.63 69.11 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 114.642 1.349 . . . . 74.120000000000005 114.642 -163.796 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.485 ' HD3' HD13 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -56.11 -34.61 66.2 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 119.322 0.964 . . . . 71.420000000000002 113.29 172.672 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.485 HD13 ' HD3' ' A' ' 31' ' ' ARG . 1.1 mm? -75.14 -33.23 61.51 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 123.613 0.765 . . . . 55.020000000000003 108.995 -177.618 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.426 HD21 ' HA ' ' A' ' 89' ' ' MET . 3.9 mm? -62.64 -33.44 75.02 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 108.625 -0.879 . . . . 54.409999999999997 108.625 169.908 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -67.81 -14.36 65.23 Favored Glycine 0 CA--C 1.538 1.524 0 CA-C-O 117.709 -1.606 . . . . 63.119999999999997 113.685 170.362 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -91.52 -18.69 23.73 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 121.291 2.545 . . . . 74.450000000000003 111.255 169.026 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 10.6 t90 -76.62 -79.23 0.11 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.148 1.379 . . . . 64.349999999999994 110.518 -176.136 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -50.69 -29.84 12.24 Favored 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 127.472 2.309 . . . . 73.209999999999994 112.722 -171.476 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -44.57 -52.87 7.65 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 126.64 1.976 . . . . 74.150000000000006 110.616 173.144 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -53.45 -48.73 59.47 Favored Glycine 0 C--N 1.337 0.625 0 N-CA-C 110.479 -1.048 . . . . 71.230000000000004 110.479 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.41 ' H ' ' CD1' ' A' ' 40' ' ' LEU . 2.2 mp -61.79 -46.48 89.36 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 126.728 2.011 . . . . 73.129999999999995 108.621 -177.37 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.0 mp -62.97 -18.28 63.04 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.083 1.353 . . . . 63.32 112.899 175.606 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 106.08 -1.91 38.07 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 127.065 2.269 . . . . 52.109999999999999 112.8 177.312 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 44.4 mttm -75.1 143.53 43.32 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 118.466 1.133 . . . . 71.319999999999993 108.65 178.428 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.1 p -142.16 178.53 7.48 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 124.043 0.937 . . . . 73.319999999999993 109.326 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 55.08 -119.89 15.23 Favored Glycine 0 N--CA 1.442 -0.922 0 C-N-CA 124.63 1.109 . . . . 64.319999999999993 110.544 168.704 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -82.86 -22.52 34.03 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 123.568 0.747 . . . . 64.340000000000003 112.768 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -72.43 -41.51 66.11 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.003 -1.06 . . . . 60.210000000000001 110.372 -176.953 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.8 -46.71 88.36 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.647 -0.872 . . . . 73.329999999999998 108.647 168.491 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -59.17 -33.63 71.15 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 118.419 -0.801 . . . . 74.25 112.895 179.2 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.56 -51.23 29.9 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 124.704 1.202 . . . . 72.150000000000006 109.849 175.37 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -56.77 -30.28 63.47 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.5 1.12 . . . . 75.239999999999995 111.857 176.432 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.45 1.09 2.48 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 120.468 -1.395 . . . . 75.239999999999995 114.32 175.605 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.0 mt -108.81 1.49 20.99 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 125.263 1.425 . . . . 64.109999999999999 110.147 179.058 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 77.4 p -129.9 18.79 5.58 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.165 0.893 . . . . 72.530000000000001 112.163 -168.169 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 5.4 t -132.97 102.68 5.23 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 C-N-CA 125.06 1.344 . . . . 63.240000000000002 109.08 177.479 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 4.2 p -146.78 128.15 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 O-C-N 120.884 -1.135 . . . . 71.319999999999993 110.058 175.574 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 5.5 t -170.55 87.13 0.12 Allowed 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 106.663 -1.606 . . . . 62.32 106.663 178.769 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.1 t . . . . . 0 CA--C 1.54 0.573 0 C-N-CA 126.76 2.024 . . . . 72.299999999999997 108.173 -172.994 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.473 0.696 0 N-CA-C 111.459 0.17 . . . . 74.310000000000002 111.459 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 48.2 t -84.38 -48.88 16.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 C-N-CA 124.17 0.988 . . . . 62.229999999999997 109.939 -177.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.43 -22.11 60.98 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 118.868 0.758 . . . . 74.099999999999994 112.889 -179.001 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.0 ttt180 -44.6 -43.14 7.94 Favored 'General case' 0 CA--C 1.516 -0.352 0 C-N-CA 128.429 2.692 . . . . 73.420000000000002 112.021 172.114 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -74.0 -15.79 61.09 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 118.403 -0.808 . . . . 74.219999999999999 111.98 -171.696 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 70.0 mt -96.32 -53.93 3.45 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.55 -0.907 . . . . 64.439999999999998 108.55 167.602 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -52.62 -40.47 62.78 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.753 1.621 . . . . 53.049999999999997 113.109 -169.111 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.35 -48.18 62.11 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.847 0.459 . . . . 74.140000000000001 111.159 177.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -67.24 -28.77 68.33 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 120.852 -1.155 . . . . 55.420000000000002 111.262 -176.852 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 14.2 tp -103.78 13.43 33.02 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 128.063 2.545 . . . . 54.420000000000002 111.824 -172.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -59.34 111.84 1.52 Allowed 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 126.268 1.827 . . . . 64.549999999999997 109.462 -177.574 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 105.49 -3.61 39.9 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 126.084 1.802 . . . . 71.239999999999995 113.077 -174.138 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 14.3 mtmm -134.16 -0.4 3.03 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 118.959 1.38 . . . . 72.030000000000001 112.474 -177.186 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -144.93 172.15 13.44 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 119.028 0.831 . . . . 75.239999999999995 110.506 168.5 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -132.83 161.45 34.12 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 125.845 1.658 . . . . 63.219999999999999 107.478 -178.779 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -64.73 -49.74 69.67 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.117 -0.947 . . . . 75.239999999999995 110.066 -164.584 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -71.64 -34.94 70.21 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 122.695 0.398 . . . . 75.519999999999996 110.042 177.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 52.3 m -57.24 -45.71 83.69 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.004 0.922 . . . . 61.140000000000001 111.062 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 79.8 mt -58.5 -48.58 85.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 CA-C-N 119.589 1.086 . . . . 60.340000000000003 110.404 179.622 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.64 -44.75 93.39 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 118.943 0.792 . . . . 71.129999999999995 110.667 -175.587 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.7 -38.08 89.76 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.198 0.599 . . . . 75.239999999999995 111.567 179.046 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.36 -47.04 76.36 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.319 0.648 . . . . 75.019999999999996 110.744 -177.078 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' MET . . . . . 0.426 ' HA ' HD21 ' A' ' 33' ' ' LEU . 10.5 mtt -61.84 -30.59 70.94 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 120.992 0.425 . . . . 62.119999999999997 111.853 -178.64 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 92.1 t -86.6 -25.44 6.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 124.915 1.286 . . . . 52.210000000000001 110.207 -171.869 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 90.2 mt-10 -56.99 -45.02 83.26 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.459 1.104 . . . . 55.509999999999998 110.459 175.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 4.2 pp -101.28 18.69 19.32 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 127.592 2.357 . . . . 74.040000000000006 112.688 -174.406 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.71 -31.08 72.14 Favored 'General case' 0 N--CA 1.469 0.493 0 O-C-N 119.92 -1.738 . . . . 75.400000000000006 113.945 -173.757 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -78.09 -37.2 46.99 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 119.665 1.12 . . . . 53.530000000000001 111.313 173.784 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 6.1 m -45.38 -47.56 13.51 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.435 1.894 . . . . 74.439999999999998 110.902 -172.624 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -64.75 -40.47 95.36 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 113.945 1.091 . . . . 63.530000000000001 113.945 -177.583 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 11.6 ptt180 -73.87 -33.13 63.93 Favored 'General case' 0 C--N 1.342 0.247 0 CA-C-O 117.436 -1.268 . . . . 62.520000000000003 110.59 -175.489 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -49.47 -55.69 12.36 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 118.314 -0.85 . . . . 55.399999999999999 109.034 171.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -53.12 -39.84 63.74 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-O 118.475 -0.774 . . . . 63.299999999999997 112.987 -173.014 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 8.5 mm -63.23 -46.41 95.85 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 120.04 1.291 . . . . 75.120000000000005 109.961 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 56.0 mt -67.03 -24.52 32.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 124.821 1.248 . . . . 73.109999999999999 109.095 179.747 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.13 -12.57 59.65 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.527 1.931 . . . . 74.329999999999998 111.53 176.23 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -121.36 24.07 10.12 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 125.587 1.555 . . . . 73.25 109.873 -163.44 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 33.0 mm . . . . . 0 C--O 1.255 1.346 0 N-CA-C 107.371 -1.344 . . . . 41.240000000000002 107.371 176.443 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.547 0.845 0 N-CA-C 116.607 2.077 . . . . 71.439999999999998 116.607 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -77.37 117.53 18.95 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 119.481 -2.012 . . . . 72.140000000000001 109.369 -171.221 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.29 -15.94 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 128.335 2.654 . . . . 71.310000000000002 116.069 -164.123 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 30.4 mttm -74.27 2.91 8.12 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.873 2.069 . . . . 74.120000000000005 115.802 -173.757 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.601 ' CZ ' ' HB2' ' A' ' 25' ' ' ALA . 0.1 OUTLIER -80.71 1.56 29.68 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 119.513 -1.992 . . . . 71.010000000000005 112.307 175.388 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -120.86 -154.75 0.6 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.922 2.089 . . . . 64.230000000000004 105.568 159.678 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 65.92 -54.61 0.37 Allowed 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 129.167 2.987 . . . . 73.099999999999994 115.711 168.74 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -96.0 -175.44 3.4 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 127.747 2.419 . . . . 75.200000000000003 107.604 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -113.72 -39.98 3.9 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 117.747 -1.12 . . . . 73.420000000000002 110.515 166.21 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 77.8 mt-10 -45.55 -54.02 8.17 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.066 1.346 . . . . 61.210000000000001 112.521 -175.19 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -72.34 -33.93 67.67 Favored 'General case' 0 N--CA 1.436 -1.137 0 O-C-N 121.01 -1.056 . . . . 63.229999999999997 111.931 -177.262 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -72.34 -30.01 64.35 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 123.37 0.668 . . . . 63.399999999999999 110.697 177.86 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.22 -45.84 90.04 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.674 1.189 . . . . 75.140000000000001 109.644 177.38 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 13.3 mttp -53.06 -39.63 63.4 Favored 'General case' 0 N--CA 1.463 0.182 0 O-C-N 121.599 -0.688 . . . . 72.439999999999998 110.927 172.231 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.601 ' HB2' ' CZ ' ' A' ' 15' ' ' PHE . . . -78.98 -28.64 43.53 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 114.098 1.147 . . . . 60.130000000000003 114.098 179.322 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -67.6 -40.61 84.75 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 108.436 -0.95 . . . . 74.0 108.436 178.53 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -109.06 54.99 0.64 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 122.004 0.907 . . . . 64.439999999999998 110.221 -156.668 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.5 ppt_? -151.71 -15.45 0.19 Allowed 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 114.215 1.191 . . . . 62.219999999999999 114.215 -177.492 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.13 -22.25 16.07 Favored 'General case' 0 C--O 1.231 0.088 0 O-C-N 120.69 -1.256 . . . . 73.200000000000003 114.031 -178.169 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -105.12 -25.32 12.55 Favored 'General case' 0 CA--C 1.518 -0.25 0 N-CA-C 113.99 1.107 . . . . 73.319999999999993 113.99 176.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.92 -22.4 64.33 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 118.919 0.782 . . . . 75.140000000000001 112.317 -169.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.4 -11.87 47.93 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 124.589 1.155 . . . . 64.109999999999999 113.678 -178.781 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 16.9 tp -72.88 -21.75 60.88 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.814 1.246 . . . . 75.0 112.243 -175.272 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -66.19 -37.59 93.1 Favored Glycine 0 CA--C 1.521 0.434 0 N-CA-C 110.898 -0.881 . . . . 75.129999999999995 110.898 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -54.73 -34.97 63.19 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 126.377 1.871 . . . . 73.340000000000003 111.568 178.516 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 28.3 t90 -70.26 -81.53 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.673 -0.862 . . . . 73.239999999999995 108.673 174.323 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -57.92 -24.7 58.99 Favored 'General case' 0 C--N 1.34 0.178 0 N-CA-C 114.311 1.226 . . . . 75.209999999999994 114.311 -167.228 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.01 -56.41 14.46 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 119.725 1.148 . . . . 73.299999999999997 109.954 176.027 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -53.45 -49.05 58.59 Favored Glycine 0 CA--C 1.527 0.79 0 CA-C-O 119.282 -0.732 . . . . 71.329999999999998 111.889 177.826 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 8.4 mp -52.41 -45.88 66.09 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.609 1.163 . . . . 74.329999999999998 110.892 179.083 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 84.8 mt -79.02 0.28 28.35 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 127.0 2.12 . . . . 74.310000000000002 112.862 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 71.41 3.07 52.33 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 124.691 1.138 . . . . 62.229999999999997 113.113 -175.396 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -63.48 127.72 32.6 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 106.178 -1.786 . . . . 74.140000000000001 106.178 175.647 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 37.7 p -136.37 171.79 13.97 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 107.98 -1.119 . . . . 52.229999999999997 107.98 175.048 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 51.14 -125.69 25.2 Favored Glycine 0 CA--C 1.524 0.634 0 C-N-CA 124.024 0.821 . . . . 31.350000000000001 112.632 172.692 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -61.89 -37.27 83.94 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.804 1.242 . . . . 73.219999999999999 111.704 -176.507 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.49 -43.03 73.97 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.686 0.795 . . . . 72.019999999999996 110.944 -177.399 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.77 -41.84 87.07 Favored 'General case' 0 C--O 1.227 -0.102 0 C-N-CA 123.577 0.751 . . . . 73.129999999999995 109.799 173.615 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 23.0 mtm180 -54.45 -57.3 11.84 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 118.87 -0.586 . . . . 75.319999999999993 109.531 176.071 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.58 -33.47 75.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 119.081 0.855 . . . . 74.310000000000002 111.49 -170.089 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 61.4 t80 -60.29 -55.24 36.11 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.284 1.034 . . . . 64.329999999999998 109.269 169.64 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.75 -36.7 81.77 Favored 'General case' 0 N--CA 1.462 0.128 0 C-N-CA 125.597 1.559 . . . . 42.530000000000001 113.604 -175.26 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.2 mt -59.69 -23.28 62.99 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 124.981 1.312 . . . . 73.040000000000006 111.149 -174.769 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.45 -82.22 0.62 Allowed 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 126.083 1.753 . . . . 74.340000000000003 107.585 178.86 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . 0.353 8.9 p 44.38 25.77 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 C-N-CA 128.315 2.646 . . . . 63.020000000000003 114.023 -171.308 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 3.6 m -100.79 125.68 54.62 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.855 0 O-C-N 119.042 -2.286 . . . . 64.239999999999995 110.688 178.794 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.8 t -153.57 -171.68 3.98 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 128.289 2.636 . . . . 55.240000000000002 105.379 170.543 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.8 m . . . . . 0 CA--C 1.536 0.419 0 C-N-CA 124.686 1.194 . . . . 73.140000000000001 108.724 -165.871 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.7 t0 . . . . . 0 CA--C 1.541 0.602 0 N-CA-C 111.633 0.234 . . . . 73.319999999999993 111.633 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 87.2 t -56.9 -49.02 80.41 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 O-C-N 119.901 -1.75 . . . . 60.229999999999997 110.579 169.537 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -65.88 -38.73 89.55 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 118.701 -0.666 . . . . 64.099999999999994 110.285 176.323 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.5 tpt180 -52.41 -56.51 14.55 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 118.349 0.522 . . . . 61.340000000000003 110.026 177.248 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? -63.28 -50.58 69.57 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 124.101 0.96 . . . . 64.209999999999994 109.459 -178.555 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 9.1 mt -56.15 -50.59 70.71 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-O 118.342 -0.837 . . . . 72.299999999999997 110.329 -176.303 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.07 -39.12 92.77 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 119.623 1.101 . . . . 75.040000000000006 112.419 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.36 -25.6 66.06 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 118.756 0.707 . . . . 71.010000000000005 111.498 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.05 -38.03 16.91 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 124.004 0.921 . . . . 71.230000000000004 111.035 174.92 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 94.3 mt -86.03 37.93 0.74 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.158 1.783 . . . . 71.420000000000002 109.84 175.787 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -61.65 102.33 0.25 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.472 1.909 . . . . 71.140000000000001 108.386 176.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 89.97 9.85 65.34 Favored Glycine 0 CA--C 1.523 0.569 0 C-N-CA 124.665 1.126 . . . . 72.230000000000004 112.876 -177.194 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -129.11 -10.95 4.74 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 119.475 1.637 . . . . 73.0 113.019 -173.5 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -149.27 171.37 16.61 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 119.207 0.912 . . . . 63.310000000000002 111.286 172.727 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -120.87 165.34 15.33 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 125.01 1.324 . . . . 62.210000000000001 109.973 -171.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -57.03 -26.69 60.73 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 126.842 2.057 . . . . 55.299999999999997 113.576 179.001 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -109.46 -22.47 12.0 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.885 0.874 . . . . 72.230000000000004 113.056 174.432 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.8 m -65.6 -37.88 87.87 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 120.562 -1.337 . . . . 43.240000000000002 113.132 -175.745 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 10.4 mt -69.69 -56.45 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 N-CA-C 107.627 -1.249 . . . . 64.430000000000007 107.627 179.326 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.51 -36.43 66.68 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 123.172 0.589 . . . . 73.319999999999993 110.979 -174.895 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.24 -38.89 78.7 Favored 'General case' 0 N--CA 1.443 -0.807 0 O-C-N 123.658 0.599 . . . . 73.310000000000002 110.858 179.0 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 6.3 tppt? -64.0 -49.66 71.56 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 119.448 1.022 . . . . 62.409999999999997 109.08 -161.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -43.88 97.16 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 113.119 0.785 . . . . 73.030000000000001 113.119 -177.811 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 58.6 t -65.04 -37.02 79.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 C-N-CA 123.985 0.914 . . . . 72.430000000000007 110.772 177.479 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -66.37 -26.49 67.29 Favored 'General case' 0 C--O 1.237 0.436 0 O-C-N 120.584 -1.322 . . . . 75.230000000000004 112.053 -175.336 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 45.3 mt -87.48 9.65 20.2 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.081 0.952 . . . . 75.209999999999994 112.322 -167.658 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 76.2 mtt85 -52.81 -46.62 67.78 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 120.88 1.673 . . . . 73.230000000000004 111.155 175.086 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -54.56 -66.23 0.44 Allowed 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 125.728 1.611 . . . . 73.010000000000005 109.12 177.301 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.6 m -48.01 -52.01 21.7 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 126.096 1.758 . . . . 62.329999999999998 110.766 -178.653 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.7 -36.14 73.75 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.874 1.27 . . . . 55.200000000000003 111.711 -177.445 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 14.8 ttp180 -59.4 -57.9 10.98 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 119.947 1.249 . . . . 63.43 108.45 173.126 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -65.82 -30.56 71.21 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-O 116.574 -1.679 . . . . 74.209999999999994 112.065 -169.532 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -48.85 -54.53 14.86 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-N 119.898 1.226 . . . . 73.319999999999993 110.237 174.199 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 18.8 mm -55.97 -47.1 80.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-N 119.684 1.129 . . . . 35.25 111.56 179.227 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 50.6 mt -66.66 -18.17 23.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 124.329 1.051 . . . . 64.340000000000003 109.569 -178.226 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 1.4 t -115.72 19.42 15.25 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.708 2.003 . . . . 73.420000000000002 110.058 -174.438 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -130.65 19.72 5.14 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.695 1.998 . . . . 72.329999999999998 110.341 177.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 33.3 mm . . . . . 0 C--O 1.247 0.943 0 CA-C-O 116.788 -1.577 . . . . 51.43 109.369 177.195 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.547 0.84 0 N-CA-C 114.125 1.157 . . . . 74.299999999999997 114.125 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.44 ' HG3' ' H ' ' A' ' 13' ' ' ALA . 6.1 pt-20 -70.08 -85.54 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.64 1.109 . . . . 63.310000000000002 111.444 -176.151 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.44 ' H ' ' HG3' ' A' ' 12' ' ' GLU . . . -72.1 -11.88 60.95 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.736 -1.228 . . . . 42.439999999999998 112.112 177.176 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 51.2 mmtt -57.68 -22.9 48.66 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 125.026 1.33 . . . . 74.540000000000006 113.528 -178.255 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -60.41 -18.79 53.09 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.561 0.744 . . . . 74.400000000000006 112.796 177.809 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -125.97 55.29 1.47 Allowed 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.258 1.023 . . . . 65.430000000000007 108.41 168.671 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -156.05 -55.62 0.09 Allowed 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 118.413 -0.803 . . . . 72.099999999999994 111.206 -179.027 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -117.19 122.6 44.5 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 119.093 0.86 . . . . 71.530000000000001 110.357 -165.018 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.41 -32.51 66.93 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 125.952 1.701 . . . . 64.129999999999995 112.893 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -63.28 -52.8 60.54 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 123.447 0.699 . . . . 61.420000000000002 111.439 -179.072 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 44.2 mt -71.97 -39.99 68.95 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 108.463 -0.939 . . . . 34.109999999999999 108.463 -176.736 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -47.11 -48.31 23.01 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 117.36 -1.305 . . . . 65.200000000000003 111.475 166.325 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -64.79 -48.39 74.63 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 120.419 1.463 . . . . 64.209999999999994 110.803 177.704 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -50.42 -42.37 53.75 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 121.514 -0.741 . . . . 70.230000000000004 110.798 175.918 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -90.65 -9.58 46.35 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 125.343 1.457 . . . . 62.100000000000001 114.615 -177.745 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.07 -41.37 82.02 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 119.723 1.147 . . . . 71.400000000000006 110.552 -174.553 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -117.48 -85.26 0.64 Allowed 'General case' 0 N--CA 1.442 -0.84 0 N-CA-C 106.266 -1.753 . . . . 52.229999999999997 106.266 -160.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.346 0.0 OUTLIER 48.56 -1.41 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 117.652 2.464 . . . . 72.030000000000001 117.652 171.099 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 -80.13 4.96 15.66 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 121.358 1.89 . . . . 73.299999999999997 112.111 -177.267 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -130.65 -26.98 2.18 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-O 117.31 -1.329 . . . . 44.210000000000001 111.044 178.686 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.83 -55.01 7.16 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 120.686 1.585 . . . . 71.109999999999999 108.894 175.368 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.452 ' HA ' ' HG3' ' A' ' 35' ' ' GLU . 0.2 OUTLIER -61.01 -13.71 18.23 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 126.41 1.884 . . . . 71.219999999999999 115.266 -175.974 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 29.6 tp -71.38 -32.59 68.65 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 120.782 -1.199 . . . . 62.420000000000002 110.262 -172.068 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.01 -34.82 90.94 Favored Glycine 0 CA--C 1.529 0.948 0 N-CA-C 110.949 -0.861 . . . . 74.340000000000003 110.949 173.694 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.452 ' HG3' ' HA ' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -65.32 -19.14 65.82 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.754 1.277 . . . . 64.420000000000002 111.406 -173.425 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 19.9 t90 -74.4 -75.71 0.15 Allowed 'General case' 0 C--N 1.341 0.227 0 N-CA-C 107.946 -1.131 . . . . 70.349999999999994 107.946 169.9 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -54.7 -29.3 52.69 Favored 'General case' 0 C--O 1.222 -0.356 0 C-N-CA 125.139 1.375 . . . . 34.299999999999997 112.722 -171.222 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -45.08 -53.75 7.55 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.903 1.229 . . . . 65.239999999999995 111.222 169.415 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.4 -33.52 87.46 Favored Glycine 0 CA--C 1.532 1.109 0 O-C-N 121.95 -0.469 . . . . 74.450000000000003 112.01 -177.765 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.429 HD22 HD11 ' A' ' 76' ' ' LEU . 7.4 mp -66.12 -50.93 62.31 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.608 1.563 . . . . 65.140000000000001 109.588 173.859 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.7 mp -62.99 -28.45 70.1 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 125.498 1.519 . . . . 73.409999999999997 113.072 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 108.92 20.82 7.78 Favored Glycine 0 CA--C 1.527 0.802 0 C-N-CA 124.892 1.234 . . . . 72.120000000000005 112.878 -179.541 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.0 mttt -106.83 135.66 47.99 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 125.794 1.638 . . . . 73.409999999999997 107.944 178.552 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 17.5 p -138.29 154.22 49.03 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 124.458 1.103 . . . . 71.219999999999999 108.789 -176.355 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 49.94 -118.06 5.38 Favored Glycine 0 CA--C 1.523 0.555 0 N-CA-C 111.214 -0.754 . . . . 72.340000000000003 111.214 173.609 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -57.71 -36.86 72.58 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.765 1.626 . . . . 72.140000000000001 113.313 -177.78 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -68.01 -45.85 72.88 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 122.024 0.916 . . . . 75.239999999999995 109.851 177.633 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.92 -32.53 74.08 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.695 0.798 . . . . 70.040000000000006 110.475 177.473 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.7 ttm180 -54.88 -52.12 63.82 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 124.332 1.053 . . . . 73.120000000000005 111.266 178.281 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.47 -41.22 96.9 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-O 121.671 0.748 . . . . 74.230000000000004 110.988 -179.112 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -65.14 -37.65 88.09 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 121.252 0.549 . . . . 72.420000000000002 111.396 178.413 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.09 -1.47 5.99 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.169 1.387 . . . . 34.420000000000002 112.596 177.299 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 35.7 mt -106.83 7.96 30.49 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.895 1.678 . . . . 64.040000000000006 111.106 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.0 t -141.21 19.94 2.26 Favored 'General case' 0 CA--C 1.543 0.673 0 O-C-N 121.409 -0.807 . . . . 74.430000000000007 112.963 -174.098 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 25.8 t -130.84 73.49 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 O-C-N 120.445 -1.409 . . . . 73.430000000000007 107.884 178.234 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 79.9 t -142.15 124.72 14.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 C-N-CA 124.155 0.982 . . . . 74.010000000000005 108.959 175.692 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.7 t -155.2 -55.66 0.09 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 106.033 -1.839 . . . . 61.399999999999999 106.033 169.402 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.446 -0.64 0 CA-C-O 122.385 1.088 . . . . 72.420000000000002 109.871 -166.006 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 39.3 t0 . . . . . 0 CA--C 1.522 -0.12 0 N-CA-C 110.349 -0.241 . . . . 62.140000000000001 110.349 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 85.6 t -84.74 -39.66 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 O-C-N 121.528 -0.733 . . . . 73.040000000000006 111.199 -175.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.437 ' CE2' ' HG2' ' A' ' 82' ' ' GLU . 2.3 t80 -74.4 -25.15 59.29 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.503 -0.748 . . . . 63.420000000000002 111.553 179.173 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.7 ttm180 -44.88 -67.77 0.26 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.065 1.746 . . . . 74.049999999999997 112.848 -174.334 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.576 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -55.13 -46.75 75.66 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 126.087 1.755 . . . . 72.340000000000003 110.115 -177.01 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.65 -57.44 11.94 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 125.267 1.427 . . . . 62.219999999999999 110.189 -177.392 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.423 ' HB2' ' CE2' ' A' ' 69' ' ' PHE . . . -65.59 -36.64 84.33 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.998 0.519 . . . . 74.430000000000007 110.906 -175.784 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.82 -47.07 85.02 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.828 0.451 . . . . 54.509999999999998 111.148 176.288 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.06 -48.85 78.39 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 124.906 1.283 . . . . 75.430000000000007 109.873 179.332 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.429 HD11 HD22 ' A' ' 40' ' ' LEU . 11.8 tp -100.84 14.65 31.05 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 125.819 1.647 . . . . 74.340000000000003 112.959 -159.175 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -47.01 119.81 2.74 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 127.315 2.246 . . . . 62.329999999999998 110.987 -174.867 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 86.53 -1.74 87.27 Favored Glycine 0 CA--C 1.524 0.614 0 C-N-CA 124.657 1.122 . . . . 72.329999999999998 113.571 175.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -124.73 0.47 8.09 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 118.675 1.237 . . . . 70.219999999999999 110.512 -174.579 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -148.98 176.14 10.69 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 125.86 1.664 . . . . 50.530000000000001 109.794 171.761 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -135.69 162.02 33.91 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 126.45 1.9 . . . . 74.239999999999995 107.14 -177.048 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.437 ' HG2' ' CE2' ' A' ' 69' ' ' PHE . 0.3 OUTLIER -54.43 -55.29 30.29 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 124.926 1.29 . . . . 70.209999999999994 111.409 178.499 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -68.7 -31.45 70.56 Favored 'General case' 0 C--O 1.225 -0.201 0 O-C-N 121.529 -0.732 . . . . 74.239999999999995 111.008 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 77.0 m -66.23 -39.48 89.59 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 118.751 -0.643 . . . . 73.409999999999997 109.286 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 75.0 mt -65.62 -48.32 83.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-N 119.795 1.18 . . . . 71.329999999999998 108.89 175.553 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.6 ppt_? -63.43 -36.81 84.97 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 118.771 -0.633 . . . . 73.329999999999998 110.818 -175.523 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.49 -54.62 21.88 Favored 'General case' 0 N--CA 1.445 -0.72 0 C-N-CA 124.244 1.018 . . . . 70.409999999999997 109.312 174.442 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.404 ' O ' HD22 ' A' ' 92' ' ' LEU . 10.7 tptt -50.07 -51.88 39.01 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 118.828 0.74 . . . . 74.099999999999994 110.62 -171.027 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 12.6 ptp -64.19 -29.56 70.66 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 120.049 -0.66 . . . . 72.319999999999993 112.27 -175.312 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 89.2 t -79.58 -28.34 12.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 124.159 0.984 . . . . 74.430000000000007 111.072 174.883 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -54.0 -51.58 63.48 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 121.217 1.826 . . . . 64.010000000000005 110.432 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.404 HD22 ' O ' ' A' ' 88' ' ' LYS . 0.2 OUTLIER -75.31 6.12 4.84 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.828 0.677 . . . . 65.299999999999997 112.828 -174.167 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 36.2 ttm180 -47.64 -41.12 21.48 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.306 1.442 . . . . 73.329999999999998 112.516 -174.71 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -96.96 -27.39 14.66 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 113.268 0.84 . . . . 53.5 113.268 173.551 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 44.5 m -59.33 -35.61 74.14 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 120.467 -1.395 . . . . 54.329999999999998 110.962 177.593 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -51.44 -45.01 62.5 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.189 0.996 . . . . 73.120000000000005 112.246 -177.5 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.47 -27.21 67.63 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-O 119.167 -0.444 . . . . 72.0 112.09 -178.065 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -80.11 -38.55 31.37 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 109.105 -0.702 . . . . 74.109999999999999 109.105 -178.686 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -55.94 -44.57 78.54 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-O 117.636 -1.173 . . . . 72.409999999999997 112.84 -176.555 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 20.0 mm -56.1 -49.27 76.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 120.234 1.379 . . . . 73.439999999999998 108.729 178.258 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 53.7 mt -69.93 -7.04 7.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 C-N-CA 125.245 1.418 . . . . 72.109999999999999 111.453 178.589 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 9.5 t -117.45 21.38 13.09 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.853 2.061 . . . . 74.340000000000003 110.767 178.854 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 -119.53 13.39 12.56 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.926 2.091 . . . . 72.439999999999998 108.604 176.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.255 1.363 0 N-CA-C 108.273 -1.01 . . . . 74.109999999999999 108.273 177.316 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 2.1 p80 . . . . . 0 CA--C 1.531 0.231 0 N-CA-C 107.942 -1.133 . . . . 75.099999999999994 107.942 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . 0.256 12.9 pt-20 49.69 81.72 0.06 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.911 1.685 . . . . 73.209999999999994 111.461 -176.849 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.42 39.64 14.9 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 126.288 1.835 . . . . 63.210000000000001 112.756 -177.167 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.3 mmtt -107.38 -9.46 16.01 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 125.166 1.386 . . . . 75.200000000000003 112.487 -178.237 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -51.15 -31.22 19.08 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.006 1.322 . . . . 75.120000000000005 113.817 176.754 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.33 -8.11 29.86 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.438 1.095 . . . . 61.009999999999998 113.169 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 18.0 t-80 -117.88 161.2 20.14 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 126.648 1.979 . . . . 71.340000000000003 107.63 -175.5 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 58.18 -158.07 0.29 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.405 1.082 . . . . 75.129999999999995 109.133 177.828 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -136.33 -34.11 0.79 Allowed 'General case' 0 C--O 1.223 -0.312 0 C-N-CA 124.277 1.031 . . . . 74.200000000000003 109.222 159.493 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -45.92 -40.36 10.07 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 125.074 1.35 . . . . 74.299999999999997 111.939 177.748 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 18.7 mt -66.16 -39.45 89.8 Favored 'General case' 0 C--N 1.331 -0.201 0 O-C-N 120.936 -1.102 . . . . 64.409999999999997 110.918 -175.377 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -76.76 -26.64 54.76 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.365 1.466 . . . . 62.219999999999999 110.611 174.386 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -55.36 -39.88 70.61 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.811 1.244 . . . . 72.310000000000002 111.229 -169.697 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.496 ' HE2' HD12 ' A' ' 100' ' ' ILE . 16.1 ptmt -54.38 -46.5 73.07 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 120.692 -1.255 . . . . 72.5 111.259 175.979 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.609 ' HB1' ' HA ' ' A' ' 97' ' ' ARG . . . -65.38 -58.71 5.22 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 125.693 1.597 . . . . 74.0 110.847 179.423 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -67.82 -3.45 9.6 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.06 0.763 . . . . 54.240000000000002 113.06 -176.713 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -116.38 11.41 14.97 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.675 1.99 . . . . 64.310000000000002 112.888 171.858 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.6 mmt-85 -74.84 -14.42 60.68 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 119.626 -1.921 . . . . 64.430000000000007 112.543 175.2 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -47.17 -72.41 0.05 Allowed 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 127.37 2.268 . . . . 72.329999999999998 112.819 -163.828 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -74.13 -5.91 44.55 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 120.76 1.618 . . . . 60.119999999999997 112.993 -177.544 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.14 -34.98 66.4 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 121.143 1.792 . . . . 74.439999999999998 111.624 -177.027 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.25 -11.76 58.47 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 112.464 0.542 . . . . 55.32 112.464 -175.674 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -66.93 -22.26 65.95 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 126.103 1.761 . . . . 73.340000000000003 114.239 -171.159 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -70.08 -31.75 69.38 Favored Glycine 0 C--O 1.224 -0.487 0 C-N-CA 120.608 -0.806 . . . . 74.0 111.301 -179.397 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 75.4 mt-10 -64.65 -33.58 76.26 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 124.035 0.934 . . . . 74.310000000000002 111.517 -172.728 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 9.0 t90 -58.07 -77.74 0.03 OUTLIER 'General case' 0 C--O 1.233 0.194 0 C-N-CA 124.518 1.127 . . . . 75.230000000000004 108.08 168.537 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.426 ' HB1' HD13 ' A' ' 76' ' ' LEU . . . -57.28 -29.18 63.64 Favored 'General case' 0 C--O 1.218 -0.565 0 C-N-CA 125.886 1.674 . . . . 74.439999999999998 112.745 -168.305 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -46.16 -54.56 8.45 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 120.321 1.419 . . . . 54.420000000000002 112.038 176.578 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -57.86 -40.42 93.05 Favored Glycine 0 CA--C 1.531 1.033 0 CA-C-N 118.707 0.685 . . . . 74.129999999999995 111.443 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.4 mp -63.06 -42.58 99.74 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.364 1.466 . . . . 70.349999999999994 110.362 178.085 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.5 mp -70.08 -0.58 7.93 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 127.899 2.479 . . . . 72.129999999999995 113.198 172.754 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 71.96 25.54 74.54 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 124.862 1.22 . . . . 71.140000000000001 112.523 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 45.1 mttt -107.98 148.51 29.6 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 125.329 1.452 . . . . 74.530000000000001 108.629 174.029 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.0 p -142.95 166.78 23.7 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-O 121.283 0.563 . . . . 71.239999999999995 110.767 171.538 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 67.13 -113.69 5.79 Favored Glycine 0 N--CA 1.444 -0.793 0 C-N-CA 124.881 1.229 . . . . 74.109999999999999 110.965 168.418 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -73.44 -41.85 62.71 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.207 -0.497 . . . . 71.340000000000003 111.304 -171.236 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.22 -36.37 82.87 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 110.158 -0.312 . . . . 74.209999999999994 110.158 178.19 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.54 -43.81 93.41 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 122.91 0.484 . . . . 64.340000000000003 110.86 173.571 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.7 ttt180 -65.27 -47.77 75.51 Favored 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 124.221 1.008 . . . . 73.010000000000005 108.959 179.323 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.83 -48.13 78.04 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 118.888 -0.577 . . . . 51.130000000000003 110.354 -176.187 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 45.4 t80 -50.6 -52.6 37.73 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 124.157 0.983 . . . . 74.310000000000002 110.03 172.683 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.56 -26.55 55.4 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 113.219 0.822 . . . . 64.209999999999994 113.219 178.845 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 16.3 mt -76.35 -16.95 59.63 Favored 'General case' 0 C--N 1.333 -0.148 0 O-C-N 120.63 -1.294 . . . . 64.299999999999997 111.486 -175.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.6 t -121.26 -8.09 9.25 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 119.965 1.257 . . . . 73.540000000000006 112.664 -172.857 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 4.7 p -73.19 3.04 1.02 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.095 0 N-CA-C 115.53 1.678 . . . . 63.299999999999997 115.53 -173.988 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 70.4 t -78.14 110.49 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 O-C-N 119.261 -2.149 . . . . 73.109999999999999 109.315 -168.359 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.7 p -79.82 -85.98 0.08 Allowed 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.611 1.165 . . . . 54.299999999999997 110.823 177.651 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.4 t . . . . . 0 CA--C 1.537 0.474 0 N-CA-C 107.053 -1.462 . . . . 72.430000000000007 107.053 -176.412 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . 0.299 44.0 m-20 . . . . . 0 CA--C 1.536 0.414 0 CA-C-O 118.004 -0.998 . . . . 55.039999999999999 112.277 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.4 t -48.96 -61.61 0.54 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 C-N-CA 125.628 1.571 . . . . 75.510000000000005 111.13 177.805 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.445 ' CE2' HD12 ' A' ' 85' ' ' ILE . 17.7 t80 -71.08 -42.35 69.48 Favored 'General case' 0 CA--C 1.527 0.061 0 C-N-CA 123.611 0.764 . . . . 64.230000000000004 110.647 177.248 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -51.84 -50.25 61.26 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.365 1.066 . . . . 63.210000000000001 110.334 -173.115 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -67.95 -37.8 82.02 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 118.874 -0.584 . . . . 64.519999999999996 110.672 -175.404 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.511 HD22 HD22 ' A' ' 76' ' ' LEU . 0.7 OUTLIER -64.89 -52.46 56.4 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-N 119.062 0.846 . . . . 55.299999999999997 110.276 174.853 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.24 -21.06 65.99 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.629 1.104 . . . . 54.229999999999997 112.365 -177.237 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.99 -63.7 1.01 Allowed 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.892 0.877 . . . . 75.230000000000004 110.606 166.412 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.61 -21.71 66.6 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.859 0.863 . . . . 71.409999999999997 112.698 -174.049 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.897 HD23 ' HB2' ' A' ' 80' ' ' ALA . 10.3 tp -113.1 19.29 17.3 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.918 2.487 . . . . 74.549999999999997 110.79 -171.966 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -51.23 110.24 0.42 Allowed 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.586 1.954 . . . . 62.210000000000001 108.821 171.082 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 94.62 0.14 64.85 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 125.187 1.375 . . . . 62.350000000000001 114.319 178.698 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.6 7.45 5.28 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.956 1.702 . . . . 64.150000000000006 111.5 178.803 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.897 ' HB2' HD23 ' A' ' 76' ' ' LEU . . . -135.21 176.98 8.17 Favored 'General case' 0 C--O 1.233 0.234 0 O-C-N 120.87 -1.144 . . . . 52.409999999999997 111.116 177.072 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -138.24 168.62 19.36 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 114.168 -1.378 . . . . 73.420000000000002 107.659 158.733 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 87.5 mt-10 -66.09 -19.19 65.77 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 112.195 -2.275 . . . . 72.400000000000006 111.442 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -110.15 -8.93 14.72 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.022 0.828 . . . . 75.109999999999999 111.403 177.741 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.1 m -84.2 -41.36 17.06 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.641 -0.662 . . . . 72.239999999999995 110.678 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.445 HD12 ' CE2' ' A' ' 69' ' ' PHE . 79.5 mt -60.2 -44.63 95.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-N 119.727 1.149 . . . . 55.210000000000001 109.504 -179.018 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -58.71 -24.94 62.36 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 118.34 0.518 . . . . 62.420000000000002 112.218 178.208 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -94.12 -5.52 47.05 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 118.548 -0.739 . . . . 34.119999999999997 111.943 -178.721 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -93.23 -64.52 1.08 Allowed 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 120.046 1.293 . . . . 64.200000000000003 110.154 173.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 2.0 mtm -64.71 -29.09 70.07 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 119.597 -0.841 . . . . 75.540000000000006 111.62 -161.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 27.4 t -63.51 -47.53 91.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 125.106 1.362 . . . . 52.100000000000001 110.795 176.818 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -59.65 -45.99 90.35 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 119.301 0.955 . . . . 54.420000000000002 111.23 -170.062 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.3 mt -72.38 -0.74 13.21 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 125.126 1.37 . . . . 63.219999999999999 110.704 -167.658 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 45.3 ttt180 -51.17 -38.6 53.1 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 124.254 1.022 . . . . 74.329999999999998 110.764 164.797 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.01 -53.31 40.25 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.974 0.807 . . . . 43.219999999999999 110.711 176.165 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.0 m -54.7 -31.27 57.74 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.027 1.731 . . . . 52.219999999999999 111.283 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.7 -53.37 59.12 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.431 1.092 . . . . 74.299999999999997 112.313 -178.783 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.609 ' HA ' ' HB1' ' A' ' 25' ' ' ALA . 14.6 ptm180 -70.43 -37.55 74.41 Favored 'General case' 0 CA--C 1.519 -0.229 0 C-N-CA 120.053 -0.659 . . . . 64.329999999999998 110.991 179.232 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -59.0 -46.29 88.55 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-O 118.072 -0.966 . . . . 63.109999999999999 111.488 -174.943 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -59.62 -31.98 69.99 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 119.029 0.831 . . . . 62.030000000000001 112.791 -174.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.496 HD12 ' HE2' ' A' ' 24' ' ' LYS . 27.2 mm -73.39 -38.2 52.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 O-C-N 121.224 -0.922 . . . . 73.329999999999998 110.374 177.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 82.3 mt -74.76 -13.63 15.54 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 C-N-CA 124.187 0.995 . . . . 74.099999999999994 109.191 177.325 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 16.1 t -85.62 -40.82 15.81 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.213 1.405 . . . . 40.310000000000002 108.154 174.628 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -128.71 65.61 1.42 Allowed 'General case' 0 C--O 1.239 0.541 0 C-N-CA 124.745 1.218 . . . . 71.200000000000003 107.781 -169.444 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.414 HD12 ' H ' ' A' ' 104' ' ' ILE . 5.1 mp . . . . . 0 C--O 1.253 1.286 0 N-CA-C 107.403 -1.332 . . . . 72.030000000000001 107.403 176.499 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.539 0.533 0 N-CA-C 114.39 1.256 . . . . 65.409999999999997 114.39 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -50.94 98.38 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 127.232 2.213 . . . . 72.510000000000005 110.676 179.469 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 53.05 11.85 0.25 Allowed 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 115.846 1.795 . . . . 54.200000000000003 115.846 -171.702 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 54.3 mttt -84.71 -4.04 58.84 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 124.691 1.197 . . . . 65.519999999999996 113.192 177.153 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -55.18 -30.36 59.74 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 120.927 1.694 . . . . 73.209999999999994 112.445 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -77.76 5.51 9.28 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.749 1.018 . . . . 70.5 113.749 179.478 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 10.2 t-80 -143.47 176.61 9.05 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.607 1.563 . . . . 64.219999999999999 109.472 -176.353 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 62.76 -171.8 0.16 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.87 1.668 . . . . 73.239999999999995 111.992 165.828 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -118.3 -35.82 3.71 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 124.713 1.205 . . . . 72.099999999999994 110.001 171.943 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.3 mp0 -45.08 -50.25 11.12 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 127.409 2.284 . . . . 74.439999999999998 112.327 -172.612 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.78 ' H ' HD22 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -75.23 -44.18 47.63 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 124.255 1.022 . . . . 74.420000000000002 111.568 -176.882 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -57.51 -44.97 85.44 Favored 'General case' 0 C--O 1.219 -0.527 0 C-N-CA 125.017 1.327 . . . . 73.209999999999994 109.988 178.227 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.72 -48.22 66.81 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.006 1.322 . . . . 73.239999999999995 110.249 -177.868 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 42.3 mttp -61.48 -57.65 11.32 Favored 'General case' 0 C--O 1.232 0.175 0 O-C-N 121.584 -0.697 . . . . 50.420000000000002 110.352 171.839 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -71.98 -16.16 62.07 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 114.248 1.203 . . . . 65.030000000000001 114.248 -165.701 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -62.48 -50.82 69.92 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 127.561 2.344 . . . . 74.030000000000001 108.783 167.027 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.57 16.95 17.4 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 114.333 1.234 . . . . 54.399999999999999 114.333 -145.393 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -109.86 -6.97 15.07 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 116.301 1.963 . . . . 71.200000000000003 116.301 -154.758 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.9 ptt180 -62.64 -16.62 57.71 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 121.375 1.898 . . . . 65.120000000000005 115.319 -170.679 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -116.95 -13.4 10.64 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 126.346 1.859 . . . . 70.109999999999999 112.636 173.248 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.1 -8.32 11.64 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 121.575 1.989 . . . . 70.430000000000007 113.625 -175.583 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.468 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.4 pt? -104.68 -3.2 23.98 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 126.457 1.903 . . . . 63.219999999999999 114.697 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 35.6 tp -68.71 -35.3 76.99 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 123.759 0.824 . . . . 74.120000000000005 111.043 -176.219 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -57.09 -42.87 93.36 Favored Glycine 0 C--O 1.221 -0.715 0 CA-C-O 118.78 -1.011 . . . . 53.219999999999999 110.72 166.662 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -64.77 -16.74 63.42 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 118.924 1.362 . . . . 74.329999999999998 112.369 -176.041 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 14.2 t90 -80.64 -63.7 1.35 Allowed 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.955 0.902 . . . . 74.040000000000006 109.137 164.556 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.7 -29.67 27.94 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.577 1.551 . . . . 54.219999999999999 114.189 -174.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.02 -61.51 2.22 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 125.927 1.691 . . . . 65.200000000000003 111.385 -177.459 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.85 -15.53 58.09 Favored Glycine 0 CA--C 1.531 1.082 0 CA-C-N 118.709 0.686 . . . . 71.040000000000006 113.153 -177.604 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 19.8 mt -76.69 -43.91 35.81 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.789 1.236 . . . . 72.200000000000003 109.215 173.792 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.451 HD23 ' HE3' ' A' ' 79' ' ' LYS . 24.2 mt -71.33 1.66 5.89 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.955 2.102 . . . . 64.340000000000003 112.001 165.824 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.05 0.5 44.02 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.763 1.649 . . . . 61.200000000000003 114.278 -177.738 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -65.51 127.52 32.17 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 125.386 1.474 . . . . 72.340000000000003 107.431 173.879 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.6 p -140.69 147.52 39.38 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.408 -0.59 . . . . 73.040000000000006 109.408 -179.461 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 82.27 -129.89 9.35 Favored Glycine 0 C--N 1.33 0.23 0 N-CA-C 111.17 -0.772 . . . . 74.319999999999993 111.17 172.414 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -70.04 -28.31 65.36 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.353 -0.61 . . . . 71.040000000000006 109.353 179.305 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -62.49 -41.29 98.7 Favored 'General case' 0 CA--C 1.514 -0.424 0 C-N-CA 125.181 1.392 . . . . 71.230000000000004 111.131 177.414 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.85 -57.26 7.35 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 107.385 -1.339 . . . . 54.140000000000001 107.385 172.693 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.07 -51.85 29.06 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 118.62 0.645 . . . . 74.200000000000003 112.116 -175.449 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.47 -38.65 90.64 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.009 1.323 . . . . 74.420000000000002 111.799 -179.177 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -62.73 -44.1 97.08 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.923 0.889 . . . . 71.239999999999995 110.289 174.392 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.4 -27.11 68.78 Favored 'General case' 0 CA--C 1.53 0.182 0 O-C-N 121.299 -0.875 . . . . 71.329999999999998 112.992 -176.476 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 9.2 mt -60.28 -49.02 79.27 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 119.031 0.832 . . . . 71.319999999999993 108.861 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.5 t -76.25 6.19 5.85 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 125.155 1.382 . . . . 74.329999999999998 112.04 179.242 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 98.6 t -119.48 94.04 2.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 C-N-CA 125.355 1.462 . . . . 63.020000000000003 108.41 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.5 p -140.93 157.46 22.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 106.533 -1.654 . . . . 73.010000000000005 106.533 155.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 13.4 t -171.49 -170.77 0.84 Allowed 'General case' 0 C--O 1.239 0.547 0 C-N-CA 126.233 1.813 . . . . 51.43 106.562 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 49.1 m . . . . . 0 CA--C 1.536 0.42 0 C-N-CA 125.224 1.41 . . . . 73.0 110.07 -177.674 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 41.0 t0 . . . . . 0 CA--C 1.537 0.471 0 N-CA-C 113.749 1.018 . . . . 45.43 113.749 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 67.5 t -106.33 -41.57 6.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 O-C-N 120.331 -1.481 . . . . 73.400000000000006 109.684 168.266 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -49.6 -37.59 28.36 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.282 1.033 . . . . 74.120000000000005 111.438 176.518 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.0 -28.25 16.3 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.647 1.579 . . . . 72.140000000000001 113.932 175.329 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -86.25 -41.6 14.48 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 108.529 -0.915 . . . . 62.039999999999999 108.529 -176.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.21 -52.82 11.26 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.407 0.683 . . . . 74.340000000000003 110.728 -178.722 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.34 -21.92 66.75 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 125.17 1.388 . . . . 74.010000000000005 111.356 -175.362 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.25 -41.84 96.77 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 118.461 0.573 . . . . 73.219999999999999 111.001 169.254 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.02 -53.33 15.15 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 107.954 -1.128 . . . . 70.239999999999995 107.954 177.899 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.522 ' HA ' ' HE2' ' A' ' 79' ' ' LYS . 65.5 mt -83.91 33.12 0.48 Allowed 'General case' 0 C--O 1.233 0.218 0 C-N-CA 125.551 1.54 . . . . 74.319999999999993 111.794 -179.393 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -67.64 121.06 15.08 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 106.429 -1.693 . . . . 74.329999999999998 106.429 175.504 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 85.44 -0.27 88.4 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 124.977 1.275 . . . . 74.120000000000005 113.756 -173.796 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.522 ' HE2' ' HA ' ' A' ' 76' ' ' LEU . 36.3 mtmm -135.6 -5.28 2.25 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 118.744 1.272 . . . . 72.019999999999996 113.224 -161.944 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -164.07 122.4 1.85 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-N 119.99 1.268 . . . . 41.130000000000003 110.531 179.024 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.85 161.27 29.13 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.334 1.054 . . . . 64.0 108.896 175.196 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -49.08 -52.66 24.41 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 126.01 1.724 . . . . 73.329999999999998 108.664 165.382 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -66.78 -8.39 28.05 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.177 1.391 . . . . 72.120000000000005 112.225 -171.544 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 17.9 m -111.88 -44.18 3.5 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 126.512 1.925 . . . . 73.439999999999998 110.319 -179.77 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 74.5 mt -52.46 -56.46 6.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-N 119.654 1.115 . . . . 44.140000000000001 108.276 172.785 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -56.5 -29.95 62.43 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 123.515 0.726 . . . . 74.310000000000002 112.015 -175.125 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -84.16 -50.18 8.16 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 124.435 1.094 . . . . 65.239999999999995 109.242 -174.334 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.8 tppt? -60.17 -36.36 77.4 Favored 'General case' 0 N--CA 1.463 0.19 0 O-C-N 121.749 -0.594 . . . . 72.329999999999998 111.313 -173.66 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 28.7 mtt -54.26 -52.81 60.2 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.864 0.466 . . . . 63.130000000000003 109.775 173.968 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 79.3 t -61.78 -30.65 48.88 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 125.376 1.47 . . . . 70.099999999999994 110.854 -177.487 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 62.1 tt0 -69.5 -52.4 26.87 Favored 'General case' 0 CA--C 1.53 0.186 0 O-C-N 121.062 -1.024 . . . . 71.129999999999995 110.274 174.083 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 38.9 mt -67.52 -24.86 65.61 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.309 1.044 . . . . 73.420000000000002 110.44 -176.284 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 42.0 ttp180 -56.93 -33.39 66.93 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 124.955 1.302 . . . . 54.100000000000001 110.605 174.336 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -68.26 -47.88 66.53 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 118.533 -0.746 . . . . 63.130000000000003 111.11 177.128 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 31.0 m -56.0 -81.87 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 126.582 1.953 . . . . 71.310000000000002 110.098 -178.305 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 43.55 -75.03 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.306 1 C-N-CA 132.874 4.47 . . . . 72.310000000000002 113.983 165.982 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 20.0 ptt-85 -66.6 -40.24 88.77 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.235 -0.893 . . . . 74.230000000000004 109.727 -177.773 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -59.78 -36.16 76.13 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-O 117.973 -1.013 . . . . 71.140000000000001 110.589 -177.538 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -57.98 -42.18 84.56 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 118.981 0.81 . . . . 65.030000000000001 111.291 -177.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 24.1 mm -56.81 -45.49 83.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-N 119.775 1.171 . . . . 65.400000000000006 109.6 176.556 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 27.8 mt -74.15 -17.53 16.99 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 C-N-CA 124.379 1.072 . . . . 74.530000000000001 110.075 -177.841 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 21.0 t -87.38 -0.9 57.46 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.142 1.777 . . . . 74.120000000000005 110.578 172.572 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 78.8 mt-10 -132.12 42.61 3.12 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 126.325 1.85 . . . . 74.329999999999998 107.536 -166.143 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.0 mt . . . . . 0 C--O 1.251 1.18 0 N-CA-C 105.328 -2.101 . . . . 74.430000000000007 105.328 169.647 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.533 0.289 0 N-CA-C 112.809 0.67 . . . . 73.099999999999994 112.809 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . 0.285 5.1 pt-20 44.65 -84.98 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 128.998 2.919 . . . . 73.310000000000002 114.318 -178.91 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.91 -22.1 64.02 Favored 'General case' 0 N--CA 1.462 0.163 0 O-C-N 121.243 -0.911 . . . . 74.329999999999998 113.214 176.263 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.529 ' HB3' HD13 ' A' ' 21' ' ' LEU . 3.4 mptt -64.96 -19.52 66.0 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-O 117.034 -1.46 . . . . 75.129999999999995 113.798 171.796 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -54.29 -39.83 67.3 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 121.699 2.045 . . . . 62.43 112.278 -177.662 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.65 -11.47 45.1 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.451 1.1 . . . . 54.039999999999999 113.467 177.86 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 -104.24 164.05 11.99 Favored 'General case' 0 N--CA 1.445 -0.705 0 C-N-CA 126.732 2.013 . . . . 74.420000000000002 108.422 177.31 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 51.34 -154.93 0.15 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.402 1.081 . . . . 74.129999999999995 108.571 -176.02 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -133.99 -19.83 1.99 Allowed 'General case' 0 C--O 1.222 -0.363 0 C-N-CA 125.038 1.335 . . . . 71.129999999999995 109.086 148.522 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -44.21 -43.37 7.15 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 127.437 2.295 . . . . 54.229999999999997 111.959 177.74 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.529 HD13 ' HB3' ' A' ' 14' ' ' LYS . 11.9 mt -67.83 -44.15 77.91 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 125.649 1.58 . . . . 61.140000000000001 111.56 -176.442 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -83.88 -20.72 32.58 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 123.6 0.76 . . . . 74.420000000000002 111.813 -178.248 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.29 -55.13 19.9 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 124.257 1.023 . . . . 61.530000000000001 109.081 -169.606 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.7 pttp -45.01 -53.44 7.75 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 124.793 1.237 . . . . 72.420000000000002 113.36 176.369 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.592 ' HB1' ' HA ' ' A' ' 97' ' ' ARG . . . -52.83 -57.1 11.31 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.11 0.964 . . . . 72.519999999999996 110.335 -179.615 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -78.16 13.42 1.48 Allowed 'General case' 0 C--O 1.242 0.684 0 C-N-CA 124.568 1.147 . . . . 74.420000000000002 112.76 -176.318 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.1 3.21 2.63 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 124.823 1.249 . . . . 75.400000000000006 112.656 -173.351 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.94 7.48 13.22 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.655 1.116 . . . . 74.230000000000004 113.994 -173.185 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 20.3 ptt-85 -60.19 -33.69 72.57 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 121.025 1.738 . . . . 72.230000000000004 109.874 177.289 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.448 ' HB3' HG13 ' A' ' 56' ' ' VAL . 0.4 OUTLIER -70.63 -12.5 61.6 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 120.547 -1.346 . . . . 72.120000000000005 112.606 -179.762 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -81.71 -50.7 8.98 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 120.41 1.459 . . . . 64.219999999999999 109.516 -175.726 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.29 -13.37 62.35 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 115.633 -0.712 . . . . 75.439999999999998 112.452 -179.693 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 17.0 mt -58.36 -32.18 68.31 Favored 'General case' 0 N--CA 1.468 0.448 0 O-C-N 120.645 -1.284 . . . . 63.240000000000002 111.457 171.499 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -72.98 -6.56 68.22 Favored Glycine 0 CA--C 1.528 0.882 0 O-C-N 121.25 -0.906 . . . . 52.350000000000001 112.28 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -83.09 -20.52 34.72 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 120.94 -1.329 . . . . 73.340000000000003 111.822 171.372 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 36.7 t90 -74.68 -82.06 0.07 Allowed 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.336 1.054 . . . . 74.329999999999998 108.668 179.511 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.68 -17.25 21.0 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.211 1.404 . . . . 51.450000000000003 113.791 -171.455 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -51.66 -55.44 19.42 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.174 0.59 . . . . 71.340000000000003 110.363 172.879 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -62.26 -41.98 99.72 Favored Glycine 0 CA--C 1.527 0.814 0 N-CA-C 111.276 -0.73 . . . . 31.530000000000001 111.276 -175.74 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.0 mp -56.56 -34.11 66.8 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.57 1.548 . . . . 72.439999999999998 111.695 176.751 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 71.8 mt -94.54 4.37 53.94 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.766 2.027 . . . . 62.439999999999998 112.456 176.134 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 76.41 42.58 22.39 Favored Glycine 0 CA--C 1.527 0.833 0 O-C-N 120.849 -1.157 . . . . 52.439999999999998 113.109 176.314 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 30.5 mttm -127.34 132.66 50.18 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 126.358 1.863 . . . . 74.530000000000001 108.038 176.477 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 45.3 p -134.45 -179.1 5.37 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 124.797 1.239 . . . . 71.430000000000007 108.094 164.85 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 46.49 -123.08 6.92 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 125.398 1.475 . . . . 73.519999999999996 113.318 173.164 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -63.49 -31.42 72.58 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 117.405 0.602 . . . . 72.239999999999995 112.372 -174.394 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -77.07 -40.26 46.79 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.677 0.751 . . . . 64.409999999999997 110.846 -177.935 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.12 -33.3 74.2 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.846 -0.616 . . . . 74.510000000000005 110.272 168.367 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 7.0 ttm-85 -58.24 -55.95 28.4 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.417 -0.957 . . . . 75.450000000000003 108.417 173.881 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.68 -43.01 80.05 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.852 1.261 . . . . 74.310000000000002 111.103 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -60.67 -41.92 96.05 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.347 1.059 . . . . 54.420000000000002 111.344 175.538 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.97 -0.49 18.92 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 120.476 -1.39 . . . . 72.540000000000006 113.345 -178.547 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.4 mt -79.42 5.31 13.02 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 120.782 1.628 . . . . 74.409999999999997 112.331 177.803 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.31 -22.46 1.75 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.534 1.133 . . . . 64.319999999999993 112.466 -174.757 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 35.6 m -64.43 -12.08 11.66 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 N-CA-C 115.526 1.676 . . . . 74.439999999999998 115.526 -171.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.448 HG13 ' HB3' ' A' ' 30' ' ' ASN . 9.9 t -88.23 115.85 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 N-CA-C 107.935 -1.135 . . . . 72.209999999999994 107.935 -170.678 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.2 t -139.8 -53.69 0.54 Allowed 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 126.304 1.841 . . . . 73.25 106.359 -178.21 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.7 t . . . . . 0 CA--C 1.531 0.221 0 C-N-CA 125.264 1.426 . . . . 74.109999999999999 110.432 176.864 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 . . . . . 0 C--O 1.224 -0.258 0 CA-C-O 119.033 -0.508 . . . . 75.140000000000001 111.298 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.439 ' HA ' ' HE3' ' A' ' 71' ' ' LYS . 57.3 t -63.16 -36.74 77.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-N 119.255 0.934 . . . . 54.009999999999998 110.305 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -89.74 -19.1 25.17 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 123.797 0.839 . . . . 40.229999999999997 110.189 -179.181 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.5 -36.17 79.74 Favored 'General case' 0 CA--C 1.522 -0.133 0 N-CA-C 115.154 1.539 . . . . 74.540000000000006 115.154 -167.869 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.686 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -68.74 -53.44 21.93 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 106.635 -1.617 . . . . 61.240000000000002 106.635 -175.508 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -47.6 -61.39 1.96 Allowed 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 126.102 1.761 . . . . 71.150000000000006 109.064 172.881 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.89 -42.98 76.77 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 124.154 0.909 . . . . 35.210000000000001 111.405 -171.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -75.53 -35.64 60.68 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.776 1.028 . . . . 75.209999999999994 113.776 -179.531 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -73.75 -44.07 57.28 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 120.904 -1.123 . . . . 63.520000000000003 109.419 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 12.6 tp -86.04 13.76 7.21 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 128.332 2.653 . . . . 71.549999999999997 110.681 -179.28 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -55.73 123.08 12.94 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 125.407 1.483 . . . . 74.25 108.43 -178.304 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 98.75 -11.43 62.72 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 124.787 1.184 . . . . 63.549999999999997 113.728 -174.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.5 mtmm -128.71 6.6 5.62 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 119.058 1.429 . . . . 74.140000000000001 112.534 -171.387 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -146.92 174.32 11.61 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.997 0.919 . . . . 64.120000000000005 109.735 170.733 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -130.35 156.8 44.1 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 125.329 1.452 . . . . 73.310000000000002 107.595 -178.842 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 68.3 mm-40 -66.26 -20.76 66.2 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 125.207 1.403 . . . . 74.140000000000001 112.425 -177.524 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 21.8 pt-20 -94.78 -22.77 17.86 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 120.929 -1.107 . . . . 54.210000000000001 112.371 170.808 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.5 m -79.38 -40.71 29.45 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.028 0.931 . . . . 63.210000000000001 110.583 -172.651 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 77.6 mt -56.65 -57.34 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 CA-C-N 119.524 1.056 . . . . 75.340000000000003 108.507 -177.81 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.87 -41.11 90.81 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-N 118.15 0.432 . . . . 73.540000000000006 112.123 -179.646 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.51 -44.78 85.31 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 122.967 0.507 . . . . 71.430000000000007 110.385 -179.237 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.73 -26.17 61.43 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.861 0.864 . . . . 75.510000000000005 112.465 -179.482 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 21.9 mtt -73.1 -41.2 64.3 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 119.014 0.825 . . . . 64.099999999999994 110.803 177.607 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 11.9 t -73.11 -31.19 33.99 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.137 0.975 . . . . 63.310000000000002 110.129 178.883 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -48.61 -57.71 5.8 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 126.074 1.75 . . . . 61.520000000000003 111.769 -174.858 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.93 25.3 0.12 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.767 1.627 . . . . 61.109999999999999 114.138 -179.41 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 3.4 mtt-85 -50.54 -48.28 57.35 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 125.61 1.564 . . . . 74.299999999999997 113.539 -177.408 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.17 -38.88 21.75 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 123.924 0.89 . . . . 63.299999999999997 109.939 177.374 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.8 m -50.8 -39.09 51.98 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.561 1.544 . . . . 75.310000000000002 110.817 -179.122 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.3 -38.63 77.43 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.14 -0.975 . . . . 73.540000000000006 113.591 178.352 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ARG . . . . . 0.592 ' HA ' ' HB1' ' A' ' 25' ' ' ALA . 5.0 ptm180 -86.24 -27.02 24.71 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.313 0.96 . . . . 53.100000000000001 112.156 175.782 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -66.84 -48.91 67.42 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.99 0.916 . . . . 75.530000000000001 111.78 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -59.59 -29.25 67.83 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 118.297 0.498 . . . . 64.239999999999995 111.918 -169.69 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 42.3 mm -67.39 -32.42 57.22 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 124.488 1.115 . . . . 74.5 112.351 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 51.3 mt -88.95 -21.85 6.76 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 N-CA-C 108.529 -0.915 . . . . 75.420000000000002 108.529 176.294 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 4.3 t -71.34 -37.31 71.71 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.973 -0.454 . . . . 62.140000000000001 109.804 172.949 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -135.53 76.04 1.59 Allowed 'General case' 0 C--O 1.236 0.367 0 C-N-CA 127.012 2.125 . . . . 74.439999999999998 105.549 -165.815 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 9.1 mt . . . . . 0 C--O 1.247 0.951 0 C-N-CA 127.602 2.361 . . . . 74.510000000000005 107.896 -177.416 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 1.9 p80 . . . . . 0 CA--C 1.539 0.539 0 CA-C-O 119.795 -0.145 . . . . 75.540000000000006 110.719 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -67.72 108.4 2.92 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 107.972 -1.121 . . . . 75.439999999999998 107.972 -174.637 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.15 14.33 5.41 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.242 1.417 . . . . 51.140000000000001 114.101 -179.284 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 13.3 mttt -85.15 -3.81 58.94 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.132 1.773 . . . . 72.519999999999996 113.44 176.478 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.435 ' CE1' HG21 ' A' ' 100' ' ' ILE . 0.1 OUTLIER -68.46 -32.65 72.82 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 120.732 -1.23 . . . . 53.439999999999998 110.321 -165.955 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -79.91 14.24 1.87 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.043 1.737 . . . . 71.519999999999996 113.309 171.223 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -127.47 -21.41 3.83 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.983 1.265 . . . . 71.299999999999997 114.123 -164.867 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -152.58 168.13 26.58 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.745 1.157 . . . . 74.540000000000006 110.361 176.826 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -69.88 -46.0 66.43 Favored 'General case' 0 C--O 1.224 -0.281 0 O-C-N 121.608 -0.682 . . . . 73.129999999999995 111.295 171.169 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -45.61 -54.55 7.52 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.349 1.46 . . . . 64.120000000000005 112.119 -166.91 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.83 ' H ' HD22 ' A' ' 21' ' ' LEU . 0.1 OUTLIER -63.77 -39.48 94.37 Favored 'General case' 0 N--CA 1.436 -1.134 0 O-C-N 120.869 -1.144 . . . . 74.540000000000006 111.441 -175.542 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -61.65 -42.94 99.6 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.859 0.863 . . . . 73.200000000000003 110.872 174.655 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -55.24 -39.76 70.11 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.705 0.802 . . . . 64.200000000000003 109.95 172.919 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.07 -40.21 73.22 Favored 'General case' 0 C--N 1.342 0.247 0 O-C-N 120.625 -1.297 . . . . 73.109999999999999 112.351 173.351 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.26 -47.76 72.66 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 119.465 1.029 . . . . 72.120000000000005 111.716 174.714 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -58.23 -30.4 66.48 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 121.41 0.624 . . . . 75.5 110.578 177.703 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -99.09 25.2 6.98 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 126.677 1.991 . . . . 73.430000000000007 110.856 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.666 ' HG3' HD11 ' A' ' 100' ' ' ILE . 6.9 mmt-85 -114.4 -6.75 12.91 Favored 'General case' 0 N--CA 1.463 0.223 0 O-C-N 120.852 -1.155 . . . . 75.310000000000002 111.303 165.014 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 30.9 ptt-85 -60.6 -29.92 69.5 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 119.632 1.105 . . . . 75.340000000000003 112.197 -176.646 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.547 ' HA ' HD12 ' A' ' 33' ' ' LEU . 16.4 m120 -94.92 -13.32 25.51 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 123.864 0.865 . . . . 72.120000000000005 112.401 177.927 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.407 ' HD2' HD12 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -57.66 -59.84 4.58 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 120.451 1.478 . . . . 74.530000000000001 110.032 178.889 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.407 HD12 ' HD2' ' A' ' 31' ' ' ARG . 3.5 mp -69.26 -25.53 64.32 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.51 -0.768 . . . . 74.450000000000003 109.91 -166.779 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.547 HD12 ' HA ' ' A' ' 30' ' ' ASN . 60.6 mt -51.96 -33.13 36.37 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.176 0.99 . . . . 71.140000000000001 112.69 173.875 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -75.24 -36.12 46.36 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 110.124 -1.191 . . . . 72.310000000000002 110.124 -179.113 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -69.17 -23.2 63.91 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.468 1.507 . . . . 64.420000000000002 111.486 -179.29 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 19.0 t90 -67.79 -78.52 0.06 Allowed 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.406 1.082 . . . . 61.049999999999997 108.477 166.276 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.5 -26.06 53.23 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 124.481 1.113 . . . . 61.020000000000003 113.242 -168.742 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -45.84 -54.22 8.46 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.309 0.958 . . . . 51.509999999999998 111.186 170.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.82 -44.12 97.33 Favored Glycine 0 CA--C 1.53 0.97 0 N-CA-C 111.558 -0.617 . . . . 54.109999999999999 111.558 -176.603 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.5 mp -58.47 -51.64 69.0 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 126.695 1.998 . . . . 73.329999999999998 110.61 176.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.4 mp -54.93 -42.19 71.97 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.678 1.191 . . . . 75.319999999999993 111.304 174.417 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 112.21 24.83 4.96 Favored Glycine 0 CA--C 1.519 0.307 0 C-N-CA 124.519 1.057 . . . . 64.109999999999999 112.225 -175.492 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 33.0 mttm -97.31 137.89 35.62 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 126.89 2.076 . . . . 75.450000000000003 107.249 172.534 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 36.4 p -139.42 167.91 21.03 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 123.806 0.842 . . . . 63.020000000000003 109.011 -178.324 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 54.04 -130.72 44.23 Favored Glycine 0 CA--C 1.521 0.469 0 C-N-CA 124.747 1.165 . . . . 35.119999999999997 110.81 173.452 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -71.39 -22.3 61.89 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 118.335 -0.84 . . . . 74.129999999999995 112.878 -179.605 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -64.16 -47.05 81.36 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.99 1.268 . . . . 74.409999999999997 110.599 175.21 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.54 -46.61 88.37 Favored 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 125.052 1.341 . . . . 52.340000000000003 109.76 173.737 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 6.3 ttm-85 -57.22 -50.5 72.68 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.624 0.77 . . . . 73.109999999999999 111.008 177.344 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.44 -29.51 70.19 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 126.535 1.934 . . . . 75.430000000000007 111.807 -178.616 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 82.5 t80 -73.31 -40.97 64.09 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.105 0.962 . . . . 73.209999999999994 109.516 171.851 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.16 7.18 0.61 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.55 1.14 . . . . 74.439999999999998 113.536 177.679 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 42.2 mt -88.28 -15.36 36.0 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.183 0.993 . . . . 72.219999999999999 111.863 172.796 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.9 t -125.01 3.65 8.0 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 119.211 0.914 . . . . 61.32 111.654 -169.303 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 5.9 p -62.7 -26.87 41.78 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 O-C-N 120.362 -1.461 . . . . 63.210000000000001 112.648 169.66 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 4.9 m -72.33 117.76 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.569 0 C-N-CA 127.017 2.127 . . . . 72.510000000000005 110.829 -173.482 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.45 HG23 ' H ' ' A' ' 58' ' ' SER . 0.7 OUTLIER -144.34 -85.69 0.13 Allowed 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 127.339 2.256 . . . . 72.430000000000007 107.106 175.217 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.45 ' H ' HG23 ' A' ' 57' ' ' THR . 10.0 m . . . . . 0 N--CA 1.452 -0.373 1 C-N-CA 131.726 4.01 . . . . 75.219999999999999 105.059 174.886 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 . . . . . 0 CA--C 1.542 0.635 0 N-CA-C 112.381 0.511 . . . . 54.25 112.381 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.402 HG13 ' H ' ' A' ' 69' ' ' PHE . 4.8 p -93.78 -61.76 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 C-N-CA 124.663 1.185 . . . . 73.450000000000003 109.14 175.717 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' PHE . . . . . 0.402 ' H ' HG13 ' A' ' 68' ' ' VAL . 0.3 OUTLIER -54.02 -30.82 49.09 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.435 1.494 . . . . 71.310000000000002 110.384 175.619 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.07 -32.87 16.72 Favored 'General case' 0 C--N 1.341 0.23 0 C-N-CA 126.57 1.948 . . . . 71.420000000000002 113.255 -171.765 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.8 mmtt -108.29 -32.97 7.25 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 118.327 -0.844 . . . . 54.25 110.946 175.088 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.36 -47.35 66.18 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.189 0.596 . . . . 64.420000000000002 110.7 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -57.01 -37.16 71.3 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 119.095 -0.478 . . . . 43.409999999999997 112.13 -178.536 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -80.23 -43.31 21.64 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.258 1.023 . . . . 74.140000000000001 111.532 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.15 -38.84 80.66 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 122.36 1.076 . . . . 72.439999999999998 109.194 178.319 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.534 HD23 ' HB2' ' A' ' 80' ' ' ALA . 9.2 tp -102.55 21.16 15.75 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 128.109 2.564 . . . . 61.119999999999997 111.071 -175.582 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 47.2 tt0 -52.48 114.95 1.54 Allowed 'General case' 0 C--O 1.233 0.234 0 C-N-CA 125.734 1.613 . . . . 63.130000000000003 109.919 -177.935 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.94 -3.66 81.03 Favored Glycine 0 CA--C 1.532 1.111 0 CA-C-O 118.432 -1.205 . . . . 71.340000000000003 113.112 175.099 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -118.59 3.74 11.73 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 126.701 2.001 . . . . 60.219999999999999 111.893 -172.92 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.534 ' HB2' HD23 ' A' ' 76' ' ' LEU . . . -142.68 173.18 11.77 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 126.765 2.026 . . . . 72.230000000000004 106.868 173.317 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -120.47 161.13 21.78 Favored 'General case' 0 C--O 1.24 0.554 0 N-CA-C 105.764 -1.939 . . . . 64.430000000000007 105.764 163.314 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -55.28 -53.65 53.45 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 123.589 0.756 . . . . 63.039999999999999 110.052 174.871 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -67.43 -19.25 65.35 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.41 -0.359 . . . . 75.209999999999994 110.655 -174.841 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 19.6 m -87.5 -39.7 14.94 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 124.788 1.235 . . . . 75.310000000000002 111.504 178.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 89.2 mt -56.79 -55.41 20.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-N 121.636 2.016 . . . . 75.439999999999998 108.377 171.451 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.65 -7.91 8.65 Favored 'General case' 0 N--CA 1.462 0.166 0 N-CA-C 112.553 0.575 . . . . 73.209999999999994 112.553 -179.107 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -122.5 42.26 3.21 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 125.567 1.547 . . . . 54.310000000000002 107.958 176.775 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -118.53 -41.27 2.83 Favored 'General case' 0 C--N 1.341 0.207 0 O-C-N 121.648 -0.658 . . . . 55.149999999999999 111.578 166.115 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -63.7 -44.51 93.45 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.28 0.632 . . . . 71.230000000000004 111.421 -175.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 42.2 t -67.76 -31.28 51.64 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 C-N-CA 125.332 1.453 . . . . 64.129999999999995 111.839 179.16 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.69 -60.36 3.78 Favored 'General case' 0 C--O 1.231 0.126 0 O-C-N 120.561 -1.337 . . . . 72.420000000000002 109.821 -169.266 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.88 16.9 1.68 Allowed 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 124.383 1.073 . . . . 75.530000000000001 112.103 -178.694 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 14.6 ttm180 -49.08 -44.78 42.29 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.451 1.101 . . . . 61.509999999999998 111.006 171.679 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.32 -58.62 7.52 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 118.713 -0.661 . . . . 31.219999999999999 109.961 175.095 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 5.8 m -52.57 -51.3 60.42 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.483 1.113 . . . . 74.5 110.538 -175.519 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -63.04 -23.68 67.56 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 113.682 0.994 . . . . 71.409999999999997 113.682 -176.778 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.2 -68.89 0.54 Allowed 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 106.064 -1.828 . . . . 71.530000000000001 106.064 165.679 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -44.97 -49.15 11.34 Favored 'General case' 0 CA--C 1.518 -0.278 0 C-N-CA 128.124 2.57 . . . . 71.519999999999996 113.197 -167.465 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -52.18 -35.72 49.71 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-O 117.919 -1.039 . . . . 75.530000000000001 112.27 -174.641 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.666 HD11 ' HG3' ' A' ' 28' ' ' ARG . 14.5 mm -57.94 -54.35 33.17 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 120.071 1.305 . . . . 75.519999999999996 111.056 -178.581 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 80.8 mt -62.63 -19.46 22.91 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 C-N-CA 123.67 0.788 . . . . 74.230000000000004 109.422 178.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.28 5.39 39.96 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 126.867 2.067 . . . . 52.240000000000002 113.153 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -121.26 11.82 10.87 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.94 1.696 . . . . 73.540000000000006 110.589 -175.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 35.2 mt . . . . . 0 C--O 1.248 1.007 0 C-N-CA 127.822 2.449 . . . . 71.219999999999999 110.733 -172.999 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 11' ' ' HIS . . . . . 0.456 ' HA ' HD13 ' A' ' 21' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.368 0 N-CA-C 115.069 1.507 . . . . 60.210000000000001 115.069 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -59.56 108.15 0.69 Allowed 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 127.666 2.386 . . . . 54.32 109.444 -173.489 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 55.8 -8.23 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 128.609 2.763 . . . . 64.430000000000007 115.806 -168.433 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 34.7 mttt -62.78 -23.29 67.15 Favored 'General case' 0 C--O 1.224 -0.254 0 C-N-CA 125.673 1.589 . . . . 73.150000000000006 113.137 -174.845 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -53.29 -29.36 32.92 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 119.651 1.114 . . . . 70.340000000000003 113.965 -176.01 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -97.83 2.62 49.53 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.715 0.806 . . . . 73.120000000000005 113.096 -178.612 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.4 m170 -125.45 -62.19 1.22 Allowed 'General case' 0 C--O 1.237 0.428 0 C-N-CA 125.929 1.692 . . . . 43.25 109.077 -170.815 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -85.93 112.14 20.89 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 106.793 -1.558 . . . . 74.010000000000005 106.793 174.443 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.53 -36.55 78.99 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-O 118.104 -0.951 . . . . 74.329999999999998 110.987 -175.115 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.494 ' H ' ' CD ' ' A' ' 20' ' ' GLU . 3.4 mp0 -54.5 -41.51 69.69 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.737 1.153 . . . . 65.129999999999995 111.368 -172.417 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.456 HD13 ' HA ' ' A' ' 11' ' ' HIS . 32.8 mt -64.01 -31.93 73.29 Favored 'General case' 0 C--O 1.233 0.234 0 O-C-N 121.599 -0.688 . . . . 72.349999999999994 111.989 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -84.83 -32.99 22.99 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 125.908 1.683 . . . . 74.040000000000006 110.861 176.422 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -55.14 -50.52 69.05 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 125.799 1.64 . . . . 70.040000000000006 109.183 -170.118 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.446 ' HE3' ' HA ' ' A' ' 21' ' ' LEU . 13.7 ptpt -52.05 -46.02 64.93 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.58 0.752 . . . . 74.439999999999998 111.992 175.247 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.21 -36.93 80.29 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 124.285 1.034 . . . . 43.509999999999998 111.016 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -71.49 -17.32 62.35 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.673 1.589 . . . . 64.129999999999995 111.201 176.267 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -123.97 25.58 7.89 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.573 1.949 . . . . 54.210000000000001 113.683 -169.923 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.321 0.0 OUTLIER -137.03 11.98 3.08 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 115.087 1.514 . . . . 74.010000000000005 115.087 177.421 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.8 ptt-85 -60.87 -18.71 57.77 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.955 1.465 . . . . 73.200000000000003 114.955 176.138 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -94.81 -24.02 17.24 Favored 'General case' 0 C--O 1.225 -0.217 0 CA-C-N 120.476 1.489 . . . . 72.140000000000001 110.671 172.157 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.39 -55.4 21.98 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 119.879 1.218 . . . . 73.209999999999994 111.132 -177.18 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -63.7 -20.7 65.93 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.07 -0.968 . . . . 72.120000000000005 113.307 -174.266 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.4 -38.33 90.65 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.37 1.468 . . . . 70.010000000000005 110.085 -176.975 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.48 -33.79 88.18 Favored Glycine 0 CA--C 1.527 0.82 0 CA-C-O 119.561 -0.577 . . . . 74.420000000000002 111.774 178.16 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -65.3 -38.33 89.87 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 117.866 0.833 . . . . 72.329999999999998 110.679 -177.259 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.482 ' CD1' ' HE2' ' A' ' 88' ' ' LYS . 28.8 t90 -60.51 -60.65 3.48 Favored 'General case' 0 C--O 1.228 -0.071 0 N-CA-C 108.291 -1.003 . . . . 74.030000000000001 108.291 177.366 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.05 -45.97 64.91 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 118.816 -0.611 . . . . 63.109999999999999 111.297 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -45.73 -57.5 4.21 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.209 1.004 . . . . 51.420000000000002 112.387 179.51 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.97 -32.08 80.84 Favored Glycine 0 CA--C 1.529 0.944 0 N-CA-C 112.069 -0.412 . . . . 75.299999999999997 112.069 -176.126 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 80.7 mt -71.07 -48.05 54.81 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 124.139 0.975 . . . . 74.409999999999997 110.66 178.212 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.6 mp -52.83 -31.66 40.23 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 124.859 1.263 . . . . 74.0 111.386 168.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 101.22 8.75 46.51 Favored Glycine 0 CA--C 1.526 0.781 0 C-N-CA 125.748 1.642 . . . . 55.240000000000002 112.394 -177.787 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.427 ' HE3' ' CD1' ' A' ' 51' ' ' TYR . 48.5 mttm -72.39 127.69 33.35 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 106.554 -1.647 . . . . 74.109999999999999 106.554 167.758 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 17.7 p -144.5 170.02 16.84 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.707 -0.849 . . . . 73.140000000000001 108.707 177.299 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.53 -131.84 15.19 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 109.205 -1.558 . . . . 73.049999999999997 109.205 -177.486 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -76.47 -30.8 57.45 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 118.843 -0.598 . . . . 64.120000000000005 111.003 177.347 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -57.6 -41.31 80.98 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 119.576 1.08 . . . . 72.329999999999998 111.585 -176.597 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.1 -46.52 90.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.645 -1.161 . . . . 64.310000000000002 111.387 174.405 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.8 ttt85 -57.48 -55.09 39.3 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 124.904 1.282 . . . . 71.409999999999997 109.165 178.558 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.65 -43.7 97.28 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 126.653 1.981 . . . . 52.43 111.376 -178.607 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.427 ' CD1' ' HE3' ' A' ' 43' ' ' LYS . 43.5 t80 -61.71 -44.39 97.02 Favored 'General case' 0 C--N 1.333 -0.13 0 O-C-N 121.709 -0.619 . . . . 74.409999999999997 109.995 174.908 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.53 -25.27 62.28 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 121.243 -0.91 . . . . 43.399999999999999 112.766 -175.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 37.7 mt -64.47 -21.04 66.54 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.766 1.227 . . . . 73.230000000000004 114.045 -173.441 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.9 t -100.71 -5.85 25.9 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.305 0.957 . . . . 74.299999999999997 111.009 -173.765 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 6.3 t -93.45 82.87 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 O-C-N 120.403 -1.436 . . . . 74.200000000000003 109.535 -164.112 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 3.7 m -132.93 87.8 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.96 0 C-N-CA 127.57 2.348 . . . . 64.5 110.156 -177.173 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.0 t -155.57 133.01 11.01 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 106.022 -1.844 . . . . 70.310000000000002 106.022 -169.369 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.2 t . . . . . 0 C--O 1.232 0.138 0 CA-C-N 120.327 1.421 . . . . 41.140000000000001 108.473 -172.743 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.0 t0 . . . . . 0 C--O 1.236 0.343 0 N-CA-C 113.01 0.744 . . . . 62.299999999999997 113.01 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.0 t -71.2 -62.33 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.219 0 C-N-CA 124.064 0.945 . . . . 70.319999999999993 108.662 177.003 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -60.12 -32.92 71.46 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-O 118.695 -0.669 . . . . 73.219999999999999 110.808 -165.936 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 25.7 ttp180 -48.42 -58.14 5.07 Favored 'General case' 0 CA--C 1.517 -0.311 0 C-N-CA 123.489 0.716 . . . . 74.230000000000004 110.955 172.254 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.5 mmtp -74.1 -43.6 57.02 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.884 -0.413 . . . . 62.299999999999997 109.884 -177.327 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.12 -58.72 7.4 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 124.071 0.948 . . . . 71.030000000000001 110.252 -171.266 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.19 -34.43 70.35 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 118.489 -0.767 . . . . 62.409999999999997 111.486 -175.467 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.62 -33.6 62.62 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 119.412 1.005 . . . . 64.120000000000005 112.299 176.126 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.49 -27.67 67.2 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.95 -1.094 . . . . 65.439999999999998 109.488 172.594 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.6 tp -120.48 22.85 11.12 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 127.013 2.125 . . . . 65.120000000000005 111.782 -165.729 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -48.45 114.18 0.91 Allowed 'General case' 0 C--O 1.233 0.199 0 C-N-CA 127.584 2.354 . . . . 72.040000000000006 108.829 173.953 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 77.54 6.22 86.56 Favored Glycine 0 CA--C 1.538 1.503 0 N-CA-C 114.636 0.614 . . . . 62.340000000000003 114.636 174.593 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 5.4 pttm -129.28 3.94 5.19 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 119.032 1.416 . . . . 71.310000000000002 113.556 -174.918 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -139.8 -162.44 1.34 Allowed 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.752 1.221 . . . . 74.230000000000004 108.426 164.536 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -136.17 147.19 47.58 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 125.595 1.558 . . . . 72.129999999999995 107.772 -176.392 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -69.16 -15.67 63.46 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.792 0.837 . . . . 65.409999999999997 113.239 -176.232 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -104.95 -2.08 25.01 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.57 1.148 . . . . 72.040000000000006 112.723 171.686 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.1 m -101.37 -35.9 9.06 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 121.059 -1.025 . . . . 74.420000000000002 112.982 -175.385 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 22.7 mt -55.09 -53.99 28.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 119.192 0.905 . . . . 45.509999999999998 109.342 -178.939 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -50.14 -51.36 43.93 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 124.026 0.931 . . . . 65.209999999999994 109.507 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -73.37 -9.13 58.38 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 124.404 1.082 . . . . 53.310000000000002 112.6 -172.931 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.482 ' HE2' ' CD1' ' A' ' 36' ' ' TRP . 57.6 tptt -84.79 -65.21 1.03 Allowed 'General case' 0 CA--C 1.519 -0.243 0 O-C-N 120.184 -1.573 . . . . 75.010000000000005 107.977 178.799 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 3.2 ptt? -61.74 -33.78 74.65 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 113.178 0.807 . . . . 73.439999999999998 113.178 -170.006 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 96.3 t -65.18 -49.19 80.41 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.223 0 C-N-CA 123.917 0.887 . . . . 74.329999999999998 109.497 176.683 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -62.06 -36.57 82.04 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 121.034 -1.041 . . . . 71.209999999999994 110.932 -173.829 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 83.2 mt -65.93 -6.11 11.43 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 125.424 1.489 . . . . 63.310000000000002 112.113 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -53.56 -51.82 61.69 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 120.191 1.359 . . . . 74.200000000000003 111.866 -178.009 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -78.95 -9.15 59.43 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.204 0.602 . . . . 70.299999999999997 112.563 -175.205 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 31.7 m -64.57 -38.21 90.22 Favored 'General case' 0 C--O 1.226 -0.165 0 O-C-N 120.827 -1.171 . . . . 62.439999999999998 110.108 -179.63 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -64.32 -27.06 68.77 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 120.834 -1.166 . . . . 62.039999999999999 113.276 -170.169 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 12.7 tpt85 -65.02 -53.96 37.87 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.53 1.132 . . . . 73.430000000000007 108.713 173.507 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -63.07 -56.18 19.17 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 124.385 1.074 . . . . 63.350000000000001 110.893 -177.43 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -63.67 -18.5 64.03 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.541 1.136 . . . . 70.129999999999995 113.27 -164.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 11.6 mm -87.09 -38.53 12.27 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.156 0 C-N-CA 125.767 1.627 . . . . 73.450000000000003 110.076 177.351 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 76.6 mt -71.84 -28.3 30.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 O-C-N 121.027 -1.046 . . . . 74.109999999999999 108.325 172.681 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 2.9 t -73.12 -43.72 61.28 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.57 0.748 . . . . 73.319999999999993 109.434 177.623 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -132.81 82.85 2.02 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 106.015 -1.846 . . . . 61.450000000000003 106.015 -174.644 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.757 HD12 ' H ' ' A' ' 104' ' ' ILE . 2.0 mp . . . . . 0 C--O 1.253 1.244 0 N-CA-C 106.626 -1.62 . . . . 71.010000000000005 106.626 173.371 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.206 -1.233 0 CA-C-O 117.748 -1.12 . . . . 73.129999999999995 113.362 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . 0.263 11.0 pt-20 43.99 58.36 3.69 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-N 121.088 1.767 . . . . 64.150000000000006 111.911 -177.422 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 55.84 12.21 0.83 Allowed 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 127.667 2.387 . . . . 70.120000000000005 116.219 -172.729 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 11.7 mmtt -70.61 -7.26 42.8 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 119.908 -1.745 . . . . 70.150000000000006 113.867 174.591 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.3 m-30 -59.71 -32.5 70.59 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 121.197 1.817 . . . . 65.540000000000006 111.122 176.733 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -73.95 15.6 0.29 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.642 1.177 . . . . 64.219999999999999 113.54 176.35 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -153.31 178.04 10.21 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 125.268 1.427 . . . . 70.329999999999998 109.774 -164.52 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 51.07 -162.46 0.07 Allowed 'General case' 0 C--O 1.236 0.362 0 C-N-CA 128.077 2.551 . . . . 70.239999999999995 111.974 168.084 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -145.46 8.98 1.19 Allowed 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 125.945 1.698 . . . . 73.030000000000001 110.971 169.394 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -72.14 -52.37 16.96 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-N 119.288 0.949 . . . . 64.409999999999997 109.725 169.918 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.903 ' H ' HD22 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -69.69 -46.02 66.99 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 124.658 1.183 . . . . 70.349999999999994 112.288 -169.578 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 39.4 t-20 -58.43 -41.43 85.01 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 124.218 1.007 . . . . 64.239999999999995 110.942 -175.719 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -47.98 -51.84 22.18 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.832 2.053 . . . . 71.340000000000003 111.748 177.066 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 3.7 mttp -55.51 -57.65 11.03 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 108.917 -0.772 . . . . 65.319999999999993 108.917 172.983 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.98 2.96 0.92 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.441 1.496 . . . . 72.129999999999995 113.983 -176.25 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -98.41 -28.47 13.62 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 120.504 -1.372 . . . . 72.25 110.388 171.057 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -128.87 34.7 4.43 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 120.714 -1.241 . . . . 62.109999999999999 113.451 -159.886 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.452 ' CD ' ' HB1' ' A' ' 96' ' ' ALA . 0.0 OUTLIER -125.12 -6.29 7.22 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 115.262 1.578 . . . . 73.140000000000001 115.262 -172.356 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 76.5 mtt85 -53.89 -22.93 11.06 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 120.109 1.322 . . . . 70.209999999999994 113.535 176.529 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -95.17 -17.6 21.64 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 113.151 0.797 . . . . 71.510000000000005 113.151 177.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.6 ttt180 -56.03 -56.37 21.6 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.548 1.067 . . . . 64.430000000000007 110.784 -179.37 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -70.67 -16.28 62.79 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 114.085 1.142 . . . . 74.329999999999998 114.085 -176.156 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 12.4 mt -61.9 -25.9 67.84 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.564 1.074 . . . . 74.450000000000003 110.521 167.896 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.13 -37.42 92.83 Favored Glycine 0 N--CA 1.442 -0.947 0 CA-C-O 119.268 -0.74 . . . . 43.109999999999999 111.963 173.641 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -65.84 -27.64 68.39 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 118.544 1.172 . . . . 73.239999999999995 110.694 179.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 28.9 t90 -71.77 -62.14 1.53 Allowed 'General case' 0 CA--C 1.534 0.354 0 O-C-N 121.213 -0.929 . . . . 70.439999999999998 109.25 171.126 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -54.85 -48.95 72.23 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 113.692 0.997 . . . . 63.240000000000002 113.692 -176.157 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -47.58 -50.38 24.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 119.252 0.933 . . . . 72.340000000000003 111.731 175.476 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -65.34 -7.13 31.08 Favored Glycine 0 CA--C 1.534 1.265 0 C-N-CA 125.337 1.446 . . . . 71.409999999999997 114.611 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 18.3 mt -102.93 -45.85 4.84 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 126.316 1.846 . . . . 63.520000000000003 109.731 172.948 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.407 HD22 ' CZ ' ' A' ' 51' ' ' TYR . 1.8 mp -62.33 -10.59 11.6 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 127.099 2.16 . . . . 63.119999999999997 114.805 -176.05 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 89.03 34.41 8.88 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 110.875 -0.89 . . . . 71.310000000000002 110.875 -179.737 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 16.2 mttm -117.45 143.98 45.48 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 106.755 -1.572 . . . . 63.509999999999998 106.755 172.747 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 10.2 p -141.92 172.18 13.04 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 107.128 -1.434 . . . . 64.439999999999998 107.128 167.13 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 60.73 -142.98 48.3 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 111.742 -0.543 . . . . 73.099999999999994 111.742 175.018 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -60.98 -32.02 71.59 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.05 0.389 . . . . 64.400000000000006 112.05 -177.105 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -59.92 -47.19 86.8 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 124.514 1.126 . . . . 73.5 111.199 177.404 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.59 -45.42 94.17 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.29 -0.868 . . . . 71.120000000000005 110.69 172.731 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.9 ttt180 -58.59 -50.29 74.34 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 123.995 0.918 . . . . 74.409999999999997 111.083 -176.988 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.19 -48.74 80.44 Favored 'General case' 0 C--O 1.233 0.184 0 C-N-CA 126.984 2.113 . . . . 73.430000000000007 111.412 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.407 ' CZ ' HD22 ' A' ' 41' ' ' LEU . 72.3 t80 -63.67 -37.95 89.28 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.474 -0.766 . . . . 73.519999999999996 110.656 176.688 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.2 -14.25 61.59 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 120.858 -1.151 . . . . 75.439999999999998 112.741 177.259 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 22.8 mt -70.08 -31.98 69.82 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 120.169 1.35 . . . . 63.32 110.405 172.853 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 17.0 p -90.35 -20.06 23.3 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 120.929 -1.107 . . . . 43.310000000000002 111.247 -171.852 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 57.5 t -68.85 88.35 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 125.787 1.635 . . . . 71.329999999999998 108.615 168.184 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 20.1 t -134.83 138.97 48.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 106.773 -1.565 . . . . 65.230000000000004 106.773 148.701 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 66.3 p -154.47 167.99 28.19 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 128.437 2.695 . . . . 74.420000000000002 107.362 175.654 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 CA--C 1.531 0.243 0 C-N-CA 125.997 1.719 . . . . 71.049999999999997 106.726 169.625 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.453 -0.311 0 CA-C-O 118.316 -0.85 . . . . 42.130000000000003 110.907 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.5 p -79.13 -53.62 13.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 C-N-CA 123.559 0.744 . . . . 64.430000000000007 110.536 176.483 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -56.62 -35.42 68.28 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-O 118.745 -0.645 . . . . 73.319999999999993 109.855 -175.022 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -48.05 -59.27 3.5 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.078 0.951 . . . . 64.319999999999993 111.578 174.342 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -72.44 -37.93 68.44 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 118.819 -0.61 . . . . 73.340000000000003 110.058 -175.236 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.58 -47.27 70.27 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 119.152 0.887 . . . . 73.140000000000001 110.544 -176.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.69 -16.76 63.92 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.473 1.109 . . . . 72.319999999999993 111.121 179.139 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -77.28 -47.42 20.13 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.013 0.824 . . . . 60.109999999999999 110.843 168.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.95 -24.08 67.71 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.473 1.109 . . . . 73.219999999999999 111.203 177.467 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 79.3 mt -117.17 31.43 6.75 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 126.345 1.858 . . . . 74.450000000000003 111.478 177.503 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -55.78 117.92 4.09 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 107.211 -1.403 . . . . 72.120000000000005 107.211 168.668 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 95.63 -10.54 68.76 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 126.317 1.913 . . . . 55.219999999999999 113.713 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.2 mtpp -126.7 1.52 6.78 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 119.696 1.748 . . . . 63.450000000000003 113.756 -165.297 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -151.0 174.31 13.29 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 119.043 0.838 . . . . 73.239999999999995 110.356 172.27 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -140.47 168.82 18.89 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 127.26 2.224 . . . . 52.420000000000002 105.798 174.331 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -57.98 -46.16 85.62 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.007 0.923 . . . . 61.109999999999999 111.64 -171.847 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -76.35 -16.47 59.74 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-O 119.485 -0.293 . . . . 73.420000000000002 110.903 -174.626 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 95.1 m -70.14 -56.81 5.91 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 107.947 -1.131 . . . . 74.549999999999997 107.947 165.525 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 47.8 mt -60.38 -55.96 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 C-N-CA 124.482 1.113 . . . . 74.340000000000003 109.938 -171.331 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.69 -28.08 63.47 Favored 'General case' 0 N--CA 1.456 -0.126 0 O-C-N 122.076 -0.39 . . . . 73.439999999999998 111.524 -175.01 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.62 -46.88 13.76 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.794 0.837 . . . . 74.420000000000002 110.285 -179.583 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.52 -40.52 75.18 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 122.939 0.495 . . . . 73.140000000000001 110.329 -165.292 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 9.5 mtt -61.26 -43.86 98.18 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 119.143 -0.456 . . . . 61.310000000000002 110.845 -179.719 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 49.8 t -65.41 -34.89 73.53 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 125.18 1.392 . . . . 71.230000000000004 110.656 -176.361 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 -55.82 -54.65 41.9 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 108.748 -0.834 . . . . 74.519999999999996 108.748 178.072 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 42.6 mt -71.89 -1.97 16.24 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 126.563 1.945 . . . . 62.119999999999997 112.601 -172.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 27.5 ttp180 -57.13 -52.15 66.46 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 123.912 0.885 . . . . 74.25 110.625 -175.586 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.85 -49.79 73.51 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.355 1.062 . . . . 71.530000000000001 110.028 177.802 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.8 m -52.63 -49.99 64.05 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 129.563 3.145 . . . . 61.439999999999998 109.927 -174.918 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.452 ' HB1' ' CD ' ' A' ' 28' ' ' ARG . . . -53.3 -34.88 59.15 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.577 0.751 . . . . 65.540000000000006 111.637 -179.025 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 9.1 mtm180 -79.01 -45.58 19.93 Favored 'General case' 0 C--O 1.233 0.233 0 O-C-N 121.107 -0.995 . . . . 72.150000000000006 109.032 -177.86 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -60.35 -39.24 86.46 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 125.0 1.32 . . . . 72.150000000000006 111.164 178.542 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -56.54 -42.49 78.61 Favored 'General case' 0 C--O 1.221 -0.43 0 C-N-CA 124.577 1.151 . . . . 64.239999999999995 112.715 -177.033 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.5 mm -58.62 -44.9 90.6 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-N 119.996 1.271 . . . . 74.109999999999999 108.979 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 86.9 mt -73.46 -9.72 13.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 124.809 1.244 . . . . 72.430000000000007 110.056 -179.58 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -109.38 16.77 22.1 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.918 1.687 . . . . 45.049999999999997 109.705 177.105 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -122.63 18.11 10.37 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.51 1.924 . . . . 72.450000000000003 108.491 177.03 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 61.8 mt . . . . . 0 C--O 1.251 1.16 0 CA-C-O 115.859 -2.02 . . . . 70.430000000000007 106.593 173.951 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.3 ttm . . . . . 0 N--CA 1.473 0.709 0 CA-C-O 118.636 -0.697 . . . . 72.409999999999997 112.14 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 67.0 p -78.56 148.85 33.19 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 120.548 1.522 . . . . 62.439999999999998 111.887 -167.207 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -83.03 78.57 9.56 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 124.498 1.119 . . . . 65.239999999999995 108.354 170.35 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -160.8 162.08 32.21 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 123.483 0.713 . . . . 75.230000000000004 109.283 159.29 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -169.55 122.47 0.74 Allowed 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 129.298 3.039 . . . . 60.340000000000003 104.087 167.556 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -119.46 -22.05 7.17 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 119.817 1.19 . . . . 75.319999999999993 113.144 -175.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 2.0 ttt-85 59.65 -164.58 0.21 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.109 1.363 . . . . 64.349999999999994 114.679 160.448 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.5 164.51 4.41 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.155 0.982 . . . . 72.129999999999995 109.903 168.033 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.4 163.49 14.17 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.136 -0.977 . . . . 72.420000000000002 109.776 166.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -153.35 75.44 1.06 Allowed 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.202 1.401 . . . . 75.25 110.186 -178.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -75.9 14.64 0.64 Allowed 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 116.792 2.145 . . . . 72.230000000000004 116.792 -175.013 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -45.93 106.6 0.08 Allowed 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.017 1.727 . . . . 71.450000000000003 112.714 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 54.57 -5.32 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 128.525 2.73 . . . . 73.510000000000005 116.392 -171.547 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 48.7 mttt -58.0 -26.97 63.07 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 127.071 2.148 . . . . 62.149999999999999 113.952 -168.231 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -63.73 -9.42 14.21 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 114.106 1.15 . . . . 74.530000000000001 114.106 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -132.92 39.09 3.34 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 119.336 0.971 . . . . 24.440000000000001 110.143 173.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -146.44 -65.1 0.29 Allowed 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 107.057 -1.46 . . . . 64.420000000000002 107.057 169.219 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -67.04 158.05 31.99 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 127.052 2.141 . . . . 61.219999999999999 111.004 -172.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -89.04 -57.75 2.79 Favored 'General case' 0 C--O 1.223 -0.311 0 N-CA-C 108.811 -0.811 . . . . 73.540000000000006 108.811 163.069 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -49.58 -50.96 40.38 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.701 1.0 . . . . 40.210000000000001 113.701 -162.197 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 15.0 mt -76.43 -26.56 55.6 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 113.509 0.929 . . . . 75.129999999999995 113.509 -178.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -65.69 -51.35 60.11 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.975 1.31 . . . . 72.510000000000005 107.591 175.216 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -44.4 -49.24 9.76 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 128.936 2.895 . . . . 73.450000000000003 111.359 -171.164 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.1 pttp -53.7 -51.61 62.72 Favored 'General case' 0 C--O 1.233 0.234 0 O-C-N 121.258 -0.901 . . . . 62.539999999999999 111.984 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.85 -30.4 50.97 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 113.283 0.845 . . . . 61.450000000000003 113.283 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -53.56 -41.25 66.3 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.704 1.602 . . . . 60.119999999999997 108.692 176.144 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.18 -86.03 0.32 Allowed 'General case' 0 C--N 1.345 0.389 0 CA-C-O 118.674 -0.679 . . . . 54.229999999999997 109.273 178.493 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.455 ' HB3' ' HB1' ' A' ' 96' ' ' ALA . 0.1 OUTLIER 48.61 -24.98 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.201 1 C-N-CA 132.121 4.168 . . . . 74.439999999999998 118.559 179.02 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.99 -36.81 13.37 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 128.516 2.726 . . . . 75.409999999999997 114.202 -167.576 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -107.67 -19.65 13.48 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.159 0.984 . . . . 72.530000000000001 110.155 -174.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.73 -32.16 71.44 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.973 1.309 . . . . 73.129999999999995 110.969 -176.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.503 ' CD1' HD23 ' A' ' 92' ' ' LEU . 0.2 OUTLIER -90.17 -5.71 56.14 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.912 0.885 . . . . 75.239999999999995 112.76 -175.288 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.432 HD11 ' HB2' ' A' ' 89' ' ' MET . 13.1 mt -81.19 -28.44 34.93 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 119.383 0.992 . . . . 60.340000000000003 113.464 -170.527 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -69.92 -34.32 71.18 Favored Glycine 0 C--O 1.223 -0.572 0 N-CA-C 109.089 -1.604 . . . . 51.25 109.089 169.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -65.2 -19.29 65.9 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 118.628 1.214 . . . . 62.43 112.295 176.391 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 32.1 t90 -77.13 -66.21 0.85 Allowed 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 125.594 1.558 . . . . 61.240000000000002 109.363 167.17 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.41 -31.18 61.65 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 118.407 -0.806 . . . . 61.119999999999997 112.805 -174.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -46.76 -63.29 1.06 Allowed 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 125.656 1.582 . . . . 34.299999999999997 110.567 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -55.63 -44.86 86.18 Favored Glycine 0 C--N 1.336 0.535 0 N-CA-C 111.235 -0.746 . . . . 55.030000000000001 111.235 -178.167 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 28.4 mt -62.85 -36.03 81.91 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.491 0.716 . . . . 73.439999999999998 111.814 -177.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 77.8 mt -82.7 1.17 39.96 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.114 1.766 . . . . 62.109999999999999 112.495 176.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 84.24 12.18 76.74 Favored Glycine 0 CA--C 1.527 0.797 0 C-N-CA 125.202 1.382 . . . . 74.450000000000003 113.915 177.626 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -87.78 133.07 33.94 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.852 1.261 . . . . 75.209999999999994 107.969 -177.591 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 33.0 p -140.84 167.84 21.22 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 125.966 1.706 . . . . 51.539999999999999 107.883 -179.025 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 56.19 -134.69 50.43 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 111.476 -0.65 . . . . 55.210000000000001 111.476 175.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -68.3 -26.96 65.9 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 117.59 0.695 . . . . 74.25 111.542 178.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.24 -35.56 77.57 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 123.606 0.762 . . . . 72.219999999999999 110.474 176.324 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.61 -48.02 24.05 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.178 -0.675 . . . . 54.149999999999999 109.178 173.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -62.49 -47.57 83.37 Favored 'General case' 0 C--O 1.226 -0.141 0 N-CA-C 109.846 -0.427 . . . . 71.310000000000002 109.846 -168.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.87 -42.83 84.96 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.454 1.102 . . . . 73.450000000000003 110.511 -177.584 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 31.6 t80 -58.32 -46.33 86.4 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 122.669 0.387 . . . . 72.109999999999999 110.274 175.573 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.17 -36.44 68.33 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 121.465 -0.772 . . . . 45.409999999999997 111.75 178.184 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 44.2 mt -75.17 10.14 1.68 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.292 1.437 . . . . 55.009999999999998 112.259 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.7 t -133.68 34.52 3.42 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 120.098 1.317 . . . . 72.430000000000007 111.248 169.312 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 81.4 t -132.18 85.33 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 O-C-N 121.081 -1.012 . . . . 72.120000000000005 108.853 177.207 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 16.4 t -151.1 122.54 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 124.615 1.166 . . . . 54.530000000000001 109.5 170.037 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 6.5 t -149.17 -38.97 0.15 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.202 1.001 . . . . 75.439999999999998 111.445 162.065 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.5 m 74.84 41.68 0.31 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.312 1.845 . . . . 73.239999999999995 112.958 -176.125 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -66.4 179.98 0.91 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.889 2.076 . . . . 64.409999999999997 112.872 179.145 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER 67.32 60.08 0.5 Allowed 'General case' 0 C--O 1.237 0.412 0 C-N-CA 126.761 2.024 . . . . 74.239999999999995 109.774 163.526 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -137.18 109.41 7.29 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 123.558 0.743 . . . . 61.119999999999997 109.189 165.174 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 66.86 145.39 0.1 OUTLIER Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 128.516 2.726 . . . . 73.129999999999995 110.889 -170.651 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -71.3 129.79 16.5 Favored 'Trans proline' 0 C--N 1.352 0.737 0 CA-C-N 121.887 1.71 . . . . 63.210000000000001 110.785 -177.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 170.05 -11.01 0.05 OUTLIER Glycine 0 CA--C 1.527 0.841 0 CA-C-O 118.02 -1.433 . . . . 72.129999999999995 114.174 172.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -132.97 -75.28 0.49 Allowed 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 119.586 1.693 . . . . 65.109999999999999 109.34 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 49.18 82.94 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.576 1.95 . . . . 72.340000000000003 113.089 173.209 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.514 ' OD2' ' HE2' ' A' ' 71' ' ' LYS . 0.6 OUTLIER -118.56 -41.53 2.81 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 118.777 -0.63 . . . . 74.329999999999998 110.225 170.52 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 72.4 t -57.07 -43.81 81.89 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 CA-C-N 120.304 1.411 . . . . 73.409999999999997 111.342 -173.171 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -56.91 -53.97 51.89 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.694 1.198 . . . . 54.049999999999997 109.185 175.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 26.8 ttm-85 -53.83 -42.18 68.19 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 125.679 1.591 . . . . 74.150000000000006 112.067 178.595 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.514 ' HE2' ' OD2' ' A' ' 67' ' ' ASP . 5.5 mptp? -75.25 -47.61 27.25 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 118.322 0.51 . . . . 74.329999999999998 109.749 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 16.3 mt -59.55 -44.33 93.27 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 117.689 -1.148 . . . . 74.510000000000005 110.444 -179.311 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.22 -18.79 64.86 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.988 1.267 . . . . 60.109999999999999 112.364 -177.293 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -87.4 -52.67 5.24 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.513 1.125 . . . . 62.240000000000002 110.371 170.213 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -60.18 -48.08 83.25 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 121.044 -1.035 . . . . 72.129999999999995 110.012 -174.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.8 tp -91.32 15.62 11.71 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 130.348 3.459 . . . . 64.340000000000003 111.577 -175.194 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -55.87 109.87 0.64 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.488 1.515 . . . . 72.319999999999993 109.88 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 110.05 -4.38 30.25 Favored Glycine 0 CA--C 1.528 0.847 0 C-N-CA 125.425 1.488 . . . . 52.409999999999997 112.511 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -133.05 -5.76 3.08 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.046 1.338 . . . . 73.319999999999993 113.275 -171.463 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -146.33 130.07 17.08 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.507 0.67 . . . . 52.539999999999999 110.602 169.01 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.39 161.13 25.88 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 126.262 1.825 . . . . 74.409999999999997 107.616 164.498 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -58.54 -45.13 89.56 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.973 0.892 . . . . 71.310000000000002 109.35 175.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -70.52 -27.89 64.53 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.689 0.796 . . . . 74.120000000000005 112.373 179.294 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 47.6 m -68.28 -36.19 79.0 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.665 0.786 . . . . 65.420000000000002 110.209 175.45 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 10.4 mt -69.65 -60.83 2.05 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 CA-C-N 119.937 1.244 . . . . 60.439999999999998 108.566 169.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.55 -18.5 65.4 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 114.173 1.175 . . . . 73.120000000000005 114.173 -164.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -91.91 -31.27 15.73 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 119.208 0.913 . . . . 62.240000000000002 110.419 178.181 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -64.34 -66.86 0.49 Allowed 'General case' 0 CA--C 1.514 -0.419 0 CA-C-N 119.21 0.914 . . . . 71.519999999999996 111.028 -173.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.432 ' HB2' HD11 ' A' ' 33' ' ' LEU . 5.3 ptt? -66.66 -14.91 63.06 Favored 'General case' 0 N--CA 1.462 0.162 0 N-CA-C 113.592 0.96 . . . . 54.149999999999999 113.592 -162.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 37.4 t -45.67 -49.2 4.29 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 C-N-CA 127.019 2.128 . . . . 72.140000000000001 111.794 166.391 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -82.0 -21.26 37.16 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 119.502 1.046 . . . . 72.510000000000005 111.838 -169.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.503 HD23 ' CD1' ' A' ' 32' ' ' LEU . 7.0 mp -66.47 -7.37 19.19 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 126.855 2.062 . . . . 73.430000000000007 111.454 -168.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 30.3 mtp180 -54.39 -42.17 70.08 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 122.95 0.5 . . . . 71.340000000000003 110.408 168.165 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.3 -52.59 8.93 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.617 0.767 . . . . 61.420000000000002 110.293 174.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.0 m -52.84 -29.59 28.77 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.048 0.939 . . . . 74.530000000000001 112.039 -177.523 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.455 ' HB1' ' HB3' ' A' ' 28' ' ' ARG . . . -55.18 -50.87 68.25 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 125.647 1.579 . . . . 44.520000000000003 114.135 177.65 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 9.3 ptt180 -75.47 -41.56 55.29 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 109.566 -0.531 . . . . 74.230000000000004 109.566 178.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -48.78 -55.87 10.28 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 126.687 1.995 . . . . 60.210000000000001 111.711 177.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -64.28 -25.39 68.03 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.792 0.724 . . . . 73.140000000000001 112.523 -174.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.8 mm -77.36 -44.58 30.26 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.254 0 O-C-N 120.707 -1.246 . . . . 71.340000000000003 109.452 176.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 91.8 mt -71.67 -10.46 13.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 C-N-CA 124.844 1.258 . . . . 75.510000000000005 110.501 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 10.7 t -86.72 -56.14 3.54 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.926 1.29 . . . . 60.119999999999997 108.65 170.581 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 66.8 mt-10 -101.61 56.87 0.83 Allowed 'General case' 0 C--O 1.236 0.385 0 N-CA-C 106.881 -1.525 . . . . 65.430000000000007 106.881 -168.438 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 83.6 mt . . . . . 0 C--O 1.25 1.107 0 C-N-CA 123.816 0.847 . . . . 71.430000000000007 109.038 -172.202 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.6 mtm . . . . . 0 N--CA 1.476 0.84 0 CA-C-O 117.38 -1.295 . . . . 73.430000000000007 107.513 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 14.1 t -148.89 168.23 23.59 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 120.058 1.299 . . . . 74.310000000000002 108.782 -179.684 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.0 p -118.23 64.66 0.76 Allowed 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 126.787 2.035 . . . . 74.450000000000003 106.475 174.093 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -90.26 11.07 22.31 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.867 1.267 . . . . 70.310000000000002 110.918 -179.156 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -73.01 174.43 7.89 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.814 0.846 . . . . 65.540000000000006 110.804 -176.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -130.47 -2.48 4.34 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.514 1.526 . . . . 73.310000000000002 112.513 179.245 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -151.35 -174.62 4.88 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.278 0.945 . . . . 72.549999999999997 113.196 -168.36 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -67.13 147.67 52.82 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 122.253 1.025 . . . . 65.510000000000005 109.868 172.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -128.9 -66.33 0.83 Allowed 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 124.804 1.242 . . . . 70.219999999999999 108.286 175.788 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -137.11 -2.12 2.09 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 115.737 1.755 . . . . 74.420000000000002 115.737 -155.084 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . 0.327 1.1 p-80 46.27 -165.53 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.017 1.327 . . . . 73.400000000000006 113.637 168.486 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 44.75 90.38 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.358 1.863 . . . . 70.439999999999998 113.988 177.272 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 60.69 -3.54 0.14 Allowed 'General case' 0 C--O 1.237 0.397 0 C-N-CA 128.2 2.6 . . . . 74.540000000000006 115.786 -166.13 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -60.56 -13.73 15.8 Favored 'General case' 0 C--O 1.218 -0.594 0 O-C-N 120.488 -1.382 . . . . 74.340000000000003 112.507 159.043 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -48.6 -41.05 29.61 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.868 1.213 . . . . 72.510000000000005 112.198 163.334 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -82.54 -41.83 19.15 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 118.401 0.546 . . . . 54.399999999999999 111.217 174.202 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -72.41 -44.63 62.18 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.245 1.018 . . . . 54.399999999999999 112.704 -167.507 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -120.08 105.62 11.19 Favored 'General case' 0 CA--C 1.517 -0.316 0 C-N-CA 127.088 2.155 . . . . 62.43 105.59 -175.146 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.36 -14.52 56.81 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 113.087 0.773 . . . . 51.200000000000003 113.087 -172.32 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -64.11 -35.72 81.67 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.952 0.901 . . . . 64.129999999999995 109.683 175.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.8 mt -70.85 -37.69 73.13 Favored 'General case' 0 C--O 1.234 0.265 0 O-C-N 120.881 -1.137 . . . . 74.409999999999997 111.086 174.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -60.01 -50.5 73.51 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 118.946 -0.55 . . . . 74.120000000000005 110.153 172.444 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -52.61 -56.91 12.08 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 126.103 1.761 . . . . 74.140000000000001 109.68 -178.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -45.12 -49.14 12.02 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 124.731 1.212 . . . . 63.439999999999998 111.407 -179.273 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -76.82 -40.18 48.83 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.055 0.761 . . . . 62.119999999999997 113.055 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -66.78 -19.03 65.66 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.063 -1.023 . . . . 73.5 110.256 178.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -90.15 13.88 13.93 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 127.656 2.382 . . . . 72.430000000000007 112.289 170.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.6 mmt85 -108.77 -30.37 8.2 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 120.065 1.302 . . . . 71.510000000000005 112.411 172.508 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.3 ptt85 -57.43 -15.95 8.13 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 115.582 1.697 . . . . 65.510000000000005 115.582 -169.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -121.3 -15.09 8.2 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 126.218 1.807 . . . . 74.140000000000001 111.168 -178.45 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.62 -22.56 65.33 Favored 'General case' 0 N--CA 1.471 0.591 0 O-C-N 120.698 -1.251 . . . . 74.239999999999995 111.64 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.447 HD12 ' H ' ' A' ' 32' ' ' LEU . 0.1 OUTLIER -106.17 -14.17 15.22 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.575 1.55 . . . . 71.150000000000006 114.128 -171.873 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.52 -34.35 17.01 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 125.422 1.489 . . . . 53.140000000000001 113.355 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -61.81 -24.34 64.42 Favored Glycine 0 CA--C 1.526 0.732 0 CA-C-O 118.386 -1.23 . . . . 63.140000000000001 113.379 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -65.24 -31.0 71.93 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.687 2.243 . . . . 63.43 112.488 -177.393 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.431 ' CD1' ' HE3' ' A' ' 88' ' ' LYS . 22.9 t90 -63.8 -72.37 0.14 Allowed 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 125.6 1.56 . . . . 73.239999999999995 108.492 175.02 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.47 -17.13 63.56 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 124.916 1.287 . . . . 60.140000000000001 113.917 -176.638 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -54.34 -57.41 11.37 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 119.352 0.978 . . . . 60.350000000000001 109.066 173.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.65 -38.25 93.49 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 111.347 -0.701 . . . . 75.109999999999999 111.347 -179.452 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.5 mp -61.22 -38.37 86.37 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.495 -1.003 . . . . 74.040000000000006 111.064 178.127 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 95.6 mt -89.14 5.84 42.76 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 127.04 2.136 . . . . 73.450000000000003 113.068 176.218 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 74.54 9.65 82.18 Favored Glycine 0 CA--C 1.534 1.226 0 C-N-CA 125.388 1.47 . . . . 44.240000000000002 114.424 177.217 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.9 mttt -85.82 137.96 32.4 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 119.341 1.57 . . . . 52.549999999999997 106.983 173.251 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 37.0 p -138.85 -178.0 5.13 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.664 -0.865 . . . . 75.230000000000004 108.664 168.451 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 47.47 -117.28 3.22 Favored Glycine 0 CA--C 1.524 0.619 0 C-N-CA 125.288 1.423 . . . . 31.239999999999998 112.941 174.321 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -82.65 -16.59 47.69 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.015 1.726 . . . . 75.140000000000001 112.686 -172.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -76.14 -48.8 19.27 Favored 'General case' 0 CA--C 1.512 -0.486 0 O-C-N 120.912 -1.118 . . . . 62.240000000000002 109.016 169.231 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -56.81 -42.99 80.51 Favored 'General case' 0 N--CA 1.445 -0.72 0 N-CA-C 108.748 -0.834 . . . . 61.119999999999997 108.748 175.365 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.3 ttm-85 -51.42 -47.72 62.91 Favored 'General case' 0 N--CA 1.437 -1.107 0 N-CA-C 112.96 0.726 . . . . 75.329999999999998 112.96 173.186 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.69 -49.25 66.69 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 118.091 0.405 . . . . 73.450000000000003 110.435 -178.037 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -52.34 -44.93 65.45 Favored 'General case' 0 N--CA 1.457 -0.093 0 C-N-CA 123.435 0.694 . . . . 72.230000000000004 110.696 175.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.46 -30.82 63.36 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 118.421 -0.8 . . . . 43.409999999999997 112.623 -174.791 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 18.0 mt -75.5 -3.89 36.63 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.2 1.0 . . . . 64.25 111.861 -175.187 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.6 t -133.3 49.27 2.31 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.589 1.156 . . . . 63.149999999999999 109.575 179.655 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 2.0 t -127.98 12.98 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 O-C-N 120.857 -1.152 . . . . 71.450000000000003 110.669 173.151 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 4.5 m -74.24 53.21 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 125.938 1.695 . . . . 64.549999999999997 112.144 176.194 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.1 t -79.76 60.82 3.52 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.275 1.43 . . . . 65.140000000000001 108.912 178.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.3 m 63.8 -151.87 0.31 Allowed 'General case' 0 C--O 1.238 0.497 0 N-CA-C 109.919 -0.4 . . . . 64.25 109.919 169.602 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -133.45 168.29 18.89 Favored 'General case' 0 CA--C 1.516 -0.35 0 O-C-N 120.743 -1.223 . . . . 74.310000000000002 108.392 161.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -67.66 -11.3 57.95 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 112.777 0.658 . . . . 70.209999999999994 112.777 168.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -81.57 54.54 2.39 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.679 1.191 . . . . 74.540000000000006 109.574 170.596 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -138.69 163.75 44.6 Favored Pre-proline 0 CA--C 1.541 0.618 0 C-N-CA 126.406 1.882 . . . . 63.210000000000001 109.826 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -83.49 63.2 7.44 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 123.108 2.539 . . . . 62.509999999999998 110.494 -176.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 168.68 61.81 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 N-CA-C 110.21 -1.156 . . . . 71.120000000000005 110.21 -172.342 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -69.98 71.72 0.39 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.727 2.011 . . . . 70.519999999999996 108.697 174.091 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -164.08 -58.92 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 128.042 2.537 . . . . 70.400000000000006 105.819 170.382 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.68 -28.53 69.99 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 121.471 -0.768 . . . . 64.25 112.431 -170.09 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 78.3 t -57.99 -43.62 85.25 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 123.823 0.849 . . . . 65.530000000000001 110.315 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -76.27 -32.51 58.85 Favored 'General case' 0 C--O 1.233 0.224 0 O-C-N 121.118 -0.989 . . . . 74.109999999999999 109.546 -179.084 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -50.56 -50.38 53.71 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 125.071 1.348 . . . . 71.219999999999999 112.089 -172.438 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -71.7 -23.6 61.67 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 119.301 0.955 . . . . 63.520000000000003 111.515 -171.213 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 9.5 mt -74.75 -61.31 1.92 Allowed 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.25 -1.019 . . . . 74.219999999999999 108.25 168.262 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.12 -37.6 64.5 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.293 1.037 . . . . 53.039999999999999 113.09 -173.13 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.18 -38.79 87.78 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 123.29 0.636 . . . . 74.209999999999994 111.491 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -74.52 -56.88 4.35 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 122.858 1.313 . . . . 72.25 108.43 175.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.4 tp -77.15 16.67 0.54 Allowed 'General case' 0 CA--C 1.534 0.329 1 C-N-CA 131.836 4.054 . . . . 64.209999999999994 113.963 -168.861 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 55.6 tt0 -52.4 122.33 8.6 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 127.14 2.176 . . . . 70.540000000000006 110.464 -174.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 102.27 -15.43 56.3 Favored Glycine 0 CA--C 1.53 1.01 0 C-N-CA 127.249 2.357 . . . . 31.120000000000001 113.034 178.837 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 35.3 mtmt -126.06 -5.46 6.75 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 119.276 1.538 . . . . 70.120000000000005 114.88 -158.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -154.74 126.43 7.52 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 120.57 1.532 . . . . 73.349999999999994 110.026 171.084 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.14 163.52 27.77 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.72 1.208 . . . . 74.319999999999993 110.573 -178.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 77.0 mt-10 -48.56 -59.22 3.68 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 124.642 1.177 . . . . 73.340000000000003 110.433 170.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -68.29 -20.73 64.78 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.813 -0.631 . . . . 64.140000000000001 112.114 -175.117 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 18.8 m -80.16 -40.71 26.77 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.788 1.635 . . . . 61.210000000000001 110.032 176.121 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 77.4 mt -59.71 -56.56 16.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 C-N-CA 124.788 1.235 . . . . 64.299999999999997 107.689 173.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.81 -47.3 80.57 Favored 'General case' 0 C--N 1.341 0.199 0 O-C-N 123.614 0.571 . . . . 64.5 110.998 -174.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.54 -43.27 89.2 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.273 0.629 . . . . 54.439999999999998 111.559 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.431 ' HE3' ' CD1' ' A' ' 36' ' ' TRP . 12.3 tptp -66.7 -39.03 87.89 Favored 'General case' 0 C--O 1.223 -0.29 0 O-C-N 121.265 -0.897 . . . . 74.019999999999996 111.216 -176.003 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 18.0 ptp -72.14 -31.4 65.94 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 119.073 -1.051 . . . . 61.509999999999998 112.369 -174.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 71.9 t -49.97 -47.15 23.69 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 123.47 0.708 . . . . 65.109999999999999 109.233 167.182 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -50.58 -45.41 57.2 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.136 1.374 . . . . 62.329999999999998 113.501 -163.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -75.6 11.89 1.18 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.213 1.19 . . . . 65.420000000000002 114.213 -173.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 3.3 tpt85 -49.91 -53.07 28.38 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.844 1.258 . . . . 72.400000000000006 111.3 -178.677 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -63.01 -50.28 71.31 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 123.823 0.849 . . . . 61.210000000000001 109.999 175.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.8 m -50.18 -45.65 53.66 Favored 'General case' 0 C--N 1.333 -0.125 0 C-N-CA 125.912 1.685 . . . . 74.319999999999993 110.147 -173.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -54.63 -40.65 69.15 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 124.305 1.042 . . . . 71.150000000000006 112.676 -177.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -81.68 -40.32 23.01 Favored 'General case' 0 C--N 1.341 0.202 0 CA-C-O 117.463 -1.256 . . . . 74.140000000000001 111.929 172.622 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -52.35 -41.78 63.34 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 119.391 0.996 . . . . 73.439999999999998 110.834 -179.137 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 -56.27 -50.14 72.21 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 118.966 0.803 . . . . 73.120000000000005 112.024 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 43.8 mm -68.07 -42.74 85.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 123.353 0.661 . . . . 73.430000000000007 110.26 -175.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 24.1 mt -66.38 -21.14 28.25 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 N-CA-C 109.036 -0.727 . . . . 74.25 109.036 177.036 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 33.8 t -89.54 -6.07 56.68 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.584 1.154 . . . . 62.219999999999999 111.783 177.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -122.72 35.79 4.8 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 125.818 1.647 . . . . 72.030000000000001 108.812 -171.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 21.8 mm . . . . . 0 C--O 1.252 1.19 0 N-CA-C 107.46 -1.311 . . . . 74.209999999999994 107.46 172.687 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.8 mtt . . . . . 0 N--CA 1.473 0.677 0 N-CA-C 109.473 -0.565 . . . . 50.229999999999997 109.473 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.2 t -72.68 160.34 32.38 Favored 'General case' 0 CA--C 1.551 1.017 0 N-CA-C 106.25 -1.759 . . . . 61.210000000000001 106.25 -177.306 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 10.9 t -160.98 148.43 15.46 Favored 'General case' 0 C--O 1.235 0.295 0 O-C-N 120.443 -1.411 . . . . 71.409999999999997 110.049 -177.343 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -146.65 176.9 9.49 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 125.324 1.449 . . . . 50.350000000000001 108.689 170.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -58.72 172.4 0.52 Allowed 'General case' 0 C--O 1.238 0.48 0 C-N-CA 125.202 1.401 . . . . 72.209999999999994 110.389 160.349 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 47.0 p30 -117.5 163.56 16.22 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 124.606 1.163 . . . . 71.030000000000001 110.758 171.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 27.2 mtp85 -140.77 110.06 6.24 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 123.856 0.863 . . . . 72.319999999999993 108.758 -167.001 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.4 mt-10 -67.2 -16.14 64.12 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 113.918 1.081 . . . . 72.319999999999993 113.918 -179.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -100.77 172.68 6.92 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 119.527 1.058 . . . . 70.219999999999999 110.213 -174.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 50.75 69.75 0.6 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.643 1.577 . . . . 70.25 111.394 -173.321 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -123.38 -165.09 1.28 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 127.102 2.161 . . . . 63.439999999999998 108.514 -179.383 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 64.6 95.17 0.05 Allowed 'General case' 0 C--O 1.235 0.341 0 C-N-CA 126.87 2.068 . . . . 72.319999999999993 111.063 174.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 57.71 0.21 0.1 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 127.729 2.412 . . . . 64.129999999999995 114.21 -166.061 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 18.5 mmtm -66.33 -16.73 64.29 Favored 'General case' 0 C--O 1.221 -0.433 0 O-C-N 120.194 -1.566 . . . . 73.439999999999998 112.988 -178.268 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -50.22 -28.33 7.4 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 125.612 1.565 . . . . 72.409999999999997 114.826 173.132 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.95 -15.67 63.71 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.632 0.604 . . . . 71.239999999999995 112.632 178.373 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 64.4 t-80 -130.28 141.57 50.6 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 126.138 1.775 . . . . 74.120000000000005 108.129 -164.083 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 59.51 -175.84 0.1 Allowed 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.839 1.256 . . . . 74.150000000000006 109.532 -160.248 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -119.37 -19.07 8.39 Favored 'General case' 0 C--O 1.225 -0.21 0 O-C-N 121.146 -0.971 . . . . 74.349999999999994 111.883 164.078 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.88 -41.86 83.4 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.613 0.765 . . . . 73.140000000000001 110.516 -170.635 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.0 mt -71.96 -46.4 57.54 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 108.672 -0.862 . . . . 71.25 108.672 -175.465 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -61.45 -43.84 98.16 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 124.538 1.135 . . . . 73.439999999999998 111.977 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -58.79 -36.9 75.19 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 124.185 0.994 . . . . 74.140000000000001 111.014 -177.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.06 -29.65 44.97 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.821 0.848 . . . . 72.129999999999995 111.498 178.844 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.786 ' HB1' ' HA ' ' A' ' 97' ' ' ARG . . . -74.53 -54.06 8.24 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 124.717 1.207 . . . . 61.229999999999997 112.049 178.263 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.8 tp10 -55.87 -32.97 64.15 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.588 -0.695 . . . . 72.329999999999998 109.886 174.596 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -75.34 8.56 2.66 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.513 1.125 . . . . 70.349999999999994 112.31 178.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.2 mmt180 -87.91 -23.71 23.84 Favored 'General case' 0 C--O 1.231 0.111 0 O-C-N 120.656 -1.278 . . . . 74.209999999999994 111.142 166.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.3 ptt180 -67.19 -23.0 65.71 Favored 'General case' 0 C--N 1.344 0.364 0 CA-C-N 120.976 1.716 . . . . 54.299999999999997 115.185 -149.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -110.45 -12.33 14.4 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-O 118.222 -0.894 . . . . 73.420000000000002 112.02 170.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.46 -55.01 31.74 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 125.057 1.343 . . . . 74.0 110.405 171.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -66.22 -9.61 33.84 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.859 1.059 . . . . 73.299999999999997 113.859 -172.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.7 tp -56.33 -31.93 64.2 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 126.946 2.098 . . . . 65.329999999999998 111.291 171.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.49 -31.71 81.68 Favored Glycine 0 CA--C 1.532 1.141 0 O-C-N 121.252 -0.905 . . . . 74.430000000000007 112.325 176.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -68.86 -26.99 65.42 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.797 1.298 . . . . 74.239999999999995 110.768 -178.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 20.6 t90 -68.6 -65.26 0.72 Allowed 'General case' 0 N--CA 1.462 0.144 0 C-N-CA 124.87 1.268 . . . . 74.340000000000003 109.152 173.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.18 -41.36 71.83 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 118.765 -0.636 . . . . 63.119999999999997 111.878 -174.342 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -44.87 -60.8 1.87 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.523 1.129 . . . . 65.010000000000005 112.92 -178.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.65 -30.4 77.52 Favored Glycine 0 CA--C 1.528 0.898 0 CA-C-N 118.577 0.626 . . . . 72.340000000000003 112.58 -175.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 56.9 mt -68.13 -41.51 81.58 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.131 0.972 . . . . 72.129999999999995 110.012 175.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.8 mp -69.96 -1.84 10.81 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 126.387 1.875 . . . . 50.329999999999998 113.72 168.678 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 74.5 4.22 69.08 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 125.54 1.543 . . . . 65.319999999999993 113.679 -179.648 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 53.1 mttm -76.12 128.75 35.61 Favored 'General case' 0 CA--C 1.524 -0.033 0 CA-C-N 119.875 1.838 . . . . 71.430000000000007 106.856 170.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 p -134.72 166.29 23.29 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 123.823 0.849 . . . . 64.310000000000002 109.066 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 55.21 -129.74 46.42 Favored Glycine 0 CA--C 1.525 0.663 0 C-N-CA 123.667 0.651 . . . . 33.130000000000003 112.057 176.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -61.1 -36.2 79.05 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 124.645 1.178 . . . . 72.430000000000007 111.005 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.42 -37.33 86.88 Favored 'General case' 0 N--CA 1.465 0.303 0 O-C-N 121.179 -0.95 . . . . 70.319999999999993 111.296 177.394 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.44 -43.43 63.8 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 123.112 0.565 . . . . 74.310000000000002 109.858 177.434 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.5 ptp180 -65.6 -46.09 80.66 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 109.279 -0.637 . . . . 64.310000000000002 109.279 -173.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.25 -36.6 84.19 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.681 1.192 . . . . 62.310000000000002 111.542 -178.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -65.23 -45.8 83.18 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.646 0.779 . . . . 74.409999999999997 110.588 173.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -69.36 -14.95 63.2 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 114.211 1.189 . . . . 71.019999999999996 114.211 -174.031 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 64.3 mt -58.44 -20.54 45.77 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 119.432 1.014 . . . . 71.140000000000001 112.759 -176.515 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.0 t -135.32 32.12 3.13 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.352 1.061 . . . . 71.400000000000006 110.586 -168.748 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 95.0 t -113.61 99.57 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 N-CA-C 106.446 -1.687 . . . . 74.310000000000002 106.446 177.328 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 9.6 p -156.12 135.88 3.99 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 N-CA-C 107.089 -1.449 . . . . 71.230000000000004 107.089 164.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.7 t 177.21 155.77 0.29 Allowed 'General case' 0 C--O 1.235 0.341 0 C-N-CA 128.353 2.661 . . . . 73.239999999999995 105.477 172.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.2 p -160.01 121.38 3.15 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 119.012 0.824 . . . . 73.099999999999994 108.966 167.401 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -133.55 167.35 20.62 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 108.714 -0.847 . . . . 34.109999999999999 108.714 162.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -161.24 -170.26 2.6 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.276 1.83 . . . . 70.239999999999995 107.384 170.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 3.9 t70 75.21 -157.93 0.05 Allowed 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 126.779 2.032 . . . . 70.030000000000001 109.289 -178.233 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 65.91 165.82 0.12 Allowed Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 125.926 1.691 . . . . 62.240000000000002 114.493 177.179 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -84.91 4.45 6.82 Favored 'Trans proline' 0 CA--C 1.546 1.117 0 C-N-CA 123.797 2.998 . . . . 72.420000000000002 113.527 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -82.92 169.02 47.93 Favored Glycine 0 CA--C 1.526 0.75 0 O-C-N 120.358 -1.464 . . . . 73.219999999999999 112.076 -178.678 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -86.11 -62.44 1.52 Allowed 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 124.677 1.191 . . . . 61.340000000000003 109.159 172.575 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -132.86 -64.8 0.73 Allowed 'General case' 0 C--O 1.222 -0.392 0 CA-C-O 118.768 -0.634 . . . . 73.209999999999994 111.867 -136.113 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 43.6 -85.74 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 128.466 2.706 . . . . 70.329999999999998 116.195 162.05 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 2.1 p -70.12 -57.49 7.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 C-N-CA 126.923 2.089 . . . . 52.509999999999998 109.388 174.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -63.48 -18.54 63.89 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 124.949 1.3 . . . . 74.430000000000007 112.282 -179.823 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -44.91 -46.81 11.14 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 119.967 1.258 . . . . 74.310000000000002 112.431 -172.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.1 mppt? -78.85 -1.4 34.82 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.163 0.985 . . . . 74.140000000000001 112.918 -174.491 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 72.1 mt -104.51 -54.33 2.54 Favored 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 126.265 1.826 . . . . 53.109999999999999 108.285 168.622 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.33 -54.15 44.21 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 126.133 1.773 . . . . 72.319999999999993 111.352 -170.091 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -76.18 -19.31 58.56 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 111.881 0.326 . . . . 74.299999999999997 111.881 -177.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.37 -50.79 35.21 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 108.007 -1.109 . . . . 71.030000000000001 108.007 173.748 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 79.9 mt -80.62 43.35 0.66 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 129.144 2.978 . . . . 70.420000000000002 110.573 175.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -52.56 104.25 0.09 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.729 1.611 . . . . 70.0 109.76 177.19 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 69.03 14.15 67.79 Favored Glycine 0 CA--C 1.533 1.179 0 CA-C-O 118.799 -1.001 . . . . 63.020000000000003 113.844 -177.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 25.0 mtmm -113.46 -11.19 13.13 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.287 1.543 . . . . 74.409999999999997 112.055 178.009 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -148.69 138.93 22.42 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.204 -1.035 . . . . 64.010000000000005 108.204 165.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.41 161.82 25.9 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 125.787 1.635 . . . . 62.210000000000001 109.407 176.386 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 85.0 mt-10 -59.83 -46.31 89.66 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.46 0.704 . . . . 74.439999999999998 110.091 175.434 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -74.01 -15.18 61.1 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 121.379 -0.826 . . . . 70.319999999999993 111.311 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.6 m -74.46 -32.88 62.74 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 117.785 -1.102 . . . . 54.43 109.975 171.124 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 11.7 mt -58.5 -60.31 2.47 Favored 'Isoleucine or valine' 0 C--O 1.239 0.516 0 CA-C-N 120.624 1.557 . . . . 74.310000000000002 108.874 177.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -53.37 -39.73 64.41 Favored 'General case' 0 C--N 1.343 0.314 0 O-C-N 124.679 1.237 . . . . 72.0 109.978 -178.68 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.25 -45.51 76.49 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 119.625 -0.226 . . . . 50.399999999999999 110.567 -176.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.36 -38.31 71.59 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.592 0.589 . . . . 74.340000000000003 112.592 -163.019 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 33.1 mtt -66.93 -0.73 3.31 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.251 -0.905 . . . . 44.409999999999997 112.684 176.165 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 46.6 t -120.58 -29.15 1.76 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 C-N-CA 126.482 1.913 . . . . 63.039999999999999 110.132 -178.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -55.67 -48.66 74.69 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.368 1.467 . . . . 74.430000000000007 109.007 175.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 15.3 mt -77.43 4.51 10.8 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.013 1.116 . . . . 54.310000000000002 114.013 -176.314 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 63.9 ttt180 -66.28 -20.64 66.16 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 120.654 -1.279 . . . . 61.240000000000002 113.543 -166.531 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -88.27 -46.19 9.42 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 119.658 1.117 . . . . 43.210000000000001 110.355 170.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 52.4 m -50.38 -36.19 31.51 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.261 1.024 . . . . 65.439999999999998 110.532 177.189 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -46.13 -49.58 16.54 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.22 1.008 . . . . 51.350000000000001 113.037 175.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.786 ' HA ' ' HB1' ' A' ' 25' ' ' ALA . 15.9 ptt-85 -79.88 -37.82 34.01 Favored 'General case' 0 C--N 1.342 0.259 0 CA-C-N 118.421 0.555 . . . . 64.450000000000003 110.911 -179.336 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -56.72 -38.11 71.9 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 124.572 1.149 . . . . 70.310000000000002 110.426 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -57.38 -36.73 71.63 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 119.203 0.911 . . . . 74.209999999999994 112.441 -175.167 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.9 mm -72.62 -48.47 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 CA-C-N 120.196 1.362 . . . . 64.230000000000004 107.885 177.619 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 70.1 mt -61.02 -13.63 7.9 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 C-N-CA 126.031 1.732 . . . . 71.329999999999998 110.745 -177.438 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -120.79 10.69 11.0 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.972 1.309 . . . . 62.439999999999998 112.106 -178.18 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 84.4 mt-10 -121.76 22.39 10.5 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.703 1.201 . . . . 73.329999999999998 110.446 174.079 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 35.2 mm . . . . . 0 C--O 1.256 1.407 0 C-N-CA 128.66 2.784 . . . . 73.120000000000005 110.599 -170.526 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.4 mmt . . . . . 0 N--CA 1.474 0.758 0 N-CA-C 113.77 1.026 . . . . 71.450000000000003 113.77 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.7 m -118.31 56.89 0.86 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 120.826 1.648 . . . . 63.539999999999999 111.307 -150.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . 0.3 57.6 p 53.55 -18.72 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 129.483 3.113 . . . . 72.439999999999998 116.7 -174.805 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -139.76 167.77 21.34 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 128.673 2.789 . . . . 75.409999999999997 108.035 177.313 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -126.13 -52.66 1.52 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 126.016 1.727 . . . . 63.109999999999999 108.221 -174.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 50.1 m-20 49.85 -157.62 0.08 Allowed 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 127.166 2.187 . . . . 60.539999999999999 111.142 171.129 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 20.9 mtp180 -86.55 33.36 0.64 Allowed 'General case' 0 C--O 1.236 0.378 0 O-C-N 119.768 -1.832 . . . . 72.430000000000007 110.156 172.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -102.74 -10.48 19.12 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.819 1.247 . . . . 42.130000000000003 111.64 -176.249 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.52 161.72 19.55 Favored 'General case' 0 C--O 1.232 0.146 0 O-C-N 120.424 -1.423 . . . . 43.420000000000002 111.535 163.203 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -151.87 54.86 0.83 Allowed 'General case' 0 C--O 1.236 0.35 0 CA-C-N 114.865 -1.062 . . . . 71.239999999999995 111.579 178.322 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -71.58 24.23 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.487 1.515 . . . . 60.240000000000002 114.84 -174.173 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -81.17 -85.6 0.1 Allowed 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.125 -0.985 . . . . 73.120000000000005 108.868 171.498 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.97 -14.76 61.08 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.95 0.722 . . . . 61.539999999999999 112.95 -174.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 25.2 mmtm -64.04 -12.22 36.57 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 118.227 -0.892 . . . . 74.120000000000005 113.154 -179.663 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -62.23 -17.26 57.84 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 120.622 1.555 . . . . 74.510000000000005 113.578 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -93.59 17.46 11.65 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.901 0.88 . . . . 75.510000000000005 111.825 173.487 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -143.37 -64.91 0.39 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.806 1.643 . . . . 75.450000000000003 110.813 -174.826 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -86.59 123.29 31.61 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 124.52 1.128 . . . . 75.329999999999998 111.406 -166.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.0 -33.99 75.66 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.386 1.074 . . . . 74.209999999999994 110.894 178.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -59.82 -24.39 64.13 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.869 0.867 . . . . 75.519999999999996 111.32 -175.429 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 48.7 mt -84.65 -46.07 11.86 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 124.992 1.317 . . . . 63.020000000000003 109.398 -179.317 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -50.6 -51.39 48.89 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.62 1.568 . . . . 62.340000000000003 108.68 176.299 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.79 -46.91 88.68 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 124.297 1.039 . . . . 71.409999999999997 111.606 -178.004 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -66.52 -39.26 88.54 Favored 'General case' 0 N--CA 1.44 -0.938 0 O-C-N 119.632 -1.917 . . . . 63.450000000000003 109.628 -177.097 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.8 -44.79 95.24 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 118.068 0.394 . . . . 74.340000000000003 111.894 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.3 tm-20 -53.61 -38.47 64.02 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.388 0.613 . . . . 75.010000000000005 110.307 173.714 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -78.24 1.76 20.52 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.945 0.898 . . . . 63.350000000000001 113.38 -175.739 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.4 mmt-85 -80.23 -19.08 47.74 Favored 'General case' 0 N--CA 1.464 0.245 0 O-C-N 120.268 -1.52 . . . . 72.450000000000003 110.95 164.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 45.2 mtp180 -52.95 -41.94 64.99 Favored 'General case' 0 C--N 1.342 0.279 0 N-CA-C 114.587 1.328 . . . . 72.030000000000001 114.587 -169.245 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -95.23 -31.02 13.69 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 123.813 0.695 . . . . 60.420000000000002 111.671 -177.626 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -44.6 -52.57 7.99 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.047 1.339 . . . . 74.239999999999995 111.536 -178.182 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.98 -5.08 44.59 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 114.805 1.409 . . . . 74.430000000000007 114.805 -169.441 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 25.7 tp -71.52 -32.52 68.29 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 127.141 2.176 . . . . 72.200000000000003 110.508 171.134 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -57.19 -48.59 78.78 Favored Glycine 0 C--N 1.34 0.793 0 N-CA-C 110.568 -1.013 . . . . 63.420000000000002 110.568 173.127 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -63.88 -30.13 71.24 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 124.807 1.243 . . . . 63.329999999999998 112.803 -170.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 9.1 t90 -63.89 -71.6 0.17 Allowed 'General case' 0 C--O 1.231 0.117 0 N-CA-C 107.446 -1.316 . . . . 72.120000000000005 107.446 171.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.1 -32.35 34.77 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 125.496 1.518 . . . . 72.040000000000006 112.394 -173.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -45.17 -52.95 8.75 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 119.383 0.992 . . . . 73.430000000000007 111.53 174.123 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.58 -42.22 97.64 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 111.63 -0.588 . . . . 73.209999999999994 111.63 -178.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.6 mp -61.68 -46.29 90.35 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 125.365 1.466 . . . . 74.319999999999993 109.988 177.72 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.2 mp -63.2 -28.49 70.08 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.89 0.876 . . . . 42.43 110.478 175.183 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 104.21 20.38 10.49 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 126.237 1.875 . . . . 63.32 112.181 176.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 39.7 mttm -89.97 133.26 34.9 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 107.461 -1.311 . . . . 74.430000000000007 107.461 169.352 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.6 p -132.71 162.28 31.84 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 123.577 0.751 . . . . 55.420000000000002 109.479 165.677 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.51 -135.75 22.51 Favored Glycine 0 N--CA 1.448 -0.508 0 N-CA-C 110.322 -1.111 . . . . 33.149999999999999 110.322 175.049 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -66.22 -27.22 67.81 Favored 'General case' 0 C--O 1.226 -0.175 0 O-C-N 122.297 -0.531 . . . . 60.310000000000002 112.389 -177.515 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -56.61 -50.08 73.04 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.997 1.319 . . . . 75.239999999999995 109.123 174.322 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.13 -40.14 71.6 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 125.44 1.496 . . . . 72.030000000000001 110.299 -177.457 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.7 ttt85 -59.84 -49.96 75.68 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 123.334 0.654 . . . . 60.340000000000003 109.596 177.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.62 -44.78 95.92 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.153 0.981 . . . . 55.240000000000002 110.684 -178.527 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 88.6 t80 -57.08 -39.02 74.15 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.498 1.119 . . . . 73.239999999999995 111.099 175.218 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.85 -4.19 30.24 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 120.59 -1.319 . . . . 61.439999999999998 113.229 178.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 12.9 mt -84.62 -0.07 52.01 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 120.547 1.522 . . . . 62.229999999999997 112.145 176.228 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 12.0 t -130.49 37.72 3.82 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 120.621 1.555 . . . . 52.32 112.054 -173.525 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 1.8 p -134.88 99.0 2.37 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 O-C-N 121.021 -1.049 . . . . 73.439999999999998 110.552 -175.612 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.2 p -159.59 109.36 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 124.147 0.979 . . . . 55.399999999999999 113.246 166.402 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.4 t -149.45 57.9 1.0 Allowed 'General case' 0 CA--C 1.554 1.098 0 O-C-N 121.202 -0.936 . . . . 44.240000000000002 111.246 177.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.4 t 61.43 -154.23 0.36 Allowed 'General case' 0 CA--C 1.542 0.641 0 O-C-N 120.218 -1.551 . . . . 61.049999999999997 110.026 -175.059 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -131.68 -162.87 1.26 Allowed 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 127.776 2.431 . . . . 71.340000000000003 108.263 163.048 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -69.06 112.02 5.42 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 118.901 0.773 . . . . 72.349999999999994 110.289 -176.369 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -119.68 91.15 3.48 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 127.097 2.159 . . . . 73.450000000000003 106.06 178.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 58.21 164.96 0.08 OUTLIER Pre-proline 0 CA--C 1.552 1.026 0 C-N-CA 127.717 2.407 . . . . 75.150000000000006 114.306 -172.023 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -84.76 64.12 6.46 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.878 2.385 . . . . 61.020000000000003 110.227 176.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -144.3 -58.24 0.02 OUTLIER Glycine 0 C--N 1.33 0.241 0 N-CA-C 110.058 -1.217 . . . . 63.030000000000001 110.058 -178.141 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -61.37 -63.84 1.15 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.644 0.777 . . . . 75.420000000000002 109.434 178.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . 0.257 14.6 pt-20 48.74 16.61 0.12 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 129.596 3.158 . . . . 73.239999999999995 115.883 -175.845 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -51.57 -44.32 62.71 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.864 1.666 . . . . 62.119999999999997 112.868 -168.103 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.2 t -55.19 -59.44 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-N 118.761 0.71 . . . . 75.439999999999998 109.499 174.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -57.59 -36.51 71.83 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.497 0.719 . . . . 75.040000000000006 110.612 -178.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.6 tpt180 -58.88 -26.58 64.41 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 124.489 1.116 . . . . 72.120000000000005 112.439 -178.338 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.7 mmmt -99.41 -43.84 6.41 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 118.488 0.585 . . . . 75.329999999999998 109.505 175.061 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -57.44 -54.8 42.7 Favored 'General case' 0 C--O 1.223 -0.341 0 C-N-CA 124.857 1.263 . . . . 75.010000000000005 110.204 -174.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.09 -4.0 15.46 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 114.006 1.113 . . . . 32.030000000000001 114.006 -178.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -87.19 -57.47 2.95 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 108.399 -0.963 . . . . 74.200000000000003 108.399 166.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.05 -43.3 70.09 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 125.068 1.347 . . . . 74.439999999999998 110.653 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.3 tp -110.88 19.85 18.13 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 126.841 2.056 . . . . 75.439999999999998 111.512 -165.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 69.5 tt0 -48.64 118.9 2.76 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 126.007 1.723 . . . . 71.219999999999999 108.284 172.022 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 81.11 -0.58 87.21 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 125.517 1.532 . . . . 75.120000000000005 114.78 178.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 11.3 mtpp -119.54 1.88 11.18 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 118.899 1.35 . . . . 75.239999999999995 111.785 -172.438 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -148.68 -163.08 1.7 Allowed 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 125.654 1.582 . . . . 75.230000000000004 107.194 168.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -145.65 158.2 43.88 Favored 'General case' 0 CA--C 1.51 -0.562 0 C-N-CA 125.898 1.679 . . . . 60.340000000000003 108.05 -175.004 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -59.85 -42.52 93.83 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 118.577 0.626 . . . . 51.329999999999998 111.596 -178.466 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.92 -39.41 72.72 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.021 0.373 . . . . 75.430000000000007 111.128 176.723 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 53.7 m -59.81 -48.18 82.71 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.197 0.999 . . . . 75.200000000000003 110.819 177.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 64.6 mt -63.34 -50.41 78.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 108.447 -0.945 . . . . 73.129999999999995 108.447 -177.766 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.97 -40.44 97.73 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 120.703 -0.399 . . . . 74.25 110.071 -176.479 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.8 -54.82 41.82 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 118.156 -0.926 . . . . 71.030000000000001 110.37 176.324 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.21 -56.58 12.1 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 118.937 0.789 . . . . 73.209999999999994 111.698 -176.737 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 8.9 ptp -66.09 -26.88 67.68 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 119.468 -0.893 . . . . 61.119999999999997 111.603 -173.15 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 59.7 t -78.9 -51.99 16.07 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 O-C-N 121.089 -1.007 . . . . 75.340000000000003 110.432 176.646 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -61.1 -31.46 71.15 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.594 1.158 . . . . 73.310000000000002 112.305 -162.489 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 18.1 mt -75.63 1.1 15.36 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.57 1.548 . . . . 74.140000000000001 112.894 -177.815 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 30.4 ttt180 -50.89 -45.81 60.3 Favored 'General case' 0 C--N 1.34 0.195 0 C-N-CA 124.433 1.093 . . . . 60.310000000000002 111.008 177.645 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -56.21 -61.61 2.28 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.707 0.803 . . . . 71.049999999999997 110.961 174.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 10.9 m -49.26 -37.35 23.26 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 127.265 2.226 . . . . 75.219999999999999 111.993 -175.045 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -51.08 -30.7 16.66 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.623 1.169 . . . . 72.329999999999998 113.469 -178.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 34.2 ttp180 -69.2 -60.3 2.44 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 108.582 -0.896 . . . . 74.310000000000002 108.582 174.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 11.8 mp0 -55.52 -35.1 65.28 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 118.002 -0.999 . . . . 63.329999999999998 110.651 -173.207 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -50.63 -45.77 57.89 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-O 118.409 -0.805 . . . . 72.340000000000003 112.483 -178.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 45.7 mm -63.77 -46.37 94.66 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-N 119.33 0.968 . . . . 62.149999999999999 109.72 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 32.4 mt -70.11 -12.03 15.62 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 124.614 1.166 . . . . 74.519999999999996 109.452 179.399 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 13.1 t -108.21 10.2 27.93 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.93 1.692 . . . . 41.030000000000001 109.154 179.304 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -112.81 12.53 19.54 Favored 'General case' 0 C--O 1.232 0.162 0 O-C-N 119.93 -1.732 . . . . 72.329999999999998 109.941 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 31.8 mt . . . . . 0 C--O 1.251 1.163 0 N-CA-C 107.704 -1.221 . . . . 72.450000000000003 107.704 -178.619 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ttm . . . . . 0 N--CA 1.474 0.764 0 N-CA-C 107.649 -1.241 . . . . 64.329999999999998 107.649 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -61.16 158.53 13.7 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 119.792 1.178 . . . . 74.409999999999997 108.994 158.435 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 26.1 m 72.1 158.41 0.2 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.938 1.295 . . . . 53.140000000000001 111.309 172.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.24 169.6 16.75 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.281 -0.887 . . . . 72.420000000000002 112.371 -166.13 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -70.16 97.7 1.24 Allowed 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 108.798 -0.816 . . . . 74.030000000000001 108.798 171.329 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -62.25 -43.76 98.1 Favored 'General case' 0 C--N 1.333 -0.152 0 C-N-CA 125.651 1.58 . . . . 62.140000000000001 111.261 177.239 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 19.4 mmt180 -91.54 128.77 37.5 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 125.197 1.399 . . . . 73.010000000000005 108.957 177.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -67.63 165.66 16.6 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-O 122.267 1.032 . . . . 75.450000000000003 111.054 175.023 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 49.9 mtm-85 -72.2 175.59 5.92 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.21 1.804 . . . . 71.310000000000002 109.845 172.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -170.71 84.06 0.1 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 126.129 1.772 . . . . 61.43 109.4 169.286 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.14 -3.48 20.24 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 116.256 1.947 . . . . 61.310000000000002 116.256 177.38 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -61.96 119.58 9.12 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.984 0.914 . . . . 73.219999999999999 110.679 -177.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 56.06 -22.4 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 130.447 3.499 . . . . 42.539999999999999 116.883 -174.229 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 32.6 mmtt -50.01 -28.86 7.59 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 128.754 2.822 . . . . 63.229999999999997 113.37 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.49 -25.31 64.34 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 113.014 0.746 . . . . 72.129999999999995 113.014 -176.076 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.39 -8.13 43.82 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.152 0.797 . . . . 71.219999999999999 113.152 176.157 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 13.3 t-80 -145.06 -171.39 3.64 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 125.96 1.704 . . . . 74.040000000000006 108.03 -160.301 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 58.3 -164.19 0.19 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.228 1.411 . . . . 60.299999999999997 110.365 170.228 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -143.44 -39.18 0.32 Allowed 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.847 1.259 . . . . 63.020000000000003 110.756 167.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -54.67 -43.67 72.62 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 119.554 1.07 . . . . 64.239999999999995 111.586 -172.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 80.4 mt -75.1 -33.89 61.68 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 123.872 0.869 . . . . 74.439999999999998 112.444 177.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -69.93 -36.8 75.62 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.343 1.457 . . . . 72.099999999999994 110.698 -177.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -46.13 -35.96 5.47 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 128.458 2.703 . . . . 60.240000000000002 113.76 -173.06 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.09 -53.44 57.78 Favored 'General case' 0 C--O 1.225 -0.212 0 O-C-N 120.652 -1.28 . . . . 73.299999999999997 111.138 175.685 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.74 -39.41 84.25 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 118.985 0.811 . . . . 73.030000000000001 111.884 178.172 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -50.94 -37.57 45.15 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.73 1.212 . . . . 74.5 110.814 -176.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -110.08 -85.34 0.55 Allowed 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.607 -0.886 . . . . 74.540000000000006 108.607 178.767 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 50.37 -12.95 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 129.128 2.971 . . . . 73.239999999999995 117.414 -173.375 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 30.7 mtm180 -44.45 -48.59 9.99 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 126.958 2.103 . . . . 74.109999999999999 113.186 -158.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -100.25 -24.3 14.59 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 122.456 0.302 . . . . 62.119999999999997 111.257 -177.254 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -7.89 1.06 Allowed 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 126.949 2.1 . . . . 75.150000000000006 114.225 -173.126 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.415 ' H ' HD23 ' A' ' 32' ' ' LEU . 2.4 pt? -120.72 -15.16 8.45 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 119.872 1.215 . . . . 62.399999999999999 112.919 -178.424 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 12.3 tp -60.56 -21.14 62.23 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 127.707 2.403 . . . . 55.219999999999999 111.891 172.254 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -70.22 -42.29 66.87 Favored Glycine 0 C--O 1.224 -0.499 0 N-CA-C 110.48 -1.048 . . . . 61.039999999999999 110.48 175.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -61.82 -39.35 91.47 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.548 1.174 . . . . 71.219999999999999 110.663 179.193 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 36.1 t90 -55.03 -63.47 1.14 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.627 0.771 . . . . 75.140000000000001 109.375 172.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.83 -29.4 69.86 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.069 0.948 . . . . 54.350000000000001 113.337 -173.27 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -55.59 -54.46 43.82 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 124.317 1.047 . . . . 60.420000000000002 110.136 -177.011 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -67.37 -5.83 37.67 Favored Glycine 0 CA--C 1.532 1.117 0 CA-C-O 119.032 -0.871 . . . . 73.239999999999995 113.687 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 35.8 mt -90.93 -37.06 13.76 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 119.339 1.57 . . . . 63.020000000000003 110.42 171.376 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.416 HD23 ' HE2' ' A' ' 79' ' ' LYS . 47.2 mt -91.36 8.79 34.43 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.58 1.952 . . . . 73.150000000000006 113.163 -173.79 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 75.65 5.25 78.13 Favored Glycine 0 CA--C 1.527 0.786 0 CA-C-O 119.274 -0.737 . . . . 41.549999999999997 113.0 -177.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.1 mttm -78.91 119.66 22.41 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 119.072 1.436 . . . . 64.040000000000006 107.125 -179.311 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 67.1 p -135.29 175.95 9.12 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 107.789 -1.189 . . . . 64.140000000000001 107.789 159.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 58.12 -145.25 41.26 Favored Glycine 0 CA--C 1.532 1.096 0 N-CA-C 111.571 -0.612 . . . . 60.409999999999997 111.571 -172.69 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -58.0 -31.32 66.84 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.312 1.045 . . . . 72.340000000000003 111.348 -172.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -63.57 -42.86 98.29 Favored 'General case' 0 C--O 1.225 -0.224 0 C-N-CA 123.8 0.84 . . . . 73.030000000000001 110.966 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.3 -41.54 69.81 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.856 -0.794 . . . . 71.439999999999998 108.856 177.299 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.8 ptt-85 -73.07 -41.64 63.91 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 119.368 -0.933 . . . . 73.439999999999998 108.928 -169.088 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.18 -42.33 99.36 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 123.517 0.727 . . . . 74.129999999999995 110.958 176.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -58.1 -46.09 86.1 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.3 0.5 . . . . 75.329999999999998 110.318 173.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.97 -12.93 5.15 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.541 1.136 . . . . 75.230000000000004 113.226 176.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 56.3 mt -101.6 1.44 37.82 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.759 1.624 . . . . 75.349999999999994 112.63 -177.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.8 t -125.23 -9.77 7.02 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 119.501 1.046 . . . . 75.150000000000006 112.502 176.235 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 12.3 m -70.71 84.39 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 C-N-CA 126.13 1.772 . . . . 64.230000000000004 111.756 175.016 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 2.9 p -139.99 132.98 35.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 O-C-N 121.167 -0.958 . . . . 61.32 111.804 151.017 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.1 t -148.47 -164.86 2.12 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 106.058 -1.83 . . . . 74.310000000000002 106.058 162.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.25 -163.66 0.39 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.435 1.494 . . . . 75.129999999999995 112.303 -178.892 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -138.76 173.18 11.85 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.532 1.133 . . . . 72.519999999999996 109.289 157.058 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -65.53 -85.43 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.253 1.821 . . . . 74.540000000000006 110.65 -175.579 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 11.9 t0 72.37 0.63 3.66 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 127.531 2.332 . . . . 64.519999999999996 113.06 -172.451 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -151.25 161.2 30.44 Favored Pre-proline 0 CA--C 1.544 0.745 0 C-N-CA 125.655 1.582 . . . . 62.530000000000001 109.929 177.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -88.62 64.77 3.0 Favored 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 123.154 2.57 . . . . 55.100000000000001 111.022 -167.534 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -169.47 -140.7 3.03 Favored Glycine 0 CA--C 1.522 0.48 0 N-CA-C 110.213 -1.155 . . . . 40.0 110.213 -176.113 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 3.0 t70 46.2 45.43 12.85 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 130.502 3.521 . . . . 53.210000000000001 115.239 173.1 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 81.9 mt-10 -65.56 61.74 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 125.934 1.694 . . . . 75.129999999999995 112.055 173.817 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -135.95 -40.32 0.68 Allowed 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 126.575 1.95 . . . . 72.319999999999993 109.665 168.267 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.3 p -60.22 -44.93 96.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-N 119.543 1.065 . . . . 72.439999999999998 111.198 179.178 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -62.08 -21.07 64.65 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 121.062 -1.024 . . . . 63.509999999999998 113.492 177.883 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -53.56 -38.85 64.25 Favored 'General case' 0 C--N 1.343 0.287 0 CA-C-N 119.124 0.875 . . . . 73.239999999999995 110.949 -174.602 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -66.96 -31.62 72.31 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.612 -0.514 . . . . 73.519999999999996 109.612 -171.12 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -78.2 -51.18 10.59 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-O 118.487 -0.768 . . . . 74.439999999999998 109.12 169.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.58 -40.83 72.53 Favored 'General case' 0 C--N 1.334 -0.107 0 C-N-CA 125.074 1.35 . . . . 74.25 113.214 -171.256 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.81 -17.07 62.18 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.355 1.062 . . . . 73.420000000000002 112.503 179.159 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -97.95 -55.02 2.91 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 108.782 -0.821 . . . . 74.519999999999996 108.782 -178.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.7 mt -78.71 40.4 0.38 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 127.43 2.292 . . . . 74.409999999999997 111.055 170.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -57.97 113.07 1.72 Allowed 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.836 1.254 . . . . 73.239999999999995 108.312 175.04 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 75.31 12.05 83.81 Favored Glycine 0 CA--C 1.528 0.884 0 C-N-CA 124.708 1.147 . . . . 52.219999999999999 112.949 -178.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.416 ' HE2' HD23 ' A' ' 41' ' ' LEU . 25.4 mtpp -133.02 -8.63 3.05 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.013 1.325 . . . . 74.239999999999995 112.153 -172.596 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -157.69 114.83 2.98 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.883 1.273 . . . . 73.140000000000001 108.25 163.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -67.44 170.65 7.1 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 124.72 1.208 . . . . 63.509999999999998 110.912 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -47.42 -55.74 8.36 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.123 1.769 . . . . 75.439999999999998 110.12 166.261 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -69.84 -30.48 67.99 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 122.967 0.507 . . . . 75.439999999999998 111.119 -176.504 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 30.5 m -65.09 -53.63 42.43 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 109.268 -0.642 . . . . 71.219999999999999 109.268 176.312 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 41.2 mt -61.74 -52.46 60.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 CA-C-N 119.575 1.079 . . . . 75.140000000000001 109.017 -178.324 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.04 -23.41 67.43 Favored 'General case' 0 C--N 1.34 0.157 0 N-CA-C 111.849 0.314 . . . . 75.120000000000005 111.849 -175.577 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.42 -54.73 5.21 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 108.717 -0.845 . . . . 35.530000000000001 108.717 174.02 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.9 tppm? -54.56 -57.1 12.73 Favored 'General case' 0 CA--C 1.512 -0.518 0 C-N-CA 125.948 1.699 . . . . 44.100000000000001 112.136 -171.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 5.2 ptm -59.56 -26.93 65.79 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 120.067 -0.653 . . . . 64.5 111.237 -175.147 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 59.7 t -88.25 -27.08 5.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 125.625 1.57 . . . . 64.530000000000001 111.832 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -55.52 -57.82 10.34 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 126.342 1.857 . . . . 73.099999999999994 108.053 172.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.2 pp -80.8 11.58 3.81 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.912 1.685 . . . . 73.219999999999999 113.275 -172.327 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -53.37 -50.99 63.91 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 120.945 -1.097 . . . . 74.219999999999999 110.971 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.99 -45.41 85.73 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.232 0.539 . . . . 75.439999999999998 110.694 175.181 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.9 m -50.92 -35.92 35.72 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.625 1.57 . . . . 51.130000000000003 111.517 -178.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -47.79 -45.57 29.61 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.26 1.424 . . . . 74.019999999999996 113.547 177.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -78.86 -43.44 25.08 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.807 1.185 . . . . 60.299999999999997 111.038 174.274 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.14 -31.91 67.65 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 124.434 1.094 . . . . 54.5 112.538 -175.131 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -61.73 -24.48 66.83 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.338 0.972 . . . . 71.319999999999993 112.448 177.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 26.7 mm -81.77 -38.38 15.92 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 C-N-CA 124.106 0.962 . . . . 43.119999999999997 110.03 175.354 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 23.0 mm -59.41 -27.17 36.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 123.733 0.813 . . . . 61.299999999999997 109.648 174.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.63 -17.41 61.67 Favored 'General case' 0 N--CA 1.44 -0.928 0 C-N-CA 125.889 1.675 . . . . 51.229999999999997 112.021 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -139.37 62.23 1.53 Allowed 'General case' 0 C--O 1.237 0.422 0 N-CA-C 106.403 -1.702 . . . . 60.0 106.403 -175.494 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 95.8 mt . . . . . 0 C--O 1.255 1.383 0 N-CA-C 107.089 -1.448 . . . . 71.010000000000005 107.089 162.582 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.483 1.203 0 CA-C-O 121.735 0.779 . . . . 75.409999999999997 110.021 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.5 p -155.36 -57.67 0.1 Allowed 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 125.246 1.418 . . . . 72.430000000000007 108.395 -149.241 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 64.06 15.92 9.59 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.334 1.454 . . . . 64.129999999999995 114.069 171.14 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -84.98 80.01 9.44 Favored 'General case' 0 C--O 1.237 0.407 0 O-C-N 120.501 -1.374 . . . . 53.43 108.891 168.368 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 50.71 -168.15 0.03 OUTLIER 'General case' 0 C--O 1.236 0.386 0 C-N-CA 128.11 2.564 . . . . 75.230000000000004 112.042 -175.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -176.49 -164.93 0.12 Allowed 'General case' 0 C--O 1.238 0.482 0 C-N-CA 129.232 3.013 . . . . 60.299999999999997 107.228 159.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 43.9 mtm180 -110.19 -172.28 2.0 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 127.023 2.129 . . . . 72.340000000000003 110.788 -166.008 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -137.78 -66.67 0.5 Allowed 'General case' 0 CA--C 1.523 -0.079 0 O-C-N 120.933 -1.104 . . . . 73.530000000000001 110.865 178.395 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 35.5 mtp180 -83.63 -27.69 28.97 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.858 0.361 . . . . 64.409999999999997 111.398 -160.625 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.99 34.67 0.36 Allowed 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 125.379 1.472 . . . . 74.140000000000001 112.372 -169.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' HIS . . . . . 0.466 ' HA ' HD13 ' A' ' 21' ' ' LEU . 0.4 OUTLIER -69.82 10.14 0.43 Allowed 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.882 1.068 . . . . 74.099999999999994 113.882 173.461 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -50.1 109.26 0.28 Allowed 'General case' 0 C--O 1.238 0.451 0 C-N-CA 126.635 1.974 . . . . 74.200000000000003 109.708 175.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 48.43 33.58 4.06 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 126.969 2.108 . . . . 75.319999999999993 113.759 -175.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 26.2 mttt -114.4 -10.3 12.65 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.346 1.059 . . . . 71.230000000000004 113.175 174.403 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -66.15 -21.51 66.34 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 119.311 0.959 . . . . 75.530000000000001 112.863 -171.222 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -122.67 72.55 1.08 Allowed 'General case' 0 C--O 1.232 0.155 0 N-CA-C 107.261 -1.385 . . . . 63.310000000000002 107.261 162.186 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -164.44 -46.98 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.031 0.932 . . . . 74.219999999999999 110.48 173.627 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.58 161.27 13.71 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 121.52 -0.737 . . . . 64.530000000000001 111.488 -167.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -93.8 -38.67 11.14 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.199 0.999 . . . . 73.239999999999995 109.576 162.323 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -44.76 -62.14 1.32 Allowed 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.295 1.438 . . . . 73.540000000000006 111.041 -175.521 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.466 HD13 ' HA ' ' A' ' 11' ' ' HIS . 13.4 mt -84.31 -29.5 26.32 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 125.38 1.472 . . . . 51.109999999999999 110.735 -172.501 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 51.4 t30 -69.55 -21.45 63.63 Favored 'General case' 0 C--O 1.216 -0.689 0 CA-C-O 117.88 -1.057 . . . . 73.540000000000006 111.837 176.146 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -48.2 -55.24 10.94 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 120.214 1.37 . . . . 74.519999999999996 111.174 -170.843 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.5 pttm -56.44 -53.3 59.04 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 121.131 -0.981 . . . . 74.129999999999995 111.242 173.091 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.84 -11.51 27.92 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.306 1.042 . . . . 74.420000000000002 113.684 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -87.84 -14.45 39.47 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 120.545 -1.347 . . . . 75.120000000000005 110.469 176.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -153.81 92.12 1.53 Allowed 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.355 1.062 . . . . 72.400000000000006 110.416 178.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.743 ' HD3' ' HB1' ' A' ' 96' ' ' ALA . 0.0 OUTLIER -118.62 -17.51 9.26 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-O 118.389 -0.815 . . . . 64.310000000000002 111.903 169.16 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.74 -35.79 33.27 Favored 'General case' 0 C--N 1.342 0.257 0 CA-C-N 119.974 1.261 . . . . 75.140000000000001 113.344 -173.495 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -83.53 -22.02 32.54 Favored 'General case' 0 C--O 1.223 -0.309 0 CA-C-O 118.028 -0.987 . . . . 75.540000000000006 113.629 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.561 ' HD3' HD12 ' A' ' 32' ' ' LEU . 0.1 OUTLIER -64.02 -54.76 29.28 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 120.541 1.518 . . . . 73.239999999999995 109.778 166.94 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.561 HD12 ' HD3' ' A' ' 31' ' ' ARG . 3.0 mp -68.73 -24.77 64.51 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.596 0.758 . . . . 73.510000000000005 110.443 -167.761 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 mt -46.14 -38.51 8.28 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.664 1.185 . . . . 72.5 111.569 167.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -69.54 -40.17 78.46 Favored Glycine 0 C--N 1.34 0.774 0 O-C-N 121.419 -0.8 . . . . 73.129999999999995 112.465 177.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -64.2 -30.02 71.1 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 118.537 1.168 . . . . 74.420000000000002 111.667 -177.725 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 20.5 t90 -61.51 -77.24 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 108.421 -0.955 . . . . 75.099999999999994 108.421 166.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.72 -30.76 63.84 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.015 1.326 . . . . 71.129999999999995 113.867 -166.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.39 -54.99 24.77 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 123.943 0.897 . . . . 71.409999999999997 109.743 171.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -55.1 -45.45 81.94 Favored Glycine 0 CA--C 1.522 0.476 0 C-N-CA 124.195 0.902 . . . . 52.119999999999997 111.746 -178.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 9.0 mp -54.68 -41.89 70.75 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 125.695 1.598 . . . . 63.299999999999997 110.937 177.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.456 HD23 ' HE3' ' A' ' 79' ' ' LYS . 51.5 mt -87.87 6.03 37.49 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 126.303 1.841 . . . . 75.540000000000006 112.177 -178.336 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 73.51 15.47 79.14 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-O 119.108 -0.829 . . . . 50.009999999999998 112.83 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 52.2 mttt -89.07 127.3 35.69 Favored 'General case' 0 CA--C 1.519 -0.231 0 N-CA-C 106.443 -1.688 . . . . 72.239999999999995 106.443 174.105 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.3 p -141.28 169.72 17.08 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.684 -0.858 . . . . 73.420000000000002 108.684 177.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 55.94 -130.2 48.53 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 110.23 -1.148 . . . . 75.530000000000001 110.23 179.426 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.88 -29.16 66.3 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 112.174 0.435 . . . . 74.319999999999993 112.174 -174.355 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.62 -33.38 75.79 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 121.234 -0.916 . . . . 74.329999999999998 110.031 177.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.36 -40.44 62.13 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.488 0.715 . . . . 75.540000000000006 109.718 177.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.0 ptp180 -67.23 -44.24 79.98 Favored 'General case' 0 C--O 1.227 -0.124 0 N-CA-C 109.765 -0.458 . . . . 63.399999999999999 109.765 -178.096 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.59 -43.79 84.89 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 125.983 1.713 . . . . 75.510000000000005 110.131 176.278 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -60.85 -47.95 84.04 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 122.78 0.432 . . . . 64.200000000000003 111.299 173.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.46 -16.14 44.22 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.352 -0.842 . . . . 75.430000000000007 112.932 -176.737 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 50.1 mt -61.87 -11.37 12.55 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 119.462 1.028 . . . . 75.519999999999996 113.732 178.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 8.9 t -132.52 -3.17 3.37 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 120.351 1.432 . . . . 75.329999999999998 112.831 -172.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 6.0 p -80.05 11.45 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.932 0 O-C-N 120.668 -1.27 . . . . 64.420000000000002 113.107 -171.505 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 2.1 p -115.8 120.7 65.56 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.173 0 O-C-N 120.666 -1.271 . . . . 74.400000000000006 110.605 -164.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.405 HG23 HG22 ' A' ' 68' ' ' VAL . 5.9 t -161.98 -178.35 6.38 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 130.372 3.469 . . . . 63.140000000000001 105.615 -176.003 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.5 m -161.67 112.06 1.63 Allowed 'General case' 0 CA--C 1.532 0.278 0 O-C-N 120.244 -1.535 . . . . 72.530000000000001 110.384 170.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.467 ' H ' HG21 ' A' ' 68' ' ' VAL . 0.2 OUTLIER -155.8 126.35 6.8 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 104.318 -2.475 . . . . 75.239999999999995 104.318 168.366 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -164.61 -171.92 2.49 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 119.972 1.26 . . . . 75.239999999999995 108.346 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 4.3 t70 75.85 32.77 0.64 Allowed 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 127.272 2.229 . . . . 75.519999999999996 110.23 -178.179 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . 0.279 17.3 pt-20 46.19 71.7 1.48 Allowed Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 129.623 3.169 . . . . 71.409999999999997 111.353 -171.381 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -90.74 -2.3 5.02 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 124.068 3.179 . . . . 75.120000000000005 113.878 -171.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -178.01 -93.92 0.09 OUTLIER Glycine 0 C--N 1.335 0.498 0 CA-C-N 119.641 1.11 . . . . 55.219999999999999 110.483 -178.118 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -128.95 -78.24 0.56 Allowed 'General case' 0 N--CA 1.457 -0.122 0 N-CA-C 105.996 -1.853 . . . . 61.310000000000002 105.996 -166.452 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.4 pt-20 -156.68 144.6 19.4 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 127.802 2.441 . . . . 64.340000000000003 107.508 170.182 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -148.67 -71.39 0.2 Allowed 'General case' 0 C--O 1.233 0.192 0 O-C-N 121.156 -0.965 . . . . 62.409999999999997 110.848 -173.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.467 HG21 ' H ' ' A' ' 59' ' ' ASP . 54.9 t -83.51 -35.82 11.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 109.05 -0.722 . . . . 64.310000000000002 109.05 177.029 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -58.85 -44.62 91.02 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-O 117.958 -1.02 . . . . 74.540000000000006 109.308 169.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.405 ' CZ ' ' HE3' ' A' ' 71' ' ' LYS . 34.2 ttp85 -45.68 -58.47 3.42 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.684 0.794 . . . . 75.519999999999996 111.57 -177.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.405 ' HE3' ' CZ ' ' A' ' 70' ' ' ARG . 1.0 OUTLIER -69.83 -40.1 76.07 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 118.38 -0.819 . . . . 75.239999999999995 111.44 -175.831 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 38.6 mt -64.88 -48.06 75.62 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-N 119.2 0.909 . . . . 61.509999999999998 110.695 -179.438 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.73 -28.71 67.06 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 124.961 1.304 . . . . 74.5 111.816 -179.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.99 -47.88 67.31 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 118.899 0.772 . . . . 62.210000000000001 110.659 172.233 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.55 -55.26 18.74 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 107.738 -1.208 . . . . 71.299999999999997 107.738 -178.774 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 87.0 mt -87.18 34.57 0.69 Allowed 'General case' 0 C--O 1.233 0.222 0 C-N-CA 127.416 2.286 . . . . 74.239999999999995 111.907 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -53.24 115.37 1.86 Allowed 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 107.251 -1.388 . . . . 75.319999999999993 107.251 171.023 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 87.37 4.24 80.87 Favored Glycine 0 CA--C 1.532 1.102 0 C-N-CA 124.929 1.252 . . . . 35.210000000000001 114.163 176.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.456 ' HE3' HD23 ' A' ' 41' ' ' LEU . 28.9 mtmm -133.64 5.34 3.68 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 125.134 1.374 . . . . 73.519999999999996 112.416 -174.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -144.62 177.73 8.48 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.052 1.341 . . . . 74.230000000000004 108.91 170.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -143.51 164.74 29.5 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 126.754 2.022 . . . . 75.400000000000006 107.319 177.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -58.93 -54.81 42.95 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 124.085 0.954 . . . . 71.540000000000006 110.666 176.264 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -71.96 -11.77 60.93 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 122.978 0.511 . . . . 74.140000000000001 111.943 -178.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 54.3 m -84.09 -52.07 6.58 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 108.498 -0.927 . . . . 41.299999999999997 108.498 174.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 71.8 mt -55.77 -46.65 79.86 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 120.23 1.377 . . . . 74.530000000000001 109.068 178.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.46 -28.92 60.95 Favored 'General case' 0 C--N 1.344 0.347 0 N-CA-C 112.55 0.574 . . . . 63.399999999999999 112.55 -177.527 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.3 -44.47 12.83 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 124.121 0.969 . . . . 73.310000000000002 109.952 176.263 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 6.3 tptt -66.59 -48.82 68.36 Favored 'General case' 0 CA--C 1.521 -0.149 0 C-N-CA 125.98 1.712 . . . . 72.319999999999993 111.738 -166.623 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.44 -29.02 69.66 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.13 0.877 . . . . 72.430000000000007 111.183 -178.491 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 57.1 t -72.92 -31.12 34.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 123.805 0.842 . . . . 54.100000000000001 110.562 174.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.06 -53.75 54.08 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 126.981 2.112 . . . . 72.109999999999999 112.946 -162.717 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -67.24 22.82 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 127.988 2.515 . . . . 63.509999999999998 113.88 -171.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 6.7 ppt_? -65.3 -25.68 67.73 Favored 'General case' 0 N--CA 1.466 0.368 0 O-C-N 120.139 -1.601 . . . . 74.400000000000006 113.58 -169.176 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.85 -47.19 9.25 Favored 'General case' 0 C--N 1.332 -0.172 0 O-C-N 121.026 -1.047 . . . . 74.109999999999999 109.044 178.254 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.8 m -55.14 -29.66 58.22 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.79 1.236 . . . . 65.400000000000006 110.891 175.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.743 ' HB1' ' HD3' ' A' ' 28' ' ' ARG . . . -56.59 -45.54 81.34 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.826 1.25 . . . . 32.219999999999999 112.49 173.169 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 26.1 ttt-85 -63.36 -51.83 64.29 Favored 'General case' 0 CA--C 1.517 -0.292 0 O-C-N 120.828 -1.17 . . . . 73.519999999999996 108.663 175.575 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.62 -55.41 32.38 Favored 'General case' 0 N--CA 1.444 -0.754 0 O-C-N 125.022 1.451 . . . . 74.319999999999993 110.669 -168.478 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -57.51 -42.28 82.5 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-O 118.732 -0.652 . . . . 74.420000000000002 112.427 -174.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 39.4 mm -64.25 -39.75 86.62 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-N 119.903 1.229 . . . . 53.039999999999999 110.541 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 61.8 mt -71.37 -11.74 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 O-C-N 121.5 -0.75 . . . . 71.400000000000006 109.355 178.173 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.16 4.91 34.57 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.26 1.424 . . . . 74.200000000000003 111.579 176.009 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 80.5 mt-10 -124.52 29.18 6.37 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 125.198 1.399 . . . . 75.430000000000007 108.791 -174.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.6 mm . . . . . 0 C--O 1.251 1.163 0 N-CA-C 105.54 -2.022 . . . . 74.239999999999995 105.54 169.532 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.4 ptt? . . . . . 0 N--CA 1.476 0.872 0 CA-C-O 118.894 -0.574 . . . . 73.319999999999993 109.727 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.6 m 60.97 68.02 0.77 Allowed 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.151 1.38 . . . . 65.219999999999999 109.442 174.08 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 12.5 t -144.68 144.57 31.29 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 106.313 -1.736 . . . . 72.450000000000003 106.313 173.389 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 18.6 p90 -80.3 176.08 10.08 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.101 -1.074 . . . . 62.229999999999997 108.101 152.155 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.9 t0 174.67 -55.21 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 129.237 3.015 . . . . 74.340000000000003 104.743 171.23 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -60.28 -51.99 67.19 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 128.599 2.759 . . . . 70.540000000000006 112.588 173.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.9 ptp180 -83.73 126.99 33.46 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.035 -1.098 . . . . 74.340000000000003 108.035 -171.748 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -89.03 178.78 6.31 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 124.667 1.187 . . . . 71.150000000000006 108.939 175.236 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 23.2 mtm105 -61.9 169.35 2.63 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 122.446 1.117 . . . . 74.239999999999995 111.023 171.088 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -91.51 18.15 7.71 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.904 -1.044 . . . . 71.209999999999994 113.393 -166.111 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . 0.32 0.1 OUTLIER 43.82 16.61 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 130.846 3.659 . . . . 73.510000000000005 113.467 -168.005 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.9 114.1 14.14 Favored 'General case' 0 N--CA 1.444 -0.759 0 O-C-N 119.751 -1.843 . . . . 73.129999999999995 108.061 -171.909 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 60.81 31.67 20.07 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.896 2.078 . . . . 65.420000000000002 114.862 -174.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -100.11 -25.33 14.32 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 115.429 1.64 . . . . 74.129999999999995 115.429 -177.392 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -74.99 0.32 16.25 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 114.705 1.372 . . . . 73.530000000000001 114.705 -166.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -113.11 25.47 11.34 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.577 1.081 . . . . 65.510000000000005 110.085 173.549 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -151.38 174.65 13.09 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 124.925 1.29 . . . . 64.409999999999997 108.656 -179.422 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 60.85 -160.11 0.31 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.635 1.174 . . . . 74.319999999999993 108.852 171.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -137.11 -35.81 0.68 Allowed 'General case' 0 C--N 1.332 -0.173 0 O-C-N 120.375 -1.453 . . . . 73.109999999999999 111.237 161.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -47.83 -54.44 12.45 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.245 1.018 . . . . 74.430000000000007 112.712 -170.557 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.4 mt -77.74 -29.91 51.33 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.852 -0.53 . . . . 61.329999999999998 111.739 -172.245 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -63.52 -49.48 73.34 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 108.974 -0.75 . . . . 74.340000000000003 108.974 174.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -55.7 -39.5 71.12 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.949 0.899 . . . . 70.519999999999996 110.934 -178.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -44.8 -48.36 10.95 Favored 'General case' 0 C--N 1.344 0.336 0 C-N-CA 124.281 1.032 . . . . 61.100000000000001 111.777 173.664 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.433 ' HB1' ' HA ' ' A' ' 97' ' ' ARG . . . -64.72 -49.15 71.99 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.565 1.146 . . . . 74.129999999999995 111.441 -178.266 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -71.0 -18.09 62.61 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 121.975 -0.453 . . . . 71.510000000000005 110.982 -176.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -113.37 55.06 0.72 Allowed 'General case' 0 C--O 1.237 0.41 0 C-N-CA 125.265 1.426 . . . . 74.200000000000003 109.025 -176.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.4 mmt-85 -121.97 -7.66 8.91 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 126.048 1.739 . . . . 53.009999999999998 112.261 172.069 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 36.8 mtm-85 -53.38 -53.85 45.24 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 119.599 1.091 . . . . 71.430000000000007 112.192 -168.24 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -82.34 -15.23 53.6 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.501 -0.75 . . . . 74.430000000000007 112.604 -167.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.83 -14.21 59.65 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 119.033 0.833 . . . . 61.420000000000002 112.808 -169.013 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -127.83 3.65 6.02 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.973 2.109 . . . . 54.399999999999999 112.027 -171.334 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 56.7 tp -56.41 -30.13 62.41 Favored 'General case' 0 N--CA 1.461 0.1 0 C-N-CA 128.607 2.763 . . . . 72.310000000000002 111.807 174.315 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.403 ' HA3' ' HA ' ' A' ' 52' ' ' ALA . . . -45.8 -46.81 13.81 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 124.791 1.186 . . . . 71.430000000000007 113.016 170.154 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -63.0 -22.49 66.89 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.768 1.227 . . . . 71.230000000000004 111.938 -172.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.438 ' CD2' ' HG2' ' A' ' 88' ' ' LYS . 5.8 t90 -64.07 -72.66 0.14 Allowed 'General case' 0 C--N 1.343 0.307 0 N-CA-C 107.913 -1.143 . . . . 71.239999999999995 107.913 168.882 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.93 -29.2 62.89 Favored 'General case' 0 C--O 1.221 -0.441 0 C-N-CA 126.314 1.846 . . . . 52.240000000000002 112.193 -171.824 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -47.36 -49.27 24.86 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.987 0.812 . . . . 23.510000000000002 111.52 -179.24 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.46 -35.9 91.75 Favored Glycine 0 CA--C 1.534 1.242 0 CA-C-N 118.352 0.523 . . . . 62.219999999999999 112.869 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.413 HD12 ' N ' ' A' ' 40' ' ' LEU . 3.2 mp -64.98 -39.29 93.26 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.649 1.58 . . . . 71.430000000000007 109.339 178.654 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.9 mp -73.04 -9.68 58.98 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 127.324 2.25 . . . . 50.0 112.977 172.569 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 71.44 29.7 67.76 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 125.806 1.67 . . . . 75.209999999999994 112.188 -176.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -111.22 139.06 46.91 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 119.551 1.676 . . . . 62.299999999999997 107.228 170.746 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.1 p -135.73 175.87 9.2 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 107.254 -1.387 . . . . 75.319999999999993 107.254 168.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 60.48 -126.74 41.99 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.487 -1.045 . . . . 72.430000000000007 110.487 173.537 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -78.29 -34.69 48.65 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 123.974 0.91 . . . . 75.409999999999997 110.512 -170.165 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.79 -35.2 79.82 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.773 0.829 . . . . 55.399999999999999 109.621 173.309 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.32 -42.06 69.08 Favored 'General case' 0 C--N 1.339 0.109 0 O-C-N 121.961 -0.462 . . . . 64.510000000000005 111.15 170.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.0 ttm180 -55.79 -47.43 77.12 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.436 0.694 . . . . 62.329999999999998 111.603 -176.309 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.76 -50.6 73.19 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.357 0.526 . . . . 73.129999999999995 110.203 -178.24 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -53.31 -42.78 67.0 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.693 1.197 . . . . 70.430000000000007 111.477 173.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.403 ' HA ' ' HA3' ' A' ' 34' ' ' GLY . . . -60.25 -24.62 65.03 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 124.071 0.948 . . . . 72.319999999999993 113.519 -178.438 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 43.9 mt -84.68 -14.8 47.42 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 118.05 -0.976 . . . . 73.329999999999998 111.977 -171.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 11.7 t -102.77 -28.14 12.27 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 119.989 1.268 . . . . 63.5 112.273 -173.216 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 1.6 p -72.43 96.57 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.325 0 C-N-CA 127.31 2.244 . . . . 64.120000000000005 109.892 172.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 11.0 p -148.97 152.42 12.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 C-N-CA 125.421 1.488 . . . . 73.510000000000005 108.701 152.419 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.449 HG23 HG23 ' A' ' 68' ' ' VAL . 0.1 OUTLIER -149.24 -85.91 0.09 Allowed 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 118.219 -0.896 . . . . 73.340000000000003 108.826 155.836 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.9 t -153.26 -86.42 0.06 Allowed 'General case' 0 C--O 1.226 -0.133 0 CA-C-N 120.012 1.278 . . . . 64.530000000000001 108.367 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -179.81 176.45 0.76 Allowed 'General case' 0 C--O 1.238 0.469 0 N-CA-C 107.405 -1.332 . . . . 70.209999999999994 107.405 -166.492 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.46 ' CZ ' ' HA ' ' A' ' 86' ' ' ARG . 0.1 OUTLIER -103.23 77.46 1.53 Allowed 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 127.09 2.156 . . . . 71.140000000000001 109.102 176.816 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.78 -32.27 70.66 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 119.267 -0.973 . . . . 65.200000000000003 109.995 -179.355 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -148.91 165.1 18.61 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 125.566 1.546 . . . . 65.219999999999999 109.102 173.075 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_endo -71.23 173.01 12.9 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.778 2.985 . . . . 70.230000000000004 112.1 176.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -168.69 -109.62 0.22 Allowed Glycine 0 CA--C 1.524 0.616 0 CA-C-O 119.216 -0.769 . . . . 70.0 111.694 -178.35 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -164.87 88.73 0.47 Allowed 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 126.863 2.065 . . . . 63.329999999999998 105.766 175.186 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 54.23 86.69 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.799 2.04 . . . . 73.099999999999994 112.462 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -121.09 -86.31 0.65 Allowed 'General case' 0 N--CA 1.48 1.051 0 CA-C-O 117.886 -1.054 . . . . 64.209999999999994 111.125 179.239 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.449 HG23 HG23 ' A' ' 57' ' ' THR . 14.1 p -63.06 -32.46 56.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 121.115 1.779 . . . . 73.540000000000006 110.646 178.666 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -78.1 -18.12 56.08 Favored 'General case' 0 C--O 1.221 -0.408 0 N-CA-C 116.084 1.883 . . . . 65.099999999999994 116.084 176.541 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 22.1 ttt180 -55.36 -57.37 12.14 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 122.375 2.352 . . . . 70.200000000000003 114.286 -169.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -74.57 3.33 7.9 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 122.989 0.516 . . . . 65.540000000000006 111.559 -174.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 18.1 tp -112.78 -63.94 1.37 Allowed 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 127.872 2.469 . . . . 65.519999999999996 108.465 -174.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -51.29 -40.37 58.81 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 127.02 2.128 . . . . 73.129999999999995 111.418 177.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -76.27 -27.01 56.5 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 112.87 0.692 . . . . 74.400000000000006 112.87 -179.203 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.55 -9.22 59.5 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.693 0.797 . . . . 65.409999999999997 110.492 172.252 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 69.0 mt -116.48 34.99 4.75 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 128.723 2.809 . . . . 73.109999999999999 110.916 177.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -54.55 110.93 0.7 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.157 1.383 . . . . 53.109999999999999 108.618 176.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 86.2 2.64 85.51 Favored Glycine 0 CA--C 1.529 0.956 0 C-N-CA 125.439 1.495 . . . . 41.030000000000001 114.957 -179.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -127.24 1.25 6.41 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 118.871 1.336 . . . . 74.310000000000002 112.193 -165.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -147.64 -172.85 4.13 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.733 1.213 . . . . 63.43 109.498 172.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.519 ' H ' ' HB ' ' A' ' 84' ' ' THR . 33.0 m-20 -146.84 170.38 17.16 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 126.976 2.11 . . . . 73.109999999999999 105.799 165.668 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -55.13 -47.55 74.89 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.227 1.011 . . . . 61.140000000000001 110.356 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -82.88 -24.21 33.28 Favored 'General case' 0 CA--C 1.534 0.354 0 O-C-N 121.333 -0.854 . . . . 70.510000000000005 111.339 -177.026 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.519 ' HB ' ' H ' ' A' ' 81' ' ' ASP . 79.5 m -64.29 -39.13 93.3 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 120.737 -1.227 . . . . 70.400000000000006 108.909 172.345 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 96.8 mt -61.15 -50.33 80.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 O-C-N 121.116 -0.99 . . . . 50.119999999999997 109.345 173.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.46 ' HA ' ' CZ ' ' A' ' 60' ' ' PHE . 0.0 OUTLIER -64.53 -32.26 73.83 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 118.966 -1.094 . . . . 61.520000000000003 111.087 -174.985 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.09 -53.05 60.87 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 109.203 -0.666 . . . . 73.519999999999996 109.203 172.299 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.438 ' HG2' ' CD2' ' A' ' 36' ' ' TRP . 0.0 OUTLIER -60.66 -44.88 95.94 Favored 'General case' 0 N--CA 1.463 0.178 0 O-C-N 120.956 -1.09 . . . . 74.140000000000001 113.366 -173.101 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 59.7 mtt -59.92 -20.97 60.36 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 118.662 0.665 . . . . 71.430000000000007 111.828 178.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 66.4 t -98.3 -25.51 4.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 125.028 1.331 . . . . 74.439999999999998 110.542 -176.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -60.19 -54.03 50.63 Favored 'General case' 0 N--CA 1.463 0.201 0 O-C-N 120.75 -1.219 . . . . 61.399999999999999 108.56 173.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 4.0 pp -73.97 7.01 2.88 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.45 1.1 . . . . 73.420000000000002 112.85 -178.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 21.5 ttt-85 -56.24 -50.46 71.24 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 120.011 -1.681 . . . . 73.420000000000002 112.692 -176.441 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.34 -31.91 72.98 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 119.409 1.004 . . . . 73.5 112.388 -178.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 73.7 m -47.42 -36.64 10.15 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.284 1.434 . . . . 64.519999999999996 110.147 178.072 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -53.94 -46.65 71.61 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 124.983 1.313 . . . . 51.200000000000003 113.192 -175.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.433 ' HA ' ' HB1' ' A' ' 25' ' ' ALA . 15.6 ptt-85 -82.72 -34.78 27.15 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 120.541 -0.464 . . . . 63.399999999999999 111.364 178.761 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -59.29 -41.24 88.5 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.242 1.017 . . . . 65.439999999999998 109.634 -179.023 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 60.8 mm-40 -50.18 -49.92 50.91 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 126.463 1.905 . . . . 74.099999999999994 112.645 174.534 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 21.6 mm -59.61 -48.31 87.85 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-N 118.925 0.784 . . . . 65.329999999999998 109.047 178.677 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 97.7 mt -68.38 -5.16 4.01 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 C-N-CA 126.846 2.058 . . . . 63.420000000000002 110.888 -178.216 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -103.74 -17.86 14.92 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 125.419 1.488 . . . . 73.099999999999994 111.381 175.849 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -132.55 46.0 2.68 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 125.026 1.331 . . . . 70.400000000000006 109.324 -168.135 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 24.5 mt . . . . . 0 C--O 1.249 1.027 0 C-N-CA 130.277 3.431 . . . . 73.400000000000006 108.197 -176.455 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.7 ptt? . . . . . 0 N--CA 1.473 0.683 0 CA-C-O 118.784 -0.627 . . . . 71.519999999999996 112.447 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.2 t -91.66 -30.14 16.49 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.669 1.122 . . . . 75.129999999999995 109.778 -163.327 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.7 p -88.29 111.41 21.67 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 126.846 2.058 . . . . 74.209999999999994 107.676 174.025 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 35.5 p90 -147.05 176.68 9.75 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.229 1.012 . . . . 72.219999999999999 109.647 176.195 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -135.58 174.8 10.21 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 123.891 0.876 . . . . 73.129999999999995 109.404 175.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -124.08 -36.72 2.65 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 126.252 1.821 . . . . 74.540000000000006 110.806 -174.299 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 18.1 ptt180 -88.93 37.01 0.82 Allowed 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.994 1.27 . . . . 74.239999999999995 110.465 -179.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -118.91 -15.85 9.3 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.245 1.418 . . . . 74.430000000000007 112.752 -169.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 44.6 mtm180 -94.67 163.59 13.31 Favored 'General case' 0 N--CA 1.464 0.268 0 O-C-N 120.378 -1.451 . . . . 74.329999999999998 109.244 156.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -160.41 71.05 0.43 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.406 1.483 . . . . 72.439999999999998 108.705 178.12 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -74.42 10.0 1.49 Allowed 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 115.719 1.748 . . . . 73.209999999999994 115.719 -172.051 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -45.0 -42.75 8.56 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 115.921 1.823 . . . . 72.239999999999995 115.921 -162.414 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -129.12 -1.16 5.17 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.969 1.308 . . . . 62.43 112.096 169.268 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.1 mtpt -63.57 -19.97 65.26 Favored 'General case' 0 C--O 1.223 -0.295 0 O-C-N 121.016 -1.052 . . . . 51.009999999999998 113.634 -171.252 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -49.22 -33.24 12.18 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 127.415 2.286 . . . . 73.299999999999997 114.559 -173.767 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.59 -20.67 63.63 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.154 0.582 . . . . 74.5 112.287 -178.49 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -113.98 -169.18 1.47 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 129.95 3.3 . . . . 70.540000000000006 105.915 178.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 57.94 -169.99 0.11 Allowed 'General case' 0 C--O 1.239 0.515 0 C-N-CA 124.516 1.126 . . . . 73.319999999999993 110.644 177.063 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -143.34 -48.06 0.3 Allowed 'General case' 0 C--N 1.333 -0.146 0 O-C-N 120.4 -1.437 . . . . 53.030000000000001 110.71 171.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 64.3 tt0 -60.55 -32.24 71.31 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.079 0.552 . . . . 72.140000000000001 110.937 -171.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 72.3 mt -71.81 -41.2 68.53 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.225 -0.922 . . . . 73.409999999999997 110.491 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -63.57 -42.72 98.29 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.3 1.04 . . . . 72.120000000000005 110.514 173.018 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -54.53 -41.55 69.83 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.001 0.92 . . . . 75.400000000000006 109.884 174.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.36 -16.66 6.01 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 117.267 -1.349 . . . . 64.219999999999999 114.1 175.452 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -97.01 -32.01 12.22 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 121.145 1.793 . . . . 70.540000000000006 113.642 173.287 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.0 tp10 -46.1 -43.09 14.5 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.805 1.642 . . . . 65.329999999999998 112.035 -176.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -91.42 26.3 2.31 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.046 1.338 . . . . 61.399999999999999 112.277 -167.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 2.8 mmt180 -112.23 2.73 16.75 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 120.569 -1.332 . . . . 73.430000000000007 111.924 177.837 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 19.3 mtt-85 -63.53 -23.92 67.59 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.332 1.423 . . . . 73.120000000000005 112.295 -175.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -135.11 -16.17 1.92 Allowed 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 117.067 -1.444 . . . . 63.530000000000001 114.559 173.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.07 6.88 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 128.112 2.565 . . . . 71.400000000000006 114.578 -173.117 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.443 HD13 HD22 ' A' ' 92' ' ' LEU . 0.3 OUTLIER -137.35 -1.7 2.08 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 127.456 2.302 . . . . 65.129999999999995 110.693 -166.956 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 52.3 tp -66.8 -30.75 71.03 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 127.104 2.162 . . . . 70.329999999999998 110.824 170.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -65.69 -43.8 93.62 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.924 -0.87 . . . . 52.130000000000003 110.924 170.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -65.08 -23.85 67.28 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 118.376 1.088 . . . . 71.519999999999996 111.996 -173.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 22.5 t90 -60.15 -69.28 0.22 Allowed 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 124.415 1.086 . . . . 74.230000000000004 108.97 168.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.0 -40.45 80.75 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 122.954 0.502 . . . . 72.409999999999997 111.699 -177.077 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.26 -54.72 27.7 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.669 1.187 . . . . 61.32 109.908 173.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -64.08 -36.44 93.25 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-N 117.866 0.303 . . . . 25.440000000000001 112.389 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 38.2 mt -62.63 -38.98 92.37 Favored 'General case' 0 C--O 1.233 0.225 0 O-C-N 120.766 -1.432 . . . . 65.439999999999998 110.696 176.277 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 92.5 mt -88.16 6.87 34.51 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 126.951 2.1 . . . . 63.140000000000001 113.282 -178.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 81.82 12.95 80.63 Favored Glycine 0 CA--C 1.531 1.093 0 CA-C-N 119.839 1.2 . . . . 72.099999999999994 113.996 171.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -90.83 149.47 21.95 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 126.026 1.73 . . . . 53.210000000000001 109.888 172.634 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.0 p -148.72 175.71 10.98 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 126.863 2.065 . . . . 71.5 110.054 178.236 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 58.08 -135.51 51.74 Favored Glycine 0 CA--C 1.525 0.667 0 C-N-CA 124.322 0.963 . . . . 71.099999999999994 111.72 172.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -51.62 -46.41 63.62 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.934 1.294 . . . . 73.340000000000003 111.163 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.8 -38.35 87.78 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.325 -0.852 . . . . 72.540000000000006 110.385 -173.647 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.0 -45.09 52.05 Favored 'General case' 0 N--CA 1.455 -0.22 0 O-C-N 121.887 -0.508 . . . . 34.409999999999997 111.075 171.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 52.0 mtm-85 -59.07 -55.23 37.69 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 118.058 -0.972 . . . . 73.430000000000007 112.633 -172.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.18 -34.39 77.92 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 118.331 -0.842 . . . . 52.32 110.196 -172.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -61.82 -45.47 93.69 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-O 121.835 0.826 . . . . 74.430000000000007 109.858 173.435 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.18 -26.61 68.44 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 120.563 -1.336 . . . . 73.420000000000002 113.277 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 41.3 mt -84.22 -12.82 54.16 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.757 1.223 . . . . 75.319999999999993 111.158 177.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 40.9 p -105.27 3.37 29.91 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 119.609 1.095 . . . . 75.400000000000006 111.699 175.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.2 t -118.1 98.68 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 C-N-CA 126.039 1.736 . . . . 72.239999999999995 108.191 -173.333 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 1.9 t -129.65 66.66 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 N-CA-C 107.658 -1.238 . . . . 54.439999999999998 107.658 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.278 6.6 t 51.28 -164.67 0.05 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.199 1.8 . . . . 74.430000000000007 111.425 -178.531 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -165.38 -154.31 0.21 Allowed 'General case' 0 C--O 1.239 0.532 0 C-N-CA 129.253 3.021 . . . . 74.230000000000004 103.411 156.682 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -84.18 -176.82 6.44 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 120.518 1.508 . . . . 42.350000000000001 113.05 177.262 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -145.6 -13.17 0.5 Allowed 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 127.167 2.187 . . . . 74.530000000000001 110.903 175.144 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -68.62 -168.18 0.11 Allowed 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 119.586 1.084 . . . . 75.230000000000004 110.011 165.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 46.98 72.78 1.15 Allowed Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 126.296 1.838 . . . . 74.140000000000001 112.423 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -74.61 158.71 43.47 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 124.991 3.794 . . . . 73.129999999999995 111.987 -172.075 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.04 -5.35 78.7 Favored Glycine 0 CA--C 1.532 1.118 0 C-N-CA 124.491 1.043 . . . . 64.239999999999995 112.601 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -121.09 57.08 1.0 Allowed 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 126.99 2.116 . . . . 75.409999999999997 106.821 -165.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -44.53 102.12 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 130.715 3.606 . . . . 62.149999999999999 109.397 178.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -128.2 -83.6 0.59 Allowed 'General case' 0 N--CA 1.467 0.38 0 O-C-N 121.61 -0.681 . . . . 61.43 110.362 170.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 7.1 p -61.74 -45.7 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 CA-C-N 119.091 0.859 . . . . 72.25 110.276 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.91 -23.05 67.11 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 115.037 1.495 . . . . 75.409999999999997 115.037 170.589 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 75.7 ttt-85 -63.12 -54.29 40.2 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 121.172 1.806 . . . . 70.430000000000007 110.604 -178.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -71.74 9.35 0.9 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.995 0.918 . . . . 63.299999999999997 111.567 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 69.0 mt -132.86 -5.07 3.16 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 124.794 1.238 . . . . 65.219999999999999 114.185 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -100.75 -79.65 0.5 Allowed 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.86 1.264 . . . . 74.310000000000002 108.053 173.385 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.02 -45.73 91.82 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 118.422 0.556 . . . . 65.200000000000003 110.339 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.77 -29.51 66.85 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.078 0.551 . . . . 74.219999999999999 110.858 -175.605 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.4 tp -111.7 19.35 18.14 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 127.085 2.154 . . . . 73.219999999999999 111.213 -166.313 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -44.56 126.82 5.69 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 127.075 2.15 . . . . 65.430000000000007 111.635 -169.39 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 86.54 -12.21 61.7 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 126.231 1.872 . . . . 74.230000000000004 113.579 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 32.2 mtmm -117.31 10.63 13.76 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.689 1.195 . . . . 71.510000000000005 110.445 -175.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -147.03 175.03 11.0 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 126.39 1.876 . . . . 71.340000000000003 110.02 177.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.505 ' H ' ' HB ' ' A' ' 84' ' ' THR . 2.8 m-20 -150.14 172.38 15.38 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 105.617 -1.994 . . . . 63.539999999999999 105.617 154.254 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -55.67 -52.03 65.25 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 124.672 1.189 . . . . 73.120000000000005 109.38 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -66.42 -29.98 70.25 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.821 0.848 . . . . 71.409999999999997 111.036 -178.301 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.505 ' HB ' ' H ' ' A' ' 81' ' ' ASP . 99.0 m -70.19 -44.48 68.6 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 118.541 -0.742 . . . . 65.409999999999997 109.193 -179.205 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 69.7 mt -55.15 -46.48 77.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 CA-C-N 119.829 1.195 . . . . 71.409999999999997 109.616 -175.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.98 -47.97 76.7 Favored 'General case' 0 C--N 1.347 0.496 0 CA-C-O 121.595 0.712 . . . . 72.209999999999994 109.568 -179.508 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -88.01 29.38 0.94 Allowed 'General case' 0 N--CA 1.443 -0.808 0 C-N-CA 125.552 1.541 . . . . 73.310000000000002 111.025 -176.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.31 -48.51 2.88 Favored 'General case' 0 CA--C 1.513 -0.466 0 O-C-N 121.111 -0.993 . . . . 62.539999999999999 109.132 158.349 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 27.0 mtm -57.49 -42.64 83.09 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 117.771 0.26 . . . . 74.340000000000003 111.052 -176.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 27.1 t -79.81 -31.88 13.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 124.347 1.059 . . . . 63.439999999999998 111.957 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -62.18 -24.81 67.41 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.883 1.273 . . . . 71.549999999999997 112.604 -170.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.443 HD22 HD13 ' A' ' 32' ' ' LEU . 20.8 mt -86.84 -1.05 57.48 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 114.941 1.46 . . . . 73.420000000000002 114.941 -165.151 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 73.6 mtp180 -56.45 -50.01 72.94 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 120.306 -1.496 . . . . 71.510000000000005 112.844 -171.432 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.02 -20.39 59.64 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 120.031 1.287 . . . . 62.43 112.105 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.6 m -56.5 -25.35 51.12 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.064 0.847 . . . . 74.420000000000002 110.373 176.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.13 -51.34 69.71 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 114.556 1.317 . . . . 74.430000000000007 114.556 176.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -74.93 -38.22 61.83 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 108.994 -0.743 . . . . 70.409999999999997 108.994 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.2 -53.68 54.28 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 124.955 1.302 . . . . 72.420000000000002 109.454 -175.739 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -58.29 -44.58 88.55 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-O 118.839 -0.601 . . . . 74.219999999999999 112.529 -174.62 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 16.9 mm -65.2 -42.02 93.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 119.079 0.854 . . . . 73.200000000000003 109.003 -178.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 98.0 mt -69.74 -15.71 19.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 N-CA-C 109.479 -0.563 . . . . 74.310000000000002 109.479 177.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -85.78 -11.0 54.62 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 126.012 1.725 . . . . 62.310000000000002 111.225 174.542 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 66.6 mt-10 -129.77 42.03 3.34 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 128.177 2.591 . . . . 61.340000000000003 108.925 -166.023 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 92.7 mt . . . . . 0 C--O 1.255 1.372 0 N-CA-C 108.697 -0.853 . . . . 71.510000000000005 108.697 -177.145 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.9 tpt . . . . . 0 N--CA 1.465 0.3 0 N-CA-C 108.328 -0.99 . . . . 64.109999999999999 108.328 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 14.1 p -65.85 163.09 17.56 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.171 0.588 . . . . 74.519999999999996 110.136 175.306 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 13.4 t -148.86 162.42 39.88 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.473 -0.936 . . . . 73.140000000000001 108.473 170.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -91.05 163.6 14.25 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 107.656 -1.238 . . . . 71.540000000000006 107.656 170.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -70.71 156.1 39.91 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 109.047 -0.723 . . . . 62.420000000000002 109.047 172.022 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -133.45 158.04 44.09 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 125.278 1.431 . . . . 74.549999999999997 109.572 178.707 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 14.6 mmt180 -78.9 80.85 5.23 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 107.717 -1.216 . . . . 74.040000000000006 107.717 177.127 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.423 ' HG2' ' H ' ' A' ' 9' ' ' ARG . 3.8 pt-20 -74.4 -46.5 39.88 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.564 -0.743 . . . . 74.239999999999995 111.338 -163.507 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.423 ' H ' ' HG2' ' A' ' 8' ' ' GLU . 3.5 mpp_? -101.41 172.33 7.05 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.581 1.553 . . . . 73.239999999999995 110.357 173.551 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 62.39 45.87 6.24 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 127.311 2.244 . . . . 33.32 112.311 -171.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' HIS . . . . . 0.497 ' HB3' HD13 ' A' ' 21' ' ' LEU . 0.7 OUTLIER -58.44 -17.66 22.48 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.325 0.861 . . . . 62.420000000000002 113.325 164.453 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -46.38 -42.46 15.02 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 128.87 2.868 . . . . 73.219999999999999 112.75 -172.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.07 13.82 13.03 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.8 1.24 . . . . 71.109999999999999 111.329 178.625 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 19.0 mttm -108.25 -13.24 14.94 Favored 'General case' 0 C--O 1.225 -0.199 0 C-N-CA 124.596 1.159 . . . . 54.439999999999998 112.398 176.227 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -64.35 -27.02 68.73 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 120.494 1.497 . . . . 74.030000000000001 110.86 170.288 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -86.94 26.24 1.18 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.698 1.599 . . . . 63.210000000000001 112.36 173.132 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -167.54 -167.94 0.96 Allowed 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 119.465 1.03 . . . . 74.030000000000001 109.965 -178.042 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 57.8 -160.7 0.24 Allowed 'General case' 0 C--O 1.238 0.474 0 C-N-CA 125.765 1.626 . . . . 72.239999999999995 110.499 165.412 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -140.19 -32.86 0.59 Allowed 'General case' 0 C--O 1.219 -0.532 0 O-C-N 120.985 -1.072 . . . . 72.329999999999998 111.029 160.297 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -49.31 -41.66 38.99 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 125.274 1.43 . . . . 64.540000000000006 111.985 -168.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.497 HD13 ' HB3' ' A' ' 11' ' ' HIS . 67.9 mt -91.62 -37.28 13.17 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 119.048 -0.501 . . . . 73.349999999999994 110.785 -176.266 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 27.0 t30 -53.33 -45.18 68.97 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 119.106 0.867 . . . . 63.240000000000002 110.539 170.666 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -60.87 -39.77 90.45 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 125.801 1.641 . . . . 73.140000000000001 110.499 -178.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -45.78 -44.92 14.36 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 121.181 -0.949 . . . . 75.019999999999996 110.964 171.204 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.581 ' HB1' ' HA ' ' A' ' 97' ' ' ARG . . . -75.31 -62.19 1.65 Allowed 'General case' 0 C--O 1.235 0.312 0 C-N-CA 126.208 1.803 . . . . 74.329999999999998 112.915 177.076 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -61.51 -16.54 48.48 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.741 1.216 . . . . 71.420000000000002 111.713 -173.329 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -119.49 37.39 4.18 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.331 1.852 . . . . 33.140000000000001 111.366 -177.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.13 6.12 4.2 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 121.289 -0.882 . . . . 60.329999999999998 112.634 168.387 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.2 ptt85 -63.36 -19.05 64.31 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 120.566 -1.334 . . . . 72.400000000000006 113.27 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -78.72 -20.36 50.24 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 119.803 1.183 . . . . 75.120000000000005 112.142 175.368 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.49 -19.06 63.75 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 120.323 1.419 . . . . 74.349999999999994 112.65 -168.338 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.19 2.14 9.18 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.709 2.004 . . . . 60.030000000000001 111.684 -168.495 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.5 mt -60.96 -28.8 69.24 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.702 1.201 . . . . 64.430000000000007 111.336 171.585 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -61.24 -37.2 93.61 Favored Glycine 0 C--O 1.223 -0.533 0 N-CA-C 111.317 -0.713 . . . . 61.229999999999997 111.317 -178.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -62.28 -33.51 74.78 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.419 1.088 . . . . 72.150000000000006 110.227 -170.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 10.2 t90 -62.65 -65.09 0.74 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.689 1.596 . . . . 64.109999999999999 110.044 170.268 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.26 -21.09 66.69 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.412 0.685 . . . . 61.119999999999997 112.481 -171.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -70.77 -55.3 8.9 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 125.024 1.33 . . . . 55.43 109.257 168.354 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -49.26 -45.07 35.16 Favored Glycine 0 CA--C 1.527 0.842 0 C-N-CA 124.231 0.919 . . . . 54.5 112.042 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 16.1 mt -61.06 -32.74 72.37 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.496 1.118 . . . . 74.329999999999998 113.89 179.355 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 95.7 mt -85.66 -3.45 58.89 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.365 1.066 . . . . 73.030000000000001 112.446 176.288 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.11 19.69 56.87 Favored Glycine 0 CA--C 1.526 0.763 0 CA-C-O 118.424 -1.209 . . . . 42.409999999999997 113.374 -175.233 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 14.3 mmtp -101.53 119.18 38.37 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 125.81 1.644 . . . . 72.430000000000007 108.655 177.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.8 p -152.6 135.56 15.57 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.433 0.693 . . . . 55.340000000000003 110.827 -179.707 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 87.59 -148.85 21.39 Favored Glycine 0 CA--C 1.533 1.2 0 N-CA-C 110.894 -0.883 . . . . 75.310000000000002 110.894 -164.23 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -63.96 -22.11 66.78 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.937 1.458 . . . . 73.019999999999996 114.937 -161.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.76 -51.29 23.44 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 108.253 -1.018 . . . . 74.230000000000004 108.253 175.31 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -56.51 -40.19 74.6 Favored 'General case' 0 C--N 1.344 0.334 0 O-C-N 121.69 -0.631 . . . . 71.310000000000002 109.886 171.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.02 -25.58 67.74 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.756 1.223 . . . . 75.319999999999993 113.002 179.623 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.05 -51.66 11.83 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 119.533 1.06 . . . . 74.010000000000005 109.663 169.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -60.15 -29.08 68.42 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.266 1.026 . . . . 64.349999999999994 112.822 -177.038 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.0 -18.97 49.92 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 120.461 -1.399 . . . . 55.420000000000002 112.513 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 22.0 mt -90.74 -15.38 30.33 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.126 0.97 . . . . 71.209999999999994 111.651 -168.339 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.8 t -95.92 -29.26 14.28 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.64 1.176 . . . . 63.340000000000003 111.411 -178.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 5.3 p -70.8 8.53 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 126.202 1.801 . . . . 43.509999999999998 114.374 -166.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 5.2 m -104.14 49.12 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 O-C-N 119.196 -2.19 . . . . 75.319999999999993 112.004 -163.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.4 t -58.74 -50.48 73.76 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 109.797 -0.446 . . . . 63.0 109.797 172.494 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.0 t 52.3 69.43 0.68 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.539 1.136 . . . . 64.299999999999997 108.784 -167.56 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.2 t0 -146.65 108.01 4.25 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 105.114 -2.18 . . . . 72.099999999999994 105.114 179.286 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -170.9 23.16 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.167 0.587 . . . . 75.019999999999996 111.902 -168.259 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -92.61 81.89 4.8 Favored 'General case' 0 N--CA 1.464 0.246 0 O-C-N 120.555 -1.341 . . . . 61.399999999999999 111.06 -170.141 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 56.33 61.26 7.53 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 124.827 1.251 . . . . 72.409999999999997 109.295 -169.272 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -80.59 178.92 6.51 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 124.279 3.32 . . . . 71.129999999999995 113.448 -161.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.16 -171.44 7.55 Favored Glycine 0 CA--C 1.534 1.265 0 C-N-CA 125.141 1.353 . . . . 54.200000000000003 113.691 177.385 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -85.69 2.37 45.6 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 127.232 2.213 . . . . 72.409999999999997 111.126 178.548 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 178.32 -163.19 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.367 1.867 . . . . 70.0 107.958 -168.162 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . 0.268 5.1 t70 68.53 -66.29 0.24 Allowed 'General case' 0 CA--C 1.518 -0.278 0 C-N-CA 131.378 3.871 . . . . 71.230000000000004 111.725 -172.626 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 30.1 t -47.76 -63.57 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 125.448 1.499 . . . . 74.409999999999997 108.476 170.142 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -79.37 -5.23 54.12 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 115.011 1.486 . . . . 75.140000000000001 115.011 -179.382 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.2 ptt180 -54.07 -19.85 5.55 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 115.486 1.661 . . . . 74.299999999999997 115.486 -172.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -113.21 -10.84 13.33 Favored 'General case' 0 CA--C 1.516 -0.345 0 C-N-CA 124.034 0.934 . . . . 62.229999999999997 112.648 177.339 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 17.9 tp -94.34 -58.43 2.21 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.881 1.273 . . . . 73.120000000000005 108.086 -175.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.32 -49.14 70.38 Favored 'General case' 0 C--O 1.223 -0.291 0 C-N-CA 124.897 1.279 . . . . 43.119999999999997 109.529 170.1 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.9 -20.58 65.94 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 114.314 1.227 . . . . 53.399999999999999 114.314 -178.343 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.08 -52.75 8.26 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 106.954 -1.498 . . . . 62.43 106.954 170.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 90.5 mt -80.39 39.67 0.47 Allowed 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 127.264 2.225 . . . . 73.340000000000003 110.785 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 62.0 tt0 -55.67 113.26 1.39 Allowed 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 126.579 1.952 . . . . 75.010000000000005 107.504 173.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 80.19 6.95 88.95 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 124.491 1.043 . . . . 53.140000000000001 114.58 -177.569 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 27.2 mtmm -130.43 -2.58 4.36 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 118.779 1.29 . . . . 75.040000000000006 113.443 -176.619 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -151.33 106.68 3.33 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 119.993 1.269 . . . . 74.040000000000006 110.379 175.036 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -64.53 166.48 8.43 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 108.458 -0.942 . . . . 71.239999999999995 108.458 167.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -55.46 -39.47 70.39 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 120.85 -1.156 . . . . 64.409999999999997 110.47 177.335 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -75.73 -16.73 60.1 Favored 'General case' 0 CA--C 1.53 0.188 0 O-C-N 121.483 -0.761 . . . . 75.230000000000004 111.276 -177.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 96.3 m -68.75 -43.81 75.04 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 118.64 0.655 . . . . 54.119999999999997 109.625 170.741 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.1 mt -62.29 -57.08 13.7 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-N 119.9 1.227 . . . . 75.299999999999997 108.82 -176.463 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.96 -44.58 67.22 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 118.274 0.488 . . . . 74.109999999999999 111.528 178.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.28 -52.67 64.64 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 108.922 -0.77 . . . . 73.120000000000005 108.922 -177.225 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -63.85 -43.76 95.17 Favored 'General case' 0 CA--C 1.518 -0.285 0 C-N-CA 123.748 0.819 . . . . 72.319999999999993 112.869 -174.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 10.0 mtt -58.29 -42.92 87.65 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 118.887 0.767 . . . . 60.219999999999999 110.757 177.492 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 60.0 t -68.68 -40.24 81.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 124.086 0.954 . . . . 35.210000000000001 110.39 179.258 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -58.26 -52.5 65.34 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 119.655 1.116 . . . . 72.310000000000002 110.947 -173.293 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 22.3 mt -67.97 1.68 2.53 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.509 1.924 . . . . 60.210000000000001 112.765 -168.381 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -67.83 -19.39 65.05 Favored 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 125.307 1.443 . . . . 72.200000000000003 112.112 -176.146 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -76.81 -56.27 4.75 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 119.994 1.27 . . . . 63.229999999999997 109.293 172.176 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 55.3 m -51.21 -36.85 43.57 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.21 1.404 . . . . 64.129999999999995 110.566 177.488 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.33 -50.82 68.64 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.693 0.797 . . . . 60.229999999999997 113.033 175.284 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.581 ' HA ' ' HB1' ' A' ' 25' ' ' ALA . 12.1 ptm180 -76.87 -35.7 57.28 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 118.522 0.601 . . . . 74.019999999999996 110.645 -179.175 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -61.47 -37.99 85.62 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 124.955 1.302 . . . . 73.329999999999998 111.817 179.3 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -63.37 -20.76 65.81 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 119.235 0.925 . . . . 73.219999999999999 112.854 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 41.9 mm -79.34 -29.49 13.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 CA-C-N 119.328 0.967 . . . . 73.019999999999996 110.605 174.542 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 15.9 mm -61.14 -23.78 31.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 N-CA-C 108.641 -0.874 . . . . 75.049999999999997 108.641 167.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -93.76 9.65 36.25 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.523 0.729 . . . . 74.409999999999997 111.779 176.601 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 88.3 mt-10 -132.29 37.49 3.54 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.582 1.953 . . . . 73.349999999999994 108.886 -179.111 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 96.9 mt . . . . . 0 C--O 1.254 1.339 0 C-N-CA 125.779 1.631 . . . . 75.310000000000002 109.331 166.456 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.468 0 N-CA-C 106.799 -1.556 . . . . 75.299999999999997 106.799 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 26.6 m 62.5 114.93 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.571 1.148 . . . . 75.040000000000006 109.301 -158.249 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -146.07 168.61 20.53 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.302 1.441 . . . . 71.140000000000001 108.675 178.373 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 12.7 t80 70.04 -70.17 0.15 Allowed 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 127.085 2.154 . . . . 75.140000000000001 112.009 175.405 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 61.36 13.1 4.71 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 126.997 2.119 . . . . 61.439999999999998 114.449 167.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.7 t0 -87.54 115.28 24.86 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 125.312 1.445 . . . . 43.310000000000002 107.29 170.612 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 22.8 ptt85 -46.14 139.69 4.4 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.995 2.118 . . . . 75.030000000000001 112.631 -174.571 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -72.36 174.0 7.95 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-O 122.991 1.376 . . . . 73.099999999999994 110.558 174.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.5 mtm180 -93.15 -176.73 4.25 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.558 1.543 . . . . 71.230000000000004 109.164 -171.651 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 44.26 61.47 2.36 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.128 1.771 . . . . 72.230000000000004 113.268 170.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -59.64 -14.84 15.36 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 115.444 1.646 . . . . 74.420000000000002 115.444 -172.319 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.443 ' HG3' ' H ' ' A' ' 13' ' ' ALA . 7.0 pt-20 -44.94 -78.75 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.951 2.101 . . . . 73.099999999999994 113.306 -168.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.443 ' H ' ' HG3' ' A' ' 12' ' ' GLU . . . -81.56 -2.57 50.46 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.627 0.771 . . . . 72.0 112.655 -179.61 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 31.4 mttm -75.6 -11.04 59.93 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.115 0.966 . . . . 64.129999999999995 112.329 176.473 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -61.56 -27.04 68.34 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 120.536 1.516 . . . . 75.439999999999998 112.571 -174.643 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -86.86 16.0 5.3 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.583 1.553 . . . . 62.219999999999999 113.033 174.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 50.9 m-70 -140.69 -65.55 0.45 Allowed 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.077 1.751 . . . . 74.219999999999999 109.966 -173.415 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -84.24 84.78 7.5 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 126.047 1.739 . . . . 74.409999999999997 107.427 -172.23 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.87 -26.07 57.94 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 114.811 -1.086 . . . . 75.239999999999995 110.912 175.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.01 -34.19 77.84 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.505 1.122 . . . . 64.129999999999995 111.592 174.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 82.0 mt -77.51 -36.96 52.04 Favored 'General case' 0 C--O 1.232 0.184 0 O-C-N 120.215 -1.553 . . . . 73.299999999999997 109.451 173.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -66.52 -29.74 69.9 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 121.244 -0.91 . . . . 74.400000000000006 111.062 176.37 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -58.62 -45.9 88.22 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.809 1.244 . . . . 63.109999999999999 110.879 172.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.31 -30.92 13.07 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.773 0.829 . . . . 73.200000000000003 112.247 174.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.18 -24.65 34.86 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 113.73 1.011 . . . . 73.209999999999994 113.73 -174.669 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -79.84 -16.57 55.19 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 119.352 0.978 . . . . 62.439999999999998 110.972 173.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -74.26 -160.12 0.09 Allowed 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 126.389 1.876 . . . . 71.109999999999999 108.932 166.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.4 mmt180 59.7 -29.65 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 128.973 2.909 . . . . 44.32 115.818 -176.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.1 ptt180 -50.9 -12.86 0.12 Allowed 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 130.89 3.676 . . . . 75.420000000000002 116.114 -174.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 25.4 m120 -113.4 -23.57 9.79 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 119.574 1.079 . . . . 62.509999999999998 112.275 178.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.9 -44.45 91.23 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 120.9 1.682 . . . . 72.030000000000001 110.301 173.637 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -79.69 -13.39 59.51 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 113.451 0.908 . . . . 71.420000000000002 113.451 -171.206 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.43 HD11 ' HB2' ' A' ' 89' ' ' MET . 15.7 mt -62.02 -24.99 67.39 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.642 0.777 . . . . 70.430000000000007 111.681 173.45 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -57.55 -39.44 90.88 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.899 -0.88 . . . . 11.34 110.899 176.682 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -65.36 -35.05 79.81 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.631 1.215 . . . . 72.420000000000002 111.108 -179.008 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.5 ' CD1' ' HE2' ' A' ' 88' ' ' LYS . 56.4 t90 -66.19 -61.88 1.78 Allowed 'General case' 0 C--N 1.342 0.242 0 C-N-CA 123.738 0.815 . . . . 71.140000000000001 108.969 178.596 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.08 -39.95 83.71 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 119.123 -0.465 . . . . 74.409999999999997 110.985 -178.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.0 -50.31 73.09 Favored 'General case' 0 C--N 1.339 0.15 0 CA-C-N 118.981 0.81 . . . . 53.219999999999999 110.889 172.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -52.28 -50.4 46.86 Favored Glycine 0 C--N 1.335 0.504 0 C-N-CA 124.977 1.275 . . . . 71.329999999999998 110.96 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 91.4 mt -58.53 -51.34 70.28 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 123.816 0.846 . . . . 73.129999999999995 109.764 175.202 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 32.1 mt -66.19 -6.11 12.45 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 115.406 1.632 . . . . 65.25 115.406 -176.315 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 80.61 12.48 82.86 Favored Glycine 0 CA--C 1.529 0.929 0 CA-C-N 119.078 0.854 . . . . 54.350000000000001 112.626 -177.242 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 57.8 mttt -87.86 129.1 35.31 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 118.834 1.317 . . . . 64.519999999999996 108.4 170.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 61.2 p -144.53 160.43 41.14 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.825 0.85 . . . . 70.319999999999993 108.764 167.352 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.82 -145.33 32.41 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 110.488 -1.045 . . . . 53.140000000000001 110.488 -175.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -57.36 -35.23 69.69 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.741 1.217 . . . . 45.25 110.583 -178.587 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -54.21 -43.56 70.89 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.309 1.044 . . . . 53.439999999999998 111.24 175.161 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -77.59 -42.56 34.71 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 121.997 -0.439 . . . . 72.349999999999994 109.924 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.3 ptt180 -63.29 -46.07 88.46 Favored 'General case' 0 C--O 1.225 -0.186 0 N-CA-C 109.511 -0.551 . . . . 74.439999999999998 109.511 -174.261 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.59 -44.16 96.57 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 126.13 1.772 . . . . 54.229999999999997 110.212 -176.151 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 17.1 t80 -60.78 -55.5 32.34 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.281 0.632 . . . . 74.430000000000007 109.445 171.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.81 -5.52 2.08 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 125.416 1.486 . . . . 54.32 114.045 -176.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 45.5 mt -65.11 -34.38 78.27 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 120.708 -1.245 . . . . 71.239999999999995 110.369 169.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 13.8 t -133.98 73.45 1.5 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 122.51 1.147 . . . . 53.020000000000003 109.943 -165.511 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.6 m -136.03 12.98 0.97 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 126.023 1.729 . . . . 54.020000000000003 111.688 -178.143 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 16.0 t -82.78 90.23 2.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 O-C-N 120.626 -1.296 . . . . 44.219999999999999 109.99 -171.493 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 5.3 t -147.51 131.6 17.3 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 126.171 1.788 . . . . 74.319999999999993 106.554 176.717 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.6 p -143.4 95.95 2.83 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 124.113 0.965 . . . . 62.119999999999997 108.402 176.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.4 t0 -141.0 89.46 2.25 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 107.429 -1.323 . . . . 71.109999999999999 107.429 -175.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -160.38 176.02 12.14 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 126.247 1.819 . . . . 54.310000000000002 109.66 -175.43 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 39.0 t70 51.8 91.62 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.109 0 C-N-CA 126.982 2.113 . . . . 64.140000000000001 109.882 -160.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 52.5 72.54 1.15 Allowed Pre-proline 0 CA--C 1.546 0.792 0 C-N-CA 129.77 3.228 . . . . 74.519999999999996 113.708 -168.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -71.36 168.69 22.73 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 123.174 2.583 . . . . 61.549999999999997 111.012 173.148 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -107.88 -33.75 2.97 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 125.131 1.348 . . . . 73.140000000000001 112.904 178.207 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -133.48 -14.07 2.58 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 125.54 1.536 . . . . 73.420000000000002 111.337 -179.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 63.32 26.15 14.94 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.769 1.228 . . . . 75.519999999999996 111.071 163.742 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -76.46 25.44 0.13 Allowed 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.882 1.673 . . . . 75.530000000000001 113.602 -165.233 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 1.6 p -131.31 -57.67 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 C-N-CA 127.83 2.452 . . . . 62.450000000000003 107.655 179.035 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 46.9 t80 -55.78 -44.02 77.33 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 119.526 1.057 . . . . 62.549999999999997 109.56 172.174 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.3 ttt180 -62.1 -11.75 15.72 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 114.824 1.416 . . . . 62.539999999999999 114.824 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 55.8 mmtt -105.63 -48.79 3.57 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 120.04 1.291 . . . . 74.519999999999996 109.368 175.376 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 13.8 mt -70.72 -27.83 64.27 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 118.48 -0.771 . . . . 72.549999999999997 110.956 -172.156 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.05 -53.25 21.36 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-N 119.434 1.015 . . . . 53.109999999999999 108.529 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.92 -20.96 66.72 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 117.955 -1.021 . . . . 74.109999999999999 113.05 174.455 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.88 -56.78 6.15 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 103.741 -2.689 . . . . 63.539999999999999 103.741 170.187 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 97.2 mt -77.6 31.56 0.16 Allowed 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 127.135 2.174 . . . . 64.230000000000004 112.141 -174.47 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -57.06 105.15 0.2 Allowed 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 126.779 2.032 . . . . 64.349999999999994 109.306 174.44 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 101.84 -1.36 52.04 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 126.153 1.835 . . . . 65.230000000000004 114.788 -177.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 28.9 mtmm -133.24 10.96 4.17 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 126.027 1.731 . . . . 74.329999999999998 113.088 -177.175 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -151.33 176.04 11.64 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 121.842 0.83 . . . . 44.25 111.683 175.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.431 ' H ' ' HB ' ' A' ' 84' ' ' THR . 7.6 m-20 -140.65 163.68 32.22 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 127.582 2.353 . . . . 71.519999999999996 105.599 172.557 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -46.05 -61.78 1.61 Allowed 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 126.109 1.763 . . . . 62.310000000000002 110.358 169.138 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -67.57 -38.11 83.61 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.188 0.595 . . . . 51.409999999999997 111.821 -176.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.431 ' HB ' ' H ' ' A' ' 81' ' ' ASP . 28.5 m -55.57 -46.39 77.2 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.802 0.841 . . . . 64.409999999999997 110.895 174.508 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 7.5 mt -70.28 -56.84 9.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 120.181 1.355 . . . . 72.439999999999998 110.301 173.471 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.87 -17.65 61.82 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 119.676 1.126 . . . . 75.25 113.153 -170.272 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -88.99 -32.86 17.42 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 119.541 1.064 . . . . 72.519999999999996 112.823 171.403 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.5 ' HE2' ' CD1' ' A' ' 36' ' ' TRP . 57.7 tptt -63.64 -70.27 0.23 Allowed 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.718 1.207 . . . . 74.530000000000001 112.178 -169.458 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.43 ' HB2' HD11 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -61.02 -31.64 71.26 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 112.806 0.669 . . . . 75.129999999999995 112.806 -167.553 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 74.2 t -58.74 -38.76 73.95 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 C-N-CA 124.925 1.29 . . . . 71.540000000000006 109.428 176.209 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -73.4 -21.4 60.5 Favored 'General case' 0 C--O 1.232 0.181 0 O-C-N 121.67 -0.644 . . . . 72.439999999999998 111.336 -172.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 89.0 mt -72.25 8.17 1.44 Allowed 'General case' 0 C--O 1.227 -0.127 0 C-N-CA 123.785 0.834 . . . . 64.430000000000007 111.661 -170.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 38.1 ttp85 -57.88 -44.52 86.75 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 121.224 -0.923 . . . . 54.509999999999998 110.015 174.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.52 -50.24 74.68 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-N 118.466 0.576 . . . . 62.350000000000001 110.851 171.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -58.3 -36.91 74.04 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.609 -0.682 . . . . 61.450000000000003 110.713 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -71.23 -48.82 49.0 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.718 1.207 . . . . 33.119999999999997 111.754 -177.417 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -63.2 -30.22 71.41 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 117.723 0.238 . . . . 75.219999999999999 110.659 177.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -57.66 -53.56 56.75 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 125.565 1.546 . . . . 71.019999999999996 111.048 170.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -57.2 -16.76 8.87 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 114.037 1.125 . . . . 61.43 114.037 -174.521 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 50.0 mm -71.23 -61.86 1.52 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 118.927 0.785 . . . . 73.400000000000006 110.168 168.26 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 84.5 mt -67.71 -19.36 24.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 124.478 1.111 . . . . 72.239999999999995 110.48 -173.091 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -69.55 -16.38 63.41 Favored 'General case' 0 N--CA 1.429 -1.517 0 C-N-CA 124.247 1.019 . . . . 73.109999999999999 111.839 172.053 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -145.7 67.84 1.21 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-N 119.899 1.227 . . . . 64.239999999999995 109.867 -173.134 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 15.2 mm . . . . . 0 C--O 1.252 1.185 0 C-N-CA 125.249 1.42 . . . . 74.230000000000004 108.74 173.876 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ptt? . . . . . 0 N--CA 1.478 0.933 0 CA-C-O 118.226 -0.892 . . . . 44.310000000000002 110.445 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 13.9 t -128.56 178.07 6.57 Favored 'General case' 0 C--O 1.239 0.547 0 N-CA-C 106.465 -1.68 . . . . 71.319999999999993 106.465 161.446 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.1 p -152.71 145.3 24.19 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 129.491 3.116 . . . . 63.420000000000002 105.631 -176.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -156.17 84.09 1.0 Allowed 'General case' 0 C--O 1.236 0.366 0 CA-C-N 119.857 1.208 . . . . 74.140000000000001 109.003 -174.472 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -79.2 93.97 5.32 Favored 'General case' 0 C--O 1.234 0.243 0 O-C-N 121.379 -0.826 . . . . 61.539999999999999 109.938 178.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 66.6 t0 -158.22 97.24 1.49 Allowed 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 103.481 -2.785 . . . . 64.420000000000002 103.481 165.539 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.5 ttp180 -130.46 120.22 23.85 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 106.993 -1.484 . . . . 73.549999999999997 106.993 -173.356 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.3 pm0 -68.78 163.87 23.12 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 122.117 0.96 . . . . 74.140000000000001 111.541 173.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.405 HH11 ' HG2' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -74.47 -52.35 12.22 Favored 'General case' 0 C--O 1.226 -0.142 0 CA-C-N 114.791 -1.095 . . . . 65.329999999999998 109.249 -179.59 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 46.12 68.62 0.57 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 126.992 2.117 . . . . 74.239999999999995 111.821 176.065 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -71.02 -4.85 27.12 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 115.249 1.574 . . . . 74.420000000000002 115.249 -169.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -62.34 129.58 41.36 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 108.823 -0.806 . . . . 73.150000000000006 108.823 -177.114 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 57.26 -8.63 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 127.889 2.476 . . . . 70.340000000000003 115.535 -169.149 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -77.33 -25.13 50.85 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 119.93 1.241 . . . . 72.150000000000006 112.066 174.413 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.39 -17.6 59.53 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 114.18 1.178 . . . . 74.329999999999998 114.18 -169.614 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -126.28 40.29 3.76 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 125.622 1.569 . . . . 73.340000000000003 108.847 173.324 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -149.37 -75.54 0.16 Allowed 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 107.79 -1.189 . . . . 72.349999999999994 107.79 179.07 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.57 117.77 9.23 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 124.804 1.241 . . . . 74.25 108.631 -178.178 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.74 -31.13 72.2 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 124.168 0.987 . . . . 62.520000000000003 111.669 -173.392 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -60.74 -62.55 1.77 Allowed 'General case' 0 C--O 1.231 0.095 0 C-N-CA 125.717 1.607 . . . . 71.129999999999995 112.163 -177.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 36.0 mt -72.03 -32.81 67.49 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 121.788 -0.57 . . . . 64.230000000000004 109.481 -169.218 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 58.0 t-20 -53.57 -59.93 3.96 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 126.36 1.864 . . . . 74.109999999999999 108.744 169.4 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -56.22 -45.6 79.86 Favored 'General case' 0 CA--C 1.517 -0.298 0 C-N-CA 123.665 0.786 . . . . 73.319999999999993 111.483 179.416 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.37 -31.4 33.61 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 119.234 0.924 . . . . 74.340000000000003 112.268 -177.912 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -91.58 -53.97 4.09 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 125.274 1.43 . . . . 72.239999999999995 111.868 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -58.29 -25.12 61.46 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.73 -0.606 . . . . 74.310000000000002 110.962 179.004 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -106.88 7.54 30.16 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 125.094 1.358 . . . . 52.020000000000003 112.401 -177.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.47 -14.98 3.46 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 120.744 -1.223 . . . . 74.099999999999994 113.124 174.597 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 49.5 mtm180 -62.42 16.56 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 131.344 3.858 . . . . 74.340000000000003 116.113 -166.343 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -124.61 -70.05 0.77 Allowed 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 119.719 1.145 . . . . 70.409999999999997 108.819 165.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.451 ' HD2' ' H ' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -60.34 -19.83 56.98 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.467 1.284 . . . . 73.319999999999993 114.467 -165.828 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.18 -19.93 66.21 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 113.039 0.755 . . . . 74.120000000000005 113.039 174.291 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 20.9 tp -72.49 -27.53 62.33 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 126.436 1.894 . . . . 73.400000000000006 110.905 171.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.25 -53.66 38.12 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 108.469 -1.852 . . . . 42.219999999999999 108.469 164.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -63.59 -7.13 6.39 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.231 1.412 . . . . 71.239999999999995 113.791 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 22.6 t90 -86.02 -79.4 0.25 Allowed 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 107.37 -1.344 . . . . 72.329999999999998 107.37 165.662 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.37 -21.86 62.62 Favored 'General case' 0 C--O 1.225 -0.193 0 C-N-CA 124.804 1.242 . . . . 74.420000000000002 114.099 -167.341 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -54.09 -53.49 52.51 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.861 1.209 . . . . 74.5 109.866 176.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -54.74 -48.78 64.44 Favored Glycine 0 CA--C 1.524 0.644 0 C-N-CA 124.254 0.931 . . . . 63.340000000000003 111.771 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.0 mp -52.9 -39.56 62.85 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.523 1.529 . . . . 71.209999999999994 111.78 175.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 67.8 mt -86.8 1.44 52.3 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.704 1.602 . . . . 75.129999999999995 112.881 -177.444 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.79 29.64 25.81 Favored Glycine 0 CA--C 1.526 0.771 0 C-N-CA 124.391 0.996 . . . . 53.130000000000003 112.864 177.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.9 mttt -128.76 122.0 29.62 Favored 'General case' 0 CA--C 1.523 -0.092 0 C-N-CA 125.642 1.577 . . . . 64.340000000000003 108.566 -168.586 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.4 p -138.26 179.59 6.36 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 124.077 0.951 . . . . 64.540000000000006 109.387 175.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 52.46 -131.0 38.77 Favored Glycine 0 CA--C 1.523 0.579 0 C-N-CA 124.613 1.102 . . . . 42.009999999999998 111.414 178.132 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -61.8 -28.77 69.69 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 113.258 0.836 . . . . 61.530000000000001 113.258 -176.228 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -68.63 -47.56 66.31 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 122.61 1.195 . . . . 60.539999999999999 110.424 179.254 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.72 -36.54 81.25 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 114.721 -1.127 . . . . 61.140000000000001 111.079 172.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.5 ttm-85 -53.34 -52.28 59.72 Favored 'General case' 0 N--CA 1.444 -0.755 0 C-N-CA 123.712 0.805 . . . . 73.140000000000001 111.43 175.301 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.74 -45.04 94.55 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.413 0.551 . . . . 50.210000000000001 111.042 -177.518 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -54.23 -45.89 72.4 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.054 0.941 . . . . 74.310000000000002 110.051 175.154 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.97 -13.09 30.6 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 114.106 1.15 . . . . 52.200000000000003 114.106 179.415 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 18.3 mt -94.14 -14.58 25.52 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 120.905 -1.122 . . . . 73.5 110.773 179.432 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 12.5 t -110.24 29.06 8.02 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.067 1.747 . . . . 73.510000000000005 109.721 172.118 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 58.5 t -134.07 75.76 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 N-CA-C 107.337 -1.357 . . . . 44.030000000000001 107.337 170.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.481 HG12 ' H ' ' A' ' 57' ' ' THR . 1.6 t -137.36 168.19 21.63 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 C-N-CA 125.047 1.339 . . . . 73.400000000000006 107.744 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.481 ' H ' HG12 ' A' ' 56' ' ' VAL . 1.0 OUTLIER 67.2 -36.13 0.27 Allowed 'General case' 0 CA--C 1.553 1.078 1 C-N-CA 135.327 5.451 . . . . 61.530000000000001 116.186 -175.767 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 95.0 p 65.96 146.43 0.04 OUTLIER 'General case' 0 C--N 1.345 0.383 0 C-N-CA 129.038 2.935 . . . . 73.129999999999995 111.985 -168.053 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -158.79 93.97 1.21 Allowed 'General case' 0 C--O 1.234 0.28 0 N-CA-C 108.934 -0.765 . . . . 51.299999999999997 108.934 -167.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.468 ' CE2' ' HB3' ' A' ' 86' ' ' ARG . 0.2 OUTLIER -164.68 51.84 0.12 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.445 1.098 . . . . 71.319999999999993 110.868 -173.614 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.55 ' H ' ' HB2' ' A' ' 65' ' ' ASP . 0.4 OUTLIER -147.99 122.51 9.77 Favored 'General case' 0 N--CA 1.477 0.925 0 O-C-N 120.576 -1.328 . . . . 72.409999999999997 113.203 -168.531 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 57.26 165.36 0.07 OUTLIER Pre-proline 0 N--CA 1.48 1.044 0 C-N-CA 127.623 2.369 . . . . 73.510000000000005 113.254 -160.204 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -74.62 70.67 4.93 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 123.595 2.863 . . . . 65.510000000000005 110.455 177.576 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -164.22 -42.77 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 125.216 1.389 . . . . 64.409999999999997 110.993 175.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.55 ' HB2' ' H ' ' A' ' 61' ' ' ASP . 5.1 m-20 -85.78 86.03 7.37 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 105.851 -1.907 . . . . 74.239999999999995 105.851 -175.143 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -139.42 72.15 1.4 Allowed 'General case' 0 N--CA 1.445 -0.716 0 N-CA-C 105.345 -2.095 . . . . 51.130000000000003 105.345 170.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.84 -65.05 1.04 Allowed 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 109.904 -0.406 . . . . 72.530000000000001 109.904 173.865 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.3 p -67.0 -44.1 88.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 118.393 0.542 . . . . 70.5 110.648 -177.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -61.72 -33.34 73.87 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 121.493 -0.754 . . . . 74.329999999999998 111.231 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 17.5 tpp180 -51.82 -50.76 60.2 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 124.804 1.242 . . . . 72.400000000000006 111.341 -171.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.91 -26.8 22.53 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 119.455 -0.307 . . . . 70.340000000000003 111.073 -177.751 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -52.44 -61.41 2.29 Favored 'General case' 0 CA--C 1.52 -0.197 0 C-N-CA 123.974 0.91 . . . . 70.310000000000002 108.839 177.307 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.72 -36.45 80.97 Favored 'General case' 0 N--CA 1.456 -0.165 0 O-C-N 123.889 0.743 . . . . 54.340000000000003 111.931 -171.015 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.39 -45.13 85.24 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.03 0.443 . . . . 71.400000000000006 110.534 178.362 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -65.81 -48.13 72.73 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 122.131 0.967 . . . . 71.219999999999999 109.65 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 11.8 tp -87.2 10.34 17.24 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 127.35 2.26 . . . . 72.230000000000004 113.26 -169.065 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -47.54 111.13 0.38 Allowed 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 127.313 2.245 . . . . 60.009999999999998 110.446 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 106.1 -2.26 38.0 Favored Glycine 0 CA--C 1.524 0.629 0 C-N-CA 125.768 1.652 . . . . 74.400000000000006 113.599 177.225 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.35 -0.13 5.68 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 119.722 1.761 . . . . 61.439999999999998 112.475 -179.329 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -147.89 176.35 10.22 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 125.065 1.346 . . . . 54.399999999999999 108.88 176.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -141.57 170.8 15.05 Favored 'General case' 0 CA--C 1.511 -0.521 0 C-N-CA 125.464 1.506 . . . . 65.299999999999997 107.88 174.584 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -65.47 -52.76 50.71 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 125.59 1.556 . . . . 70.030000000000001 108.63 -177.739 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -67.38 -29.95 69.61 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.463 0.705 . . . . 74.540000000000006 110.34 178.434 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 5.0 m -65.46 -57.8 7.39 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.419 0.688 . . . . 73.209999999999994 110.271 173.497 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 21.1 mt -60.29 -53.05 54.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 CA-C-N 120.511 1.505 . . . . 72.519999999999996 109.269 -171.423 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.468 ' HB3' ' CE2' ' A' ' 60' ' ' PHE . 0.9 OUTLIER -55.1 -37.58 67.02 Favored 'General case' 0 C--N 1.342 0.265 0 O-C-N 123.999 0.812 . . . . 71.219999999999999 110.858 -178.626 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -71.19 -47.91 54.75 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-O 118.375 -0.821 . . . . 61.299999999999997 109.285 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -50.51 -60.97 2.48 Favored 'General case' 0 CA--C 1.516 -0.345 0 C-N-CA 125.051 1.34 . . . . 73.219999999999999 109.295 -177.517 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . 0.282 0.0 OUTLIER -59.16 -38.35 79.53 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 120.271 -0.572 . . . . 61.329999999999998 111.928 -165.747 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 32.0 t -70.29 -53.16 24.32 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 125.249 1.42 . . . . 64.140000000000001 110.558 174.275 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -63.69 -26.15 68.53 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 120.178 -1.576 . . . . 65.239999999999995 111.769 -168.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 44.9 mt -64.6 8.95 0.09 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.856 1.662 . . . . 71.5 113.753 177.616 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -45.0 -64.11 0.78 Allowed 'General case' 0 C--N 1.34 0.195 0 C-N-CA 127.588 2.355 . . . . 73.209999999999994 113.13 -177.569 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.25 -20.2 28.81 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 118.966 0.803 . . . . 62.439999999999998 111.41 178.245 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.2 m -57.56 -30.04 64.91 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 120.858 -1.151 . . . . 74.519999999999996 110.242 174.364 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -54.18 -36.39 63.35 Favored 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 124.929 1.292 . . . . 52.240000000000002 114.253 170.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 18.5 ptt180 -90.78 -24.41 20.34 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 117.606 -1.188 . . . . 70.400000000000006 111.671 179.189 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -56.4 -59.28 5.2 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 119.044 0.838 . . . . 65.420000000000002 109.108 169.508 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -58.07 -20.63 40.94 Favored 'General case' 0 C--O 1.223 -0.315 0 N-CA-C 114.636 1.347 . . . . 74.5 114.636 -168.607 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 8.4 mm -89.19 -35.36 7.58 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 O-C-N 120.696 -1.253 . . . . 64.530000000000001 110.016 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 97.0 mt -66.96 -30.32 49.22 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 N-CA-C 108.579 -0.897 . . . . 73.109999999999999 108.579 168.717 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 2.2 t -71.69 -43.0 66.75 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.067 1.347 . . . . 74.319999999999993 109.413 178.175 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -129.49 70.2 1.42 Allowed 'General case' 0 C--O 1.234 0.288 0 C-N-CA 125.778 1.631 . . . . 73.340000000000003 107.508 -169.206 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 76.7 mt . . . . . 0 C--O 1.248 0.975 0 C-N-CA 126.533 1.933 . . . . 54.43 110.76 -176.007 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.459 ' HG2' ' H ' ' A' ' 2' ' ' THR . 3.2 ttt . . . . . 0 N--CA 1.475 0.801 0 N-CA-C 108.484 -0.932 . . . . 74.409999999999997 108.484 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.541 HG22 ' H ' ' A' ' 3' ' ' THR . 17.4 m 66.18 -164.18 0.23 Allowed 'General case' 0 C--O 1.243 0.715 0 CA-C-N 118.796 0.725 . . . . 72.129999999999995 109.182 167.14 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.541 ' H ' HG22 ' A' ' 2' ' ' THR . 0.7 OUTLIER -119.69 178.08 4.71 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.932 2.093 . . . . 74.340000000000003 107.235 166.841 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -151.35 174.46 13.3 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 124.635 1.174 . . . . 74.239999999999995 108.393 167.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -115.08 -177.41 3.12 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.145 1.378 . . . . 73.450000000000003 107.866 -176.186 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -144.57 83.41 1.71 Allowed 'General case' 0 CA--C 1.52 -0.179 0 O-C-N 120.746 -1.221 . . . . 64.120000000000005 108.606 158.438 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -91.74 154.32 19.04 Favored 'General case' 0 C--O 1.236 0.381 0 O-C-N 121.78 -0.575 . . . . 73.310000000000002 110.284 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -69.89 157.0 38.24 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.456 -0.942 . . . . 75.540000000000006 108.456 167.461 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -61.5 144.86 53.54 Favored 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 126.916 2.086 . . . . 72.25 109.913 175.523 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -172.45 95.83 0.14 Allowed 'General case' 0 C--O 1.234 0.285 0 C-N-CA 126.904 2.082 . . . . 75.510000000000005 106.632 169.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -131.86 9.94 4.61 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 115.432 1.641 . . . . 64.409999999999997 115.432 177.318 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -53.78 121.37 7.75 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.647 1.112 . . . . 75.319999999999993 109.12 174.498 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 48.51 -0.23 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 129.577 3.151 . . . . 63.399999999999999 117.248 -176.601 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.3 mmtt -76.59 -6.77 53.36 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 125.58 1.552 . . . . 73.409999999999997 112.808 -173.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -58.85 -36.0 73.87 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 119.449 1.022 . . . . 72.319999999999993 111.809 177.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.79 16.75 0.08 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.59 1.956 . . . . 64.430000000000007 113.399 178.22 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 44.8 t-80 -152.15 -73.49 0.14 Allowed 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 123.508 0.723 . . . . 75.510000000000005 109.94 -163.327 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -83.73 145.39 28.76 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 123.811 0.844 . . . . 72.530000000000001 108.841 -170.765 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.41 -50.57 9.29 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-O 117.945 -1.026 . . . . 75.329999999999998 109.771 175.269 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -44.94 -42.85 8.51 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 126.489 1.915 . . . . 75.329999999999998 113.392 -178.508 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 82.8 mt -76.38 -28.9 56.93 Favored 'General case' 0 C--N 1.33 -0.274 0 O-C-N 120.908 -1.12 . . . . 64.420000000000002 111.004 -174.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -80.03 -28.81 39.28 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.716 2.006 . . . . 73.439999999999998 111.212 171.056 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -56.63 -48.67 77.01 Favored 'General case' 0 C--O 1.226 -0.142 0 C-N-CA 126.929 2.092 . . . . 74.439999999999998 109.696 -171.521 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.45 -41.71 63.53 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 118.526 -0.75 . . . . 60.509999999999998 112.537 175.481 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.15 -54.27 43.56 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 124.515 1.126 . . . . 44.439999999999998 111.153 178.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -66.19 -11.26 48.51 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 112.647 0.61 . . . . 72.340000000000003 112.647 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -121.3 32.59 5.86 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.42 1.488 . . . . 60.329999999999998 111.335 -177.499 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -120.01 17.5 12.5 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.057 1.343 . . . . 72.140000000000001 112.86 178.304 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 71.7 mtm-85 -71.23 -48.82 48.94 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 120.296 -1.503 . . . . 74.109999999999999 111.825 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 30.3 m120 -62.19 -27.63 69.11 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 114.642 1.349 . . . . 74.120000000000005 114.642 -163.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.485 ' HD3' HD13 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -56.11 -34.61 66.2 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 119.322 0.964 . . . . 71.420000000000002 113.29 172.672 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.485 HD13 ' HD3' ' A' ' 31' ' ' ARG . 1.1 mm? -75.14 -33.23 61.51 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 123.613 0.765 . . . . 55.020000000000003 108.995 -177.618 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.426 HD21 ' HA ' ' A' ' 89' ' ' MET . 3.9 mm? -62.64 -33.44 75.02 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 108.625 -0.879 . . . . 54.409999999999997 108.625 169.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -67.81 -14.36 65.23 Favored Glycine 0 CA--C 1.538 1.524 0 CA-C-O 117.709 -1.606 . . . . 63.119999999999997 113.685 170.362 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -91.52 -18.69 23.73 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 121.291 2.545 . . . . 74.450000000000003 111.255 169.026 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 10.6 t90 -76.62 -79.23 0.11 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.148 1.379 . . . . 64.349999999999994 110.518 -176.136 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -50.69 -29.84 12.24 Favored 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 127.472 2.309 . . . . 73.209999999999994 112.722 -171.476 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -44.57 -52.87 7.65 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 126.64 1.976 . . . . 74.150000000000006 110.616 173.144 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -53.45 -48.73 59.47 Favored Glycine 0 C--N 1.337 0.625 0 N-CA-C 110.479 -1.048 . . . . 71.230000000000004 110.479 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.41 ' H ' ' CD1' ' A' ' 40' ' ' LEU . 2.2 mp -61.79 -46.48 89.36 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 126.728 2.011 . . . . 73.129999999999995 108.621 -177.37 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.0 mp -62.97 -18.28 63.04 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.083 1.353 . . . . 63.32 112.899 175.606 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 106.08 -1.91 38.07 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 127.065 2.269 . . . . 52.109999999999999 112.8 177.312 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 44.4 mttm -75.1 143.53 43.32 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 118.466 1.133 . . . . 71.319999999999993 108.65 178.428 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.1 p -142.16 178.53 7.48 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 124.043 0.937 . . . . 73.319999999999993 109.326 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 55.08 -119.89 15.23 Favored Glycine 0 N--CA 1.442 -0.922 0 C-N-CA 124.63 1.109 . . . . 64.319999999999993 110.544 168.704 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -82.86 -22.52 34.03 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 123.568 0.747 . . . . 64.340000000000003 112.768 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -72.43 -41.51 66.11 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.003 -1.06 . . . . 60.210000000000001 110.372 -176.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.8 -46.71 88.36 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.647 -0.872 . . . . 73.329999999999998 108.647 168.491 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -59.17 -33.63 71.15 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 118.419 -0.801 . . . . 74.25 112.895 179.2 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.56 -51.23 29.9 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 124.704 1.202 . . . . 72.150000000000006 109.849 175.37 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -56.77 -30.28 63.47 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.5 1.12 . . . . 75.239999999999995 111.857 176.432 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.45 1.09 2.48 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 120.468 -1.395 . . . . 75.239999999999995 114.32 175.605 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.0 mt -108.81 1.49 20.99 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 125.263 1.425 . . . . 64.109999999999999 110.147 179.058 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 77.4 p -129.9 18.79 5.58 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.165 0.893 . . . . 72.530000000000001 112.163 -168.169 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 5.4 t -132.97 102.68 5.23 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 C-N-CA 125.06 1.344 . . . . 63.240000000000002 109.08 177.479 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 4.2 p -146.78 128.15 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 O-C-N 120.884 -1.135 . . . . 71.319999999999993 110.058 175.574 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 5.5 t -170.55 87.13 0.12 Allowed 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 106.663 -1.606 . . . . 62.32 106.663 178.769 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.1 t -83.08 59.38 4.91 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.76 2.024 . . . . 72.299999999999997 108.173 -172.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 38.2 m-20 -139.17 39.7 2.11 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.397 1.879 . . . . 74.120000000000005 109.537 -159.323 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -138.28 61.39 1.59 Allowed 'General case' 0 C--O 1.235 0.328 0 O-C-N 120.124 -1.61 . . . . 73.329999999999998 110.015 -166.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -150.84 4.92 0.49 Allowed 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 115.432 1.641 . . . . 75.239999999999995 115.432 167.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -67.73 159.49 78.5 Favored Pre-proline 0 CA--C 1.542 0.673 0 CA-C-N 119.509 1.05 . . . . 62.420000000000002 108.911 160.692 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -79.45 65.18 8.9 Favored 'Trans proline' 0 CA--C 1.544 0.989 0 C-N-CA 122.586 2.191 . . . . 55.119999999999997 113.35 -165.636 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 135.75 -62.35 0.61 Allowed Glycine 0 CA--C 1.523 0.582 0 C-N-CA 126.023 1.773 . . . . 63.229999999999997 109.692 176.153 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . 0.265 14.2 t70 44.83 -45.42 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.494 1 C-N-CA 134.094 4.958 . . . . 63.100000000000001 118.522 -178.233 . . . . . . . . 3 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 66.93 -3.25 0.97 Allowed 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 126.31 1.844 . . . . 74.120000000000005 115.865 153.721 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -97.46 -21.17 17.29 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 119.883 -1.761 . . . . 74.310000000000002 111.459 174.13 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 48.2 t -84.38 -48.88 16.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 C-N-CA 124.17 0.988 . . . . 62.229999999999997 109.939 -177.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.43 -22.11 60.98 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 118.868 0.758 . . . . 74.099999999999994 112.889 -179.001 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.0 ttt180 -44.6 -43.14 7.94 Favored 'General case' 0 CA--C 1.516 -0.352 0 C-N-CA 128.429 2.692 . . . . 73.420000000000002 112.021 172.114 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -74.0 -15.79 61.09 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 118.403 -0.808 . . . . 74.219999999999999 111.98 -171.696 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 70.0 mt -96.32 -53.93 3.45 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.55 -0.907 . . . . 64.439999999999998 108.55 167.602 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -52.62 -40.47 62.78 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.753 1.621 . . . . 53.049999999999997 113.109 -169.111 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.35 -48.18 62.11 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.847 0.459 . . . . 74.140000000000001 111.159 177.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -67.24 -28.77 68.33 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 120.852 -1.155 . . . . 55.420000000000002 111.262 -176.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 14.2 tp -103.78 13.43 33.02 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 128.063 2.545 . . . . 54.420000000000002 111.824 -172.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -59.34 111.84 1.52 Allowed 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 126.268 1.827 . . . . 64.549999999999997 109.462 -177.574 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 105.49 -3.61 39.9 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 126.084 1.802 . . . . 71.239999999999995 113.077 -174.138 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 14.3 mtmm -134.16 -0.4 3.03 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 118.959 1.38 . . . . 72.030000000000001 112.474 -177.186 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -144.93 172.15 13.44 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 119.028 0.831 . . . . 75.239999999999995 110.506 168.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -132.83 161.45 34.12 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 125.845 1.658 . . . . 63.219999999999999 107.478 -178.779 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -64.73 -49.74 69.67 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.117 -0.947 . . . . 75.239999999999995 110.066 -164.584 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -71.64 -34.94 70.21 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 122.695 0.398 . . . . 75.519999999999996 110.042 177.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 52.3 m -57.24 -45.71 83.69 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.004 0.922 . . . . 61.140000000000001 111.062 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 79.8 mt -58.5 -48.58 85.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 CA-C-N 119.589 1.086 . . . . 60.340000000000003 110.404 179.622 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.64 -44.75 93.39 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 118.943 0.792 . . . . 71.129999999999995 110.667 -175.587 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.7 -38.08 89.76 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.198 0.599 . . . . 75.239999999999995 111.567 179.046 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.36 -47.04 76.36 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.319 0.648 . . . . 75.019999999999996 110.744 -177.078 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' MET . . . . . 0.426 ' HA ' HD21 ' A' ' 33' ' ' LEU . 10.5 mtt -61.84 -30.59 70.94 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 120.992 0.425 . . . . 62.119999999999997 111.853 -178.64 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 92.1 t -86.6 -25.44 6.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 124.915 1.286 . . . . 52.210000000000001 110.207 -171.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 90.2 mt-10 -56.99 -45.02 83.26 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.459 1.104 . . . . 55.509999999999998 110.459 175.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 4.2 pp -101.28 18.69 19.32 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 127.592 2.357 . . . . 74.040000000000006 112.688 -174.406 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.71 -31.08 72.14 Favored 'General case' 0 N--CA 1.469 0.493 0 O-C-N 119.92 -1.738 . . . . 75.400000000000006 113.945 -173.757 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -78.09 -37.2 46.99 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 119.665 1.12 . . . . 53.530000000000001 111.313 173.784 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 6.1 m -45.38 -47.56 13.51 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.435 1.894 . . . . 74.439999999999998 110.902 -172.624 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -64.75 -40.47 95.36 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 113.945 1.091 . . . . 63.530000000000001 113.945 -177.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 11.6 ptt180 -73.87 -33.13 63.93 Favored 'General case' 0 C--N 1.342 0.247 0 CA-C-O 117.436 -1.268 . . . . 62.520000000000003 110.59 -175.489 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -49.47 -55.69 12.36 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 118.314 -0.85 . . . . 55.399999999999999 109.034 171.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -53.12 -39.84 63.74 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-O 118.475 -0.774 . . . . 63.299999999999997 112.987 -173.014 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 8.5 mm -63.23 -46.41 95.85 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 120.04 1.291 . . . . 75.120000000000005 109.961 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 56.0 mt -67.03 -24.52 32.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 124.821 1.248 . . . . 73.109999999999999 109.095 179.747 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.13 -12.57 59.65 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.527 1.931 . . . . 74.329999999999998 111.53 176.23 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -121.36 24.07 10.12 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 125.587 1.555 . . . . 73.25 109.873 -163.44 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 33.0 mm . . . . . 0 C--O 1.255 1.346 0 N-CA-C 107.371 -1.344 . . . . 41.240000000000002 107.371 176.443 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.7 mtt . . . . . 0 N--CA 1.471 0.592 0 N-CA-C 106.952 -1.499 . . . . 55.420000000000002 106.952 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 42.1 p -136.43 -39.93 0.65 Allowed 'General case' 0 C--O 1.235 0.319 0 C-N-CA 123.008 0.523 . . . . 71.299999999999997 110.568 -168.457 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 6.8 m 68.46 -62.44 0.37 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 127.516 2.326 . . . . 64.439999999999998 112.062 172.649 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 47.1 p90 -137.67 -37.21 0.61 Allowed 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 126.817 2.047 . . . . 74.140000000000001 109.503 175.71 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 44.84 90.44 0.01 OUTLIER 'General case' 0 C--N 1.342 0.242 0 C-N-CA 129.111 2.964 . . . . 53.539999999999999 112.323 -176.623 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -56.46 -66.78 0.38 Allowed 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.1 0.96 . . . . 64.239999999999995 110.713 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -88.7 157.86 18.39 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 122.341 0.256 . . . . 75.239999999999995 110.334 -171.881 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -96.43 -85.82 0.33 Allowed 'General case' 0 CA--C 1.54 0.561 0 O-C-N 123.462 0.476 . . . . 63.240000000000002 111.006 -176.09 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 81.0 mtm-85 -128.29 -63.8 0.98 Allowed 'General case' 0 N--CA 1.475 0.781 0 O-C-N 120.796 -1.19 . . . . 75.219999999999999 112.705 -168.577 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 45.23 77.36 0.08 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 127.745 2.418 . . . . 53.399999999999999 114.359 179.1 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -60.59 16.19 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 127.36 2.264 . . . . 71.439999999999998 116.607 170.93 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -77.37 117.53 18.95 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 119.481 -2.012 . . . . 72.140000000000001 109.369 -171.221 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.29 -15.94 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 128.335 2.654 . . . . 71.310000000000002 116.069 -164.123 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 30.4 mttm -74.27 2.91 8.12 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.873 2.069 . . . . 74.120000000000005 115.802 -173.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.601 ' CZ ' ' HB2' ' A' ' 25' ' ' ALA . 0.1 OUTLIER -80.71 1.56 29.68 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 119.513 -1.992 . . . . 71.010000000000005 112.307 175.388 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -120.86 -154.75 0.6 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.922 2.089 . . . . 64.230000000000004 105.568 159.678 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 65.92 -54.61 0.37 Allowed 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 129.167 2.987 . . . . 73.099999999999994 115.711 168.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -96.0 -175.44 3.4 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 127.747 2.419 . . . . 75.200000000000003 107.604 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -113.72 -39.98 3.9 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 117.747 -1.12 . . . . 73.420000000000002 110.515 166.21 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 77.8 mt-10 -45.55 -54.02 8.17 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.066 1.346 . . . . 61.210000000000001 112.521 -175.19 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -72.34 -33.93 67.67 Favored 'General case' 0 N--CA 1.436 -1.137 0 O-C-N 121.01 -1.056 . . . . 63.229999999999997 111.931 -177.262 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -72.34 -30.01 64.35 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 123.37 0.668 . . . . 63.399999999999999 110.697 177.86 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.22 -45.84 90.04 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.674 1.189 . . . . 75.140000000000001 109.644 177.38 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 13.3 mttp -53.06 -39.63 63.4 Favored 'General case' 0 N--CA 1.463 0.182 0 O-C-N 121.599 -0.688 . . . . 72.439999999999998 110.927 172.231 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.601 ' HB2' ' CZ ' ' A' ' 15' ' ' PHE . . . -78.98 -28.64 43.53 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 114.098 1.147 . . . . 60.130000000000003 114.098 179.322 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -67.6 -40.61 84.75 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 108.436 -0.95 . . . . 74.0 108.436 178.53 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -109.06 54.99 0.64 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 122.004 0.907 . . . . 64.439999999999998 110.221 -156.668 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.5 ppt_? -151.71 -15.45 0.19 Allowed 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 114.215 1.191 . . . . 62.219999999999999 114.215 -177.492 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.13 -22.25 16.07 Favored 'General case' 0 C--O 1.231 0.088 0 O-C-N 120.69 -1.256 . . . . 73.200000000000003 114.031 -178.169 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -105.12 -25.32 12.55 Favored 'General case' 0 CA--C 1.518 -0.25 0 N-CA-C 113.99 1.107 . . . . 73.319999999999993 113.99 176.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.92 -22.4 64.33 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 118.919 0.782 . . . . 75.140000000000001 112.317 -169.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.4 -11.87 47.93 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 124.589 1.155 . . . . 64.109999999999999 113.678 -178.781 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 16.9 tp -72.88 -21.75 60.88 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.814 1.246 . . . . 75.0 112.243 -175.272 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -66.19 -37.59 93.1 Favored Glycine 0 CA--C 1.521 0.434 0 N-CA-C 110.898 -0.881 . . . . 75.129999999999995 110.898 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -54.73 -34.97 63.19 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 126.377 1.871 . . . . 73.340000000000003 111.568 178.516 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 28.3 t90 -70.26 -81.53 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.673 -0.862 . . . . 73.239999999999995 108.673 174.323 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -57.92 -24.7 58.99 Favored 'General case' 0 C--N 1.34 0.178 0 N-CA-C 114.311 1.226 . . . . 75.209999999999994 114.311 -167.228 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.01 -56.41 14.46 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 119.725 1.148 . . . . 73.299999999999997 109.954 176.027 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -53.45 -49.05 58.59 Favored Glycine 0 CA--C 1.527 0.79 0 CA-C-O 119.282 -0.732 . . . . 71.329999999999998 111.889 177.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 8.4 mp -52.41 -45.88 66.09 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.609 1.163 . . . . 74.329999999999998 110.892 179.083 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 84.8 mt -79.02 0.28 28.35 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 127.0 2.12 . . . . 74.310000000000002 112.862 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 71.41 3.07 52.33 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 124.691 1.138 . . . . 62.229999999999997 113.113 -175.396 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -63.48 127.72 32.6 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 106.178 -1.786 . . . . 74.140000000000001 106.178 175.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 37.7 p -136.37 171.79 13.97 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 107.98 -1.119 . . . . 52.229999999999997 107.98 175.048 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 51.14 -125.69 25.2 Favored Glycine 0 CA--C 1.524 0.634 0 C-N-CA 124.024 0.821 . . . . 31.350000000000001 112.632 172.692 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -61.89 -37.27 83.94 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.804 1.242 . . . . 73.219999999999999 111.704 -176.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.49 -43.03 73.97 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.686 0.795 . . . . 72.019999999999996 110.944 -177.399 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.77 -41.84 87.07 Favored 'General case' 0 C--O 1.227 -0.102 0 C-N-CA 123.577 0.751 . . . . 73.129999999999995 109.799 173.615 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 23.0 mtm180 -54.45 -57.3 11.84 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 118.87 -0.586 . . . . 75.319999999999993 109.531 176.071 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.58 -33.47 75.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 119.081 0.855 . . . . 74.310000000000002 111.49 -170.089 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 61.4 t80 -60.29 -55.24 36.11 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.284 1.034 . . . . 64.329999999999998 109.269 169.64 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.75 -36.7 81.77 Favored 'General case' 0 N--CA 1.462 0.128 0 C-N-CA 125.597 1.559 . . . . 42.530000000000001 113.604 -175.26 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.2 mt -59.69 -23.28 62.99 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 124.981 1.312 . . . . 73.040000000000006 111.149 -174.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.45 -82.22 0.62 Allowed 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 126.083 1.753 . . . . 74.340000000000003 107.585 178.86 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . 0.353 8.9 p 44.38 25.77 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 C-N-CA 128.315 2.646 . . . . 63.020000000000003 114.023 -171.308 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 3.6 m -100.79 125.68 54.62 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.855 0 O-C-N 119.042 -2.286 . . . . 64.239999999999995 110.688 178.794 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.8 t -153.57 -171.68 3.98 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 128.289 2.636 . . . . 55.240000000000002 105.379 170.543 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.8 m -104.35 74.46 1.18 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.686 1.194 . . . . 73.140000000000001 108.724 -165.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -66.41 102.79 0.92 Allowed 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 121.614 0.721 . . . . 72.409999999999997 112.026 -169.232 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 51.74 58.46 5.45 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.08 1.752 . . . . 62.109999999999999 109.39 -175.194 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.81 86.7 7.2 Favored 'General case' 0 N--CA 1.462 0.126 0 C-N-CA 125.062 1.345 . . . . 73.219999999999999 110.485 -175.93 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 63.79 163.93 0.12 Allowed Pre-proline 0 CA--C 1.546 0.801 0 C-N-CA 126.662 1.985 . . . . 75.430000000000007 112.946 -172.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -82.59 64.85 8.19 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.5 2.134 . . . . 61.420000000000002 112.323 -164.828 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -171.63 5.87 0.04 OUTLIER Glycine 0 CA--C 1.526 0.763 0 CA-C-O 118.22 -1.322 . . . . 71.329999999999998 114.393 176.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -131.89 23.52 4.6 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 118.79 1.295 . . . . 72.420000000000002 111.645 -167.268 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -60.39 1.22 0.13 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 127.022 2.129 . . . . 75.0 114.36 -174.428 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -58.91 -23.57 61.38 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.783 1.633 . . . . 73.319999999999993 111.633 -176.106 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 87.2 t -56.9 -49.02 80.41 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 O-C-N 119.901 -1.75 . . . . 60.229999999999997 110.579 169.537 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -65.88 -38.73 89.55 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 118.701 -0.666 . . . . 64.099999999999994 110.285 176.323 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.5 tpt180 -52.41 -56.51 14.55 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 118.349 0.522 . . . . 61.340000000000003 110.026 177.248 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? -63.28 -50.58 69.57 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 124.101 0.96 . . . . 64.209999999999994 109.459 -178.555 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 9.1 mt -56.15 -50.59 70.71 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-O 118.342 -0.837 . . . . 72.299999999999997 110.329 -176.303 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.07 -39.12 92.77 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 119.623 1.101 . . . . 75.040000000000006 112.419 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.36 -25.6 66.06 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 118.756 0.707 . . . . 71.010000000000005 111.498 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.05 -38.03 16.91 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 124.004 0.921 . . . . 71.230000000000004 111.035 174.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 94.3 mt -86.03 37.93 0.74 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.158 1.783 . . . . 71.420000000000002 109.84 175.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -61.65 102.33 0.25 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.472 1.909 . . . . 71.140000000000001 108.386 176.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 89.97 9.85 65.34 Favored Glycine 0 CA--C 1.523 0.569 0 C-N-CA 124.665 1.126 . . . . 72.230000000000004 112.876 -177.194 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -129.11 -10.95 4.74 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 119.475 1.637 . . . . 73.0 113.019 -173.5 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -149.27 171.37 16.61 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 119.207 0.912 . . . . 63.310000000000002 111.286 172.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -120.87 165.34 15.33 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 125.01 1.324 . . . . 62.210000000000001 109.973 -171.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -57.03 -26.69 60.73 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 126.842 2.057 . . . . 55.299999999999997 113.576 179.001 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -109.46 -22.47 12.0 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.885 0.874 . . . . 72.230000000000004 113.056 174.432 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.8 m -65.6 -37.88 87.87 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 120.562 -1.337 . . . . 43.240000000000002 113.132 -175.745 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 10.4 mt -69.69 -56.45 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 N-CA-C 107.627 -1.249 . . . . 64.430000000000007 107.627 179.326 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.51 -36.43 66.68 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 123.172 0.589 . . . . 73.319999999999993 110.979 -174.895 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.24 -38.89 78.7 Favored 'General case' 0 N--CA 1.443 -0.807 0 O-C-N 123.658 0.599 . . . . 73.310000000000002 110.858 179.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 6.3 tppt? -64.0 -49.66 71.56 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 119.448 1.022 . . . . 62.409999999999997 109.08 -161.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -43.88 97.16 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 113.119 0.785 . . . . 73.030000000000001 113.119 -177.811 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 58.6 t -65.04 -37.02 79.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 C-N-CA 123.985 0.914 . . . . 72.430000000000007 110.772 177.479 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -66.37 -26.49 67.29 Favored 'General case' 0 C--O 1.237 0.436 0 O-C-N 120.584 -1.322 . . . . 75.230000000000004 112.053 -175.336 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 45.3 mt -87.48 9.65 20.2 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.081 0.952 . . . . 75.209999999999994 112.322 -167.658 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 76.2 mtt85 -52.81 -46.62 67.78 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 120.88 1.673 . . . . 73.230000000000004 111.155 175.086 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -54.56 -66.23 0.44 Allowed 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 125.728 1.611 . . . . 73.010000000000005 109.12 177.301 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.6 m -48.01 -52.01 21.7 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 126.096 1.758 . . . . 62.329999999999998 110.766 -178.653 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.7 -36.14 73.75 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.874 1.27 . . . . 55.200000000000003 111.711 -177.445 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 14.8 ttp180 -59.4 -57.9 10.98 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 119.947 1.249 . . . . 63.43 108.45 173.126 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -65.82 -30.56 71.21 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-O 116.574 -1.679 . . . . 74.209999999999994 112.065 -169.532 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -48.85 -54.53 14.86 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-N 119.898 1.226 . . . . 73.319999999999993 110.237 174.199 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 18.8 mm -55.97 -47.1 80.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-N 119.684 1.129 . . . . 35.25 111.56 179.227 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 50.6 mt -66.66 -18.17 23.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 124.329 1.051 . . . . 64.340000000000003 109.569 -178.226 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 1.4 t -115.72 19.42 15.25 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.708 2.003 . . . . 73.420000000000002 110.058 -174.438 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -130.65 19.72 5.14 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.695 1.998 . . . . 72.329999999999998 110.341 177.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 33.3 mm . . . . . 0 C--O 1.247 0.943 0 CA-C-O 116.788 -1.577 . . . . 51.43 109.369 177.195 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 34.1 mtt . . . . . 0 N--CA 1.471 0.616 0 N-CA-C 108.86 -0.792 . . . . 73.430000000000007 108.86 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 22.8 p 53.53 175.23 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 127.691 2.396 . . . . 71.510000000000005 115.093 175.235 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -139.28 88.42 2.27 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 106.494 -1.669 . . . . 74.530000000000001 106.494 178.525 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -136.27 123.48 21.77 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 124.209 1.004 . . . . 73.219999999999999 109.116 -177.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -178.88 -170.71 0.2 Allowed 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 127.242 2.217 . . . . 65.299999999999997 106.589 -159.25 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.9 t70 61.11 -166.0 0.21 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.55 1.14 . . . . 50.520000000000003 110.357 -177.553 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 66.7 mtp180 -79.67 151.35 30.55 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 119.695 -1.878 . . . . 74.040000000000006 109.357 171.695 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.0 tp10 -94.04 -86.28 0.27 Allowed 'General case' 0 CA--C 1.533 0.325 0 O-C-N 123.932 0.77 . . . . 53.329999999999998 109.277 176.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 62.6 mtp180 -149.68 -85.8 0.09 Allowed 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.501 1.121 . . . . 72.109999999999999 108.582 -166.322 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -164.93 84.37 0.39 Allowed 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.806 1.243 . . . . 61.32 109.316 174.177 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -80.19 34.3 0.3 Allowed 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 114.125 1.157 . . . . 74.299999999999997 114.125 -175.447 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.44 ' HG3' ' H ' ' A' ' 13' ' ' ALA . 6.1 pt-20 -70.08 -85.54 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.64 1.109 . . . . 63.310000000000002 111.444 -176.151 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.44 ' H ' ' HG3' ' A' ' 12' ' ' GLU . . . -72.1 -11.88 60.95 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.736 -1.228 . . . . 42.439999999999998 112.112 177.176 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 51.2 mmtt -57.68 -22.9 48.66 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 125.026 1.33 . . . . 74.540000000000006 113.528 -178.255 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -60.41 -18.79 53.09 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.561 0.744 . . . . 74.400000000000006 112.796 177.809 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -125.97 55.29 1.47 Allowed 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.258 1.023 . . . . 65.430000000000007 108.41 168.671 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -156.05 -55.62 0.09 Allowed 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 118.413 -0.803 . . . . 72.099999999999994 111.206 -179.027 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -117.19 122.6 44.5 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 119.093 0.86 . . . . 71.530000000000001 110.357 -165.018 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.41 -32.51 66.93 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 125.952 1.701 . . . . 64.129999999999995 112.893 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -63.28 -52.8 60.54 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 123.447 0.699 . . . . 61.420000000000002 111.439 -179.072 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 44.2 mt -71.97 -39.99 68.95 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 108.463 -0.939 . . . . 34.109999999999999 108.463 -176.736 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -47.11 -48.31 23.01 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 117.36 -1.305 . . . . 65.200000000000003 111.475 166.325 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -64.79 -48.39 74.63 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 120.419 1.463 . . . . 64.209999999999994 110.803 177.704 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -50.42 -42.37 53.75 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 121.514 -0.741 . . . . 70.230000000000004 110.798 175.918 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -90.65 -9.58 46.35 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 125.343 1.457 . . . . 62.100000000000001 114.615 -177.745 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.07 -41.37 82.02 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 119.723 1.147 . . . . 71.400000000000006 110.552 -174.553 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -117.48 -85.26 0.64 Allowed 'General case' 0 N--CA 1.442 -0.84 0 N-CA-C 106.266 -1.753 . . . . 52.229999999999997 106.266 -160.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.346 0.0 OUTLIER 48.56 -1.41 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 117.652 2.464 . . . . 72.030000000000001 117.652 171.099 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 -80.13 4.96 15.66 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 121.358 1.89 . . . . 73.299999999999997 112.111 -177.267 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -130.65 -26.98 2.18 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-O 117.31 -1.329 . . . . 44.210000000000001 111.044 178.686 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.83 -55.01 7.16 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 120.686 1.585 . . . . 71.109999999999999 108.894 175.368 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.452 ' HA ' ' HG3' ' A' ' 35' ' ' GLU . 0.2 OUTLIER -61.01 -13.71 18.23 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 126.41 1.884 . . . . 71.219999999999999 115.266 -175.974 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 29.6 tp -71.38 -32.59 68.65 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 120.782 -1.199 . . . . 62.420000000000002 110.262 -172.068 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.01 -34.82 90.94 Favored Glycine 0 CA--C 1.529 0.948 0 N-CA-C 110.949 -0.861 . . . . 74.340000000000003 110.949 173.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.452 ' HG3' ' HA ' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -65.32 -19.14 65.82 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.754 1.277 . . . . 64.420000000000002 111.406 -173.425 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 19.9 t90 -74.4 -75.71 0.15 Allowed 'General case' 0 C--N 1.341 0.227 0 N-CA-C 107.946 -1.131 . . . . 70.349999999999994 107.946 169.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -54.7 -29.3 52.69 Favored 'General case' 0 C--O 1.222 -0.356 0 C-N-CA 125.139 1.375 . . . . 34.299999999999997 112.722 -171.222 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -45.08 -53.75 7.55 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.903 1.229 . . . . 65.239999999999995 111.222 169.415 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.4 -33.52 87.46 Favored Glycine 0 CA--C 1.532 1.109 0 O-C-N 121.95 -0.469 . . . . 74.450000000000003 112.01 -177.765 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.429 HD22 HD11 ' A' ' 76' ' ' LEU . 7.4 mp -66.12 -50.93 62.31 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.608 1.563 . . . . 65.140000000000001 109.588 173.859 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.7 mp -62.99 -28.45 70.1 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 125.498 1.519 . . . . 73.409999999999997 113.072 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 108.92 20.82 7.78 Favored Glycine 0 CA--C 1.527 0.802 0 C-N-CA 124.892 1.234 . . . . 72.120000000000005 112.878 -179.541 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.0 mttt -106.83 135.66 47.99 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 125.794 1.638 . . . . 73.409999999999997 107.944 178.552 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 17.5 p -138.29 154.22 49.03 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 124.458 1.103 . . . . 71.219999999999999 108.789 -176.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 49.94 -118.06 5.38 Favored Glycine 0 CA--C 1.523 0.555 0 N-CA-C 111.214 -0.754 . . . . 72.340000000000003 111.214 173.609 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -57.71 -36.86 72.58 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.765 1.626 . . . . 72.140000000000001 113.313 -177.78 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -68.01 -45.85 72.88 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 122.024 0.916 . . . . 75.239999999999995 109.851 177.633 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.92 -32.53 74.08 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.695 0.798 . . . . 70.040000000000006 110.475 177.473 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.7 ttm180 -54.88 -52.12 63.82 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 124.332 1.053 . . . . 73.120000000000005 111.266 178.281 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.47 -41.22 96.9 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-O 121.671 0.748 . . . . 74.230000000000004 110.988 -179.112 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -65.14 -37.65 88.09 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 121.252 0.549 . . . . 72.420000000000002 111.396 178.413 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.09 -1.47 5.99 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.169 1.387 . . . . 34.420000000000002 112.596 177.299 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 35.7 mt -106.83 7.96 30.49 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.895 1.678 . . . . 64.040000000000006 111.106 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.0 t -141.21 19.94 2.26 Favored 'General case' 0 CA--C 1.543 0.673 0 O-C-N 121.409 -0.807 . . . . 74.430000000000007 112.963 -174.098 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 25.8 t -130.84 73.49 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 O-C-N 120.445 -1.409 . . . . 73.430000000000007 107.884 178.234 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 79.9 t -142.15 124.72 14.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 C-N-CA 124.155 0.982 . . . . 74.010000000000005 108.959 175.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.7 t -155.2 -55.66 0.09 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 106.033 -1.839 . . . . 61.399999999999999 106.033 169.402 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.32 88.38 0.09 Allowed 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 122.385 1.088 . . . . 72.420000000000002 109.871 -166.006 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -146.28 158.19 43.86 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 107.537 -1.283 . . . . 64.230000000000004 107.537 148.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -158.92 -164.68 1.47 Allowed 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 104.501 -2.407 . . . . 72.200000000000003 104.501 170.702 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 66.33 -155.75 0.25 Allowed 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 120.207 1.367 . . . . 65.230000000000004 109.231 -179.481 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 65.58 167.49 0.11 Allowed Pre-proline 0 CA--C 1.556 1.188 0 CA-C-N 120.706 1.594 . . . . 72.200000000000003 110.853 -178.878 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -61.47 172.15 3.71 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 CA-C-N 121.211 1.468 . . . . 71.430000000000007 109.855 162.275 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -67.48 92.51 0.22 Allowed Glycine 0 CA--C 1.522 0.515 0 N-CA-C 110.368 -1.093 . . . . 63.32 110.368 -176.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.48 -14.57 32.48 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 118.945 1.372 . . . . 75.010000000000005 111.576 175.343 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 49.44 55.86 8.7 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.544 1.938 . . . . 65.209999999999994 111.049 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -111.12 -58.65 2.08 Favored 'General case' 0 CA--C 1.522 -0.12 0 O-C-N 121.949 -0.47 . . . . 62.140000000000001 110.349 -177.742 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 85.6 t -84.74 -39.66 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 O-C-N 121.528 -0.733 . . . . 73.040000000000006 111.199 -175.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.437 ' CE2' ' HG2' ' A' ' 82' ' ' GLU . 2.3 t80 -74.4 -25.15 59.29 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.503 -0.748 . . . . 63.420000000000002 111.553 179.173 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.7 ttm180 -44.88 -67.77 0.26 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.065 1.746 . . . . 74.049999999999997 112.848 -174.334 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.576 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -55.13 -46.75 75.66 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 126.087 1.755 . . . . 72.340000000000003 110.115 -177.01 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.65 -57.44 11.94 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 125.267 1.427 . . . . 62.219999999999999 110.189 -177.392 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.423 ' HB2' ' CE2' ' A' ' 69' ' ' PHE . . . -65.59 -36.64 84.33 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.998 0.519 . . . . 74.430000000000007 110.906 -175.784 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.82 -47.07 85.02 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.828 0.451 . . . . 54.509999999999998 111.148 176.288 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.06 -48.85 78.39 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 124.906 1.283 . . . . 75.430000000000007 109.873 179.332 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.429 HD11 HD22 ' A' ' 40' ' ' LEU . 11.8 tp -100.84 14.65 31.05 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 125.819 1.647 . . . . 74.340000000000003 112.959 -159.175 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -47.01 119.81 2.74 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 127.315 2.246 . . . . 62.329999999999998 110.987 -174.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 86.53 -1.74 87.27 Favored Glycine 0 CA--C 1.524 0.614 0 C-N-CA 124.657 1.122 . . . . 72.329999999999998 113.571 175.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -124.73 0.47 8.09 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 118.675 1.237 . . . . 70.219999999999999 110.512 -174.579 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -148.98 176.14 10.69 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 125.86 1.664 . . . . 50.530000000000001 109.794 171.761 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -135.69 162.02 33.91 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 126.45 1.9 . . . . 74.239999999999995 107.14 -177.048 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.437 ' HG2' ' CE2' ' A' ' 69' ' ' PHE . 0.3 OUTLIER -54.43 -55.29 30.29 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 124.926 1.29 . . . . 70.209999999999994 111.409 178.499 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -68.7 -31.45 70.56 Favored 'General case' 0 C--O 1.225 -0.201 0 O-C-N 121.529 -0.732 . . . . 74.239999999999995 111.008 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 77.0 m -66.23 -39.48 89.59 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 118.751 -0.643 . . . . 73.409999999999997 109.286 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 75.0 mt -65.62 -48.32 83.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-N 119.795 1.18 . . . . 71.329999999999998 108.89 175.553 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.6 ppt_? -63.43 -36.81 84.97 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 118.771 -0.633 . . . . 73.329999999999998 110.818 -175.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.49 -54.62 21.88 Favored 'General case' 0 N--CA 1.445 -0.72 0 C-N-CA 124.244 1.018 . . . . 70.409999999999997 109.312 174.442 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.404 ' O ' HD22 ' A' ' 92' ' ' LEU . 10.7 tptt -50.07 -51.88 39.01 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 118.828 0.74 . . . . 74.099999999999994 110.62 -171.027 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 12.6 ptp -64.19 -29.56 70.66 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 120.049 -0.66 . . . . 72.319999999999993 112.27 -175.312 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 89.2 t -79.58 -28.34 12.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 124.159 0.984 . . . . 74.430000000000007 111.072 174.883 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -54.0 -51.58 63.48 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 121.217 1.826 . . . . 64.010000000000005 110.432 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.404 HD22 ' O ' ' A' ' 88' ' ' LYS . 0.2 OUTLIER -75.31 6.12 4.84 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.828 0.677 . . . . 65.299999999999997 112.828 -174.167 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 36.2 ttm180 -47.64 -41.12 21.48 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.306 1.442 . . . . 73.329999999999998 112.516 -174.71 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -96.96 -27.39 14.66 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 113.268 0.84 . . . . 53.5 113.268 173.551 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 44.5 m -59.33 -35.61 74.14 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 120.467 -1.395 . . . . 54.329999999999998 110.962 177.593 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -51.44 -45.01 62.5 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.189 0.996 . . . . 73.120000000000005 112.246 -177.5 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.47 -27.21 67.63 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-O 119.167 -0.444 . . . . 72.0 112.09 -178.065 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -80.11 -38.55 31.37 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 109.105 -0.702 . . . . 74.109999999999999 109.105 -178.686 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -55.94 -44.57 78.54 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-O 117.636 -1.173 . . . . 72.409999999999997 112.84 -176.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 20.0 mm -56.1 -49.27 76.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 120.234 1.379 . . . . 73.439999999999998 108.729 178.258 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 53.7 mt -69.93 -7.04 7.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 C-N-CA 125.245 1.418 . . . . 72.109999999999999 111.453 178.589 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 9.5 t -117.45 21.38 13.09 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.853 2.061 . . . . 74.340000000000003 110.767 178.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 -119.53 13.39 12.56 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.926 2.091 . . . . 72.439999999999998 108.604 176.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.255 1.363 0 N-CA-C 108.273 -1.01 . . . . 74.109999999999999 108.273 177.316 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.0 mtm . . . . . 0 N--CA 1.471 0.623 0 N-CA-C 107.531 -1.285 . . . . 73.530000000000001 107.531 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.89 20.02 3.5 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 119.67 1.123 . . . . 52.109999999999999 111.824 -163.506 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 63.48 -173.44 0.16 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.39 1.476 . . . . 74.340000000000003 110.374 -169.562 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -59.68 154.23 18.38 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 124.588 1.155 . . . . 74.409999999999997 109.578 167.041 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -85.86 156.47 20.53 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 107.48 -1.304 . . . . 51.439999999999998 107.48 151.054 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -147.6 -60.66 0.27 Allowed 'General case' 0 C--O 1.235 0.34 0 N-CA-C 106.355 -1.72 . . . . 71.239999999999995 106.355 -179.769 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 26.0 ptt-85 -53.63 164.82 0.48 Allowed 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 126.777 2.031 . . . . 72.540000000000006 111.444 162.292 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -68.23 -81.71 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.659 0.784 . . . . 73.400000000000006 110.258 174.724 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 32.6 mtp180 -147.17 -70.46 0.23 Allowed 'General case' 0 N--CA 1.465 0.321 0 O-C-N 121.221 -0.924 . . . . 55.509999999999998 109.815 -157.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 44.69 73.92 0.14 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 127.716 2.406 . . . . 63.0 111.224 -176.165 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -132.83 -163.45 1.35 Allowed 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 127.086 2.155 . . . . 75.099999999999994 107.942 178.877 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . 0.256 12.9 pt-20 49.69 81.72 0.06 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.911 1.685 . . . . 73.209999999999994 111.461 -176.849 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.42 39.64 14.9 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 126.288 1.835 . . . . 63.210000000000001 112.756 -177.167 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.3 mmtt -107.38 -9.46 16.01 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 125.166 1.386 . . . . 75.200000000000003 112.487 -178.237 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -51.15 -31.22 19.08 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.006 1.322 . . . . 75.120000000000005 113.817 176.754 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.33 -8.11 29.86 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.438 1.095 . . . . 61.009999999999998 113.169 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 18.0 t-80 -117.88 161.2 20.14 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 126.648 1.979 . . . . 71.340000000000003 107.63 -175.5 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 58.18 -158.07 0.29 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.405 1.082 . . . . 75.129999999999995 109.133 177.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -136.33 -34.11 0.79 Allowed 'General case' 0 C--O 1.223 -0.312 0 C-N-CA 124.277 1.031 . . . . 74.200000000000003 109.222 159.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -45.92 -40.36 10.07 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 125.074 1.35 . . . . 74.299999999999997 111.939 177.748 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 18.7 mt -66.16 -39.45 89.8 Favored 'General case' 0 C--N 1.331 -0.201 0 O-C-N 120.936 -1.102 . . . . 64.409999999999997 110.918 -175.377 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -76.76 -26.64 54.76 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.365 1.466 . . . . 62.219999999999999 110.611 174.386 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -55.36 -39.88 70.61 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.811 1.244 . . . . 72.310000000000002 111.229 -169.697 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.496 ' HE2' HD12 ' A' ' 100' ' ' ILE . 16.1 ptmt -54.38 -46.5 73.07 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 120.692 -1.255 . . . . 72.5 111.259 175.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.609 ' HB1' ' HA ' ' A' ' 97' ' ' ARG . . . -65.38 -58.71 5.22 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 125.693 1.597 . . . . 74.0 110.847 179.423 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -67.82 -3.45 9.6 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.06 0.763 . . . . 54.240000000000002 113.06 -176.713 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -116.38 11.41 14.97 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.675 1.99 . . . . 64.310000000000002 112.888 171.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.6 mmt-85 -74.84 -14.42 60.68 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 119.626 -1.921 . . . . 64.430000000000007 112.543 175.2 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -47.17 -72.41 0.05 Allowed 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 127.37 2.268 . . . . 72.329999999999998 112.819 -163.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -74.13 -5.91 44.55 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 120.76 1.618 . . . . 60.119999999999997 112.993 -177.544 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.14 -34.98 66.4 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 121.143 1.792 . . . . 74.439999999999998 111.624 -177.027 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.25 -11.76 58.47 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 112.464 0.542 . . . . 55.32 112.464 -175.674 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -66.93 -22.26 65.95 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 126.103 1.761 . . . . 73.340000000000003 114.239 -171.159 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -70.08 -31.75 69.38 Favored Glycine 0 C--O 1.224 -0.487 0 C-N-CA 120.608 -0.806 . . . . 74.0 111.301 -179.397 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 75.4 mt-10 -64.65 -33.58 76.26 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 124.035 0.934 . . . . 74.310000000000002 111.517 -172.728 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 9.0 t90 -58.07 -77.74 0.03 OUTLIER 'General case' 0 C--O 1.233 0.194 0 C-N-CA 124.518 1.127 . . . . 75.230000000000004 108.08 168.537 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.426 ' HB1' HD13 ' A' ' 76' ' ' LEU . . . -57.28 -29.18 63.64 Favored 'General case' 0 C--O 1.218 -0.565 0 C-N-CA 125.886 1.674 . . . . 74.439999999999998 112.745 -168.305 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -46.16 -54.56 8.45 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 120.321 1.419 . . . . 54.420000000000002 112.038 176.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -57.86 -40.42 93.05 Favored Glycine 0 CA--C 1.531 1.033 0 CA-C-N 118.707 0.685 . . . . 74.129999999999995 111.443 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.4 mp -63.06 -42.58 99.74 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.364 1.466 . . . . 70.349999999999994 110.362 178.085 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.5 mp -70.08 -0.58 7.93 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 127.899 2.479 . . . . 72.129999999999995 113.198 172.754 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 71.96 25.54 74.54 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 124.862 1.22 . . . . 71.140000000000001 112.523 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 45.1 mttt -107.98 148.51 29.6 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 125.329 1.452 . . . . 74.530000000000001 108.629 174.029 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.0 p -142.95 166.78 23.7 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-O 121.283 0.563 . . . . 71.239999999999995 110.767 171.538 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 67.13 -113.69 5.79 Favored Glycine 0 N--CA 1.444 -0.793 0 C-N-CA 124.881 1.229 . . . . 74.109999999999999 110.965 168.418 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -73.44 -41.85 62.71 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.207 -0.497 . . . . 71.340000000000003 111.304 -171.236 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.22 -36.37 82.87 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 110.158 -0.312 . . . . 74.209999999999994 110.158 178.19 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.54 -43.81 93.41 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 122.91 0.484 . . . . 64.340000000000003 110.86 173.571 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.7 ttt180 -65.27 -47.77 75.51 Favored 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 124.221 1.008 . . . . 73.010000000000005 108.959 179.323 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.83 -48.13 78.04 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 118.888 -0.577 . . . . 51.130000000000003 110.354 -176.187 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 45.4 t80 -50.6 -52.6 37.73 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 124.157 0.983 . . . . 74.310000000000002 110.03 172.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.56 -26.55 55.4 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 113.219 0.822 . . . . 64.209999999999994 113.219 178.845 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 16.3 mt -76.35 -16.95 59.63 Favored 'General case' 0 C--N 1.333 -0.148 0 O-C-N 120.63 -1.294 . . . . 64.299999999999997 111.486 -175.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.6 t -121.26 -8.09 9.25 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 119.965 1.257 . . . . 73.540000000000006 112.664 -172.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 4.7 p -73.19 3.04 1.02 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.095 0 N-CA-C 115.53 1.678 . . . . 63.299999999999997 115.53 -173.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 70.4 t -78.14 110.49 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 O-C-N 119.261 -2.149 . . . . 73.109999999999999 109.315 -168.359 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.7 p -79.82 -85.98 0.08 Allowed 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.611 1.165 . . . . 54.299999999999997 110.823 177.651 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.4 t -161.42 -86.48 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 107.053 -1.462 . . . . 72.430000000000007 107.053 -176.412 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -170.75 162.38 7.66 Favored 'General case' 0 C--N 1.343 0.291 0 C-N-CA 124.476 1.111 . . . . 60.409999999999997 111.131 173.081 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -83.02 -176.43 6.33 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.89 1.276 . . . . 75.540000000000006 111.894 175.169 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 74.56 -176.98 0.15 Allowed 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 128.76 2.824 . . . . 75.420000000000002 109.575 -166.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 64.73 79.82 0.24 Allowed Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 126.531 1.932 . . . . 62.509999999999998 112.183 166.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.44 95.91 0.47 Allowed 'Trans proline' 0 N--CA 1.458 -0.612 0 C-N-CA 123.304 2.669 . . . . 61.43 110.136 -174.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 178.53 -49.69 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.407 0 CA-C-O 118.473 -1.181 . . . . 72.299999999999997 111.295 176.227 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -52.22 -49.85 63.14 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 125.853 1.661 . . . . 71.5 110.489 -169.648 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.635 ' HG2' ' H ' ' A' ' 67' ' ' ASP 0.271 10.5 tt0 59.85 -164.05 0.22 Allowed 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 125.042 1.337 . . . . 40.43 108.906 -169.417 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.635 ' H ' ' HG2' ' A' ' 66' ' ' GLU 0.299 44.0 m-20 67.77 -48.05 0.51 Allowed 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 129.978 3.311 . . . . 55.039999999999999 112.277 -172.082 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.4 t -48.96 -61.61 0.54 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 C-N-CA 125.628 1.571 . . . . 75.510000000000005 111.13 177.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.445 ' CE2' HD12 ' A' ' 85' ' ' ILE . 17.7 t80 -71.08 -42.35 69.48 Favored 'General case' 0 CA--C 1.527 0.061 0 C-N-CA 123.611 0.764 . . . . 64.230000000000004 110.647 177.248 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -51.84 -50.25 61.26 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.365 1.066 . . . . 63.210000000000001 110.334 -173.115 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -67.95 -37.8 82.02 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 118.874 -0.584 . . . . 64.519999999999996 110.672 -175.404 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.511 HD22 HD22 ' A' ' 76' ' ' LEU . 0.7 OUTLIER -64.89 -52.46 56.4 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-N 119.062 0.846 . . . . 55.299999999999997 110.276 174.853 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.24 -21.06 65.99 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.629 1.104 . . . . 54.229999999999997 112.365 -177.237 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.99 -63.7 1.01 Allowed 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.892 0.877 . . . . 75.230000000000004 110.606 166.412 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.61 -21.71 66.6 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.859 0.863 . . . . 71.409999999999997 112.698 -174.049 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.897 HD23 ' HB2' ' A' ' 80' ' ' ALA . 10.3 tp -113.1 19.29 17.3 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.918 2.487 . . . . 74.549999999999997 110.79 -171.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -51.23 110.24 0.42 Allowed 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.586 1.954 . . . . 62.210000000000001 108.821 171.082 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 94.62 0.14 64.85 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 125.187 1.375 . . . . 62.350000000000001 114.319 178.698 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.6 7.45 5.28 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.956 1.702 . . . . 64.150000000000006 111.5 178.803 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.897 ' HB2' HD23 ' A' ' 76' ' ' LEU . . . -135.21 176.98 8.17 Favored 'General case' 0 C--O 1.233 0.234 0 O-C-N 120.87 -1.144 . . . . 52.409999999999997 111.116 177.072 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -138.24 168.62 19.36 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 114.168 -1.378 . . . . 73.420000000000002 107.659 158.733 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 87.5 mt-10 -66.09 -19.19 65.77 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 112.195 -2.275 . . . . 72.400000000000006 111.442 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -110.15 -8.93 14.72 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.022 0.828 . . . . 75.109999999999999 111.403 177.741 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.1 m -84.2 -41.36 17.06 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.641 -0.662 . . . . 72.239999999999995 110.678 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.445 HD12 ' CE2' ' A' ' 69' ' ' PHE . 79.5 mt -60.2 -44.63 95.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-N 119.727 1.149 . . . . 55.210000000000001 109.504 -179.018 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -58.71 -24.94 62.36 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 118.34 0.518 . . . . 62.420000000000002 112.218 178.208 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -94.12 -5.52 47.05 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 118.548 -0.739 . . . . 34.119999999999997 111.943 -178.721 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -93.23 -64.52 1.08 Allowed 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 120.046 1.293 . . . . 64.200000000000003 110.154 173.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 2.0 mtm -64.71 -29.09 70.07 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 119.597 -0.841 . . . . 75.540000000000006 111.62 -161.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 27.4 t -63.51 -47.53 91.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 125.106 1.362 . . . . 52.100000000000001 110.795 176.818 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -59.65 -45.99 90.35 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 119.301 0.955 . . . . 54.420000000000002 111.23 -170.062 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.3 mt -72.38 -0.74 13.21 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 125.126 1.37 . . . . 63.219999999999999 110.704 -167.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 45.3 ttt180 -51.17 -38.6 53.1 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 124.254 1.022 . . . . 74.329999999999998 110.764 164.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.01 -53.31 40.25 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.974 0.807 . . . . 43.219999999999999 110.711 176.165 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.0 m -54.7 -31.27 57.74 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.027 1.731 . . . . 52.219999999999999 111.283 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.7 -53.37 59.12 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.431 1.092 . . . . 74.299999999999997 112.313 -178.783 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.609 ' HA ' ' HB1' ' A' ' 25' ' ' ALA . 14.6 ptm180 -70.43 -37.55 74.41 Favored 'General case' 0 CA--C 1.519 -0.229 0 C-N-CA 120.053 -0.659 . . . . 64.329999999999998 110.991 179.232 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -59.0 -46.29 88.55 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-O 118.072 -0.966 . . . . 63.109999999999999 111.488 -174.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -59.62 -31.98 69.99 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 119.029 0.831 . . . . 62.030000000000001 112.791 -174.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.496 HD12 ' HE2' ' A' ' 24' ' ' LYS . 27.2 mm -73.39 -38.2 52.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 O-C-N 121.224 -0.922 . . . . 73.329999999999998 110.374 177.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 82.3 mt -74.76 -13.63 15.54 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 C-N-CA 124.187 0.995 . . . . 74.099999999999994 109.191 177.325 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 16.1 t -85.62 -40.82 15.81 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.213 1.405 . . . . 40.310000000000002 108.154 174.628 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -128.71 65.61 1.42 Allowed 'General case' 0 C--O 1.239 0.541 0 C-N-CA 124.745 1.218 . . . . 71.200000000000003 107.781 -169.444 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.414 HD12 ' H ' ' A' ' 104' ' ' ILE . 5.1 mp . . . . . 0 C--O 1.253 1.286 0 N-CA-C 107.403 -1.332 . . . . 72.030000000000001 107.403 176.499 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.2 mtt . . . . . 0 N--CA 1.469 0.492 0 N-CA-C 106.863 -1.532 . . . . 61.409999999999997 106.863 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.4 t -103.31 -25.45 13.31 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.854 1.262 . . . . 70.400000000000006 111.923 -161.511 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.2 m 44.95 44.57 8.12 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.641 1.576 . . . . 70.219999999999999 112.559 175.87 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 47.26 70.41 0.41 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 126.827 2.051 . . . . 73.219999999999999 111.499 -168.116 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -60.82 141.71 56.79 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 123.42 0.688 . . . . 32.530000000000001 109.522 -178.606 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -152.63 -85.27 0.07 Allowed 'General case' 0 N--CA 1.445 -0.724 0 CA-C-O 118.773 -0.632 . . . . 72.230000000000004 110.015 -173.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 71.7 mtm180 -117.27 60.08 0.76 Allowed 'General case' 0 CA--C 1.518 -0.285 0 C-N-CA 125.201 1.4 . . . . 70.400000000000006 107.557 -175.035 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -65.9 -29.52 69.97 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.721 1.209 . . . . 62.520000000000003 112.209 -175.08 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.8 -164.76 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.542 1.537 . . . . 72.400000000000006 113.434 178.752 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 57.22 46.76 18.19 Favored 'General case' 0 C--O 1.227 -0.101 0 C-N-CA 127.026 2.131 . . . . 63.100000000000001 111.488 -176.32 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -64.53 1.36 0.83 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 114.39 1.256 . . . . 65.409999999999997 114.39 167.242 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -50.94 98.38 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 127.232 2.213 . . . . 72.510000000000005 110.676 179.469 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 53.05 11.85 0.25 Allowed 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 115.846 1.795 . . . . 54.200000000000003 115.846 -171.702 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 54.3 mttt -84.71 -4.04 58.84 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 124.691 1.197 . . . . 65.519999999999996 113.192 177.153 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -55.18 -30.36 59.74 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 120.927 1.694 . . . . 73.209999999999994 112.445 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -77.76 5.51 9.28 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.749 1.018 . . . . 70.5 113.749 179.478 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 10.2 t-80 -143.47 176.61 9.05 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.607 1.563 . . . . 64.219999999999999 109.472 -176.353 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 62.76 -171.8 0.16 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.87 1.668 . . . . 73.239999999999995 111.992 165.828 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -118.3 -35.82 3.71 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 124.713 1.205 . . . . 72.099999999999994 110.001 171.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.3 mp0 -45.08 -50.25 11.12 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 127.409 2.284 . . . . 74.439999999999998 112.327 -172.612 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.78 ' H ' HD22 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -75.23 -44.18 47.63 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 124.255 1.022 . . . . 74.420000000000002 111.568 -176.882 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -57.51 -44.97 85.44 Favored 'General case' 0 C--O 1.219 -0.527 0 C-N-CA 125.017 1.327 . . . . 73.209999999999994 109.988 178.227 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.72 -48.22 66.81 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.006 1.322 . . . . 73.239999999999995 110.249 -177.868 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 42.3 mttp -61.48 -57.65 11.32 Favored 'General case' 0 C--O 1.232 0.175 0 O-C-N 121.584 -0.697 . . . . 50.420000000000002 110.352 171.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -71.98 -16.16 62.07 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 114.248 1.203 . . . . 65.030000000000001 114.248 -165.701 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -62.48 -50.82 69.92 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 127.561 2.344 . . . . 74.030000000000001 108.783 167.027 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.57 16.95 17.4 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 114.333 1.234 . . . . 54.399999999999999 114.333 -145.393 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -109.86 -6.97 15.07 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 116.301 1.963 . . . . 71.200000000000003 116.301 -154.758 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.9 ptt180 -62.64 -16.62 57.71 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 121.375 1.898 . . . . 65.120000000000005 115.319 -170.679 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -116.95 -13.4 10.64 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 126.346 1.859 . . . . 70.109999999999999 112.636 173.248 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.1 -8.32 11.64 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 121.575 1.989 . . . . 70.430000000000007 113.625 -175.583 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.468 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.4 pt? -104.68 -3.2 23.98 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 126.457 1.903 . . . . 63.219999999999999 114.697 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 35.6 tp -68.71 -35.3 76.99 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 123.759 0.824 . . . . 74.120000000000005 111.043 -176.219 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -57.09 -42.87 93.36 Favored Glycine 0 C--O 1.221 -0.715 0 CA-C-O 118.78 -1.011 . . . . 53.219999999999999 110.72 166.662 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -64.77 -16.74 63.42 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 118.924 1.362 . . . . 74.329999999999998 112.369 -176.041 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 14.2 t90 -80.64 -63.7 1.35 Allowed 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.955 0.902 . . . . 74.040000000000006 109.137 164.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.7 -29.67 27.94 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.577 1.551 . . . . 54.219999999999999 114.189 -174.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.02 -61.51 2.22 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 125.927 1.691 . . . . 65.200000000000003 111.385 -177.459 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.85 -15.53 58.09 Favored Glycine 0 CA--C 1.531 1.082 0 CA-C-N 118.709 0.686 . . . . 71.040000000000006 113.153 -177.604 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 19.8 mt -76.69 -43.91 35.81 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.789 1.236 . . . . 72.200000000000003 109.215 173.792 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.451 HD23 ' HE3' ' A' ' 79' ' ' LYS . 24.2 mt -71.33 1.66 5.89 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.955 2.102 . . . . 64.340000000000003 112.001 165.824 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.05 0.5 44.02 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.763 1.649 . . . . 61.200000000000003 114.278 -177.738 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -65.51 127.52 32.17 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 125.386 1.474 . . . . 72.340000000000003 107.431 173.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.6 p -140.69 147.52 39.38 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.408 -0.59 . . . . 73.040000000000006 109.408 -179.461 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 82.27 -129.89 9.35 Favored Glycine 0 C--N 1.33 0.23 0 N-CA-C 111.17 -0.772 . . . . 74.319999999999993 111.17 172.414 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -70.04 -28.31 65.36 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.353 -0.61 . . . . 71.040000000000006 109.353 179.305 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -62.49 -41.29 98.7 Favored 'General case' 0 CA--C 1.514 -0.424 0 C-N-CA 125.181 1.392 . . . . 71.230000000000004 111.131 177.414 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.85 -57.26 7.35 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 107.385 -1.339 . . . . 54.140000000000001 107.385 172.693 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.07 -51.85 29.06 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 118.62 0.645 . . . . 74.200000000000003 112.116 -175.449 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.47 -38.65 90.64 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.009 1.323 . . . . 74.420000000000002 111.799 -179.177 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -62.73 -44.1 97.08 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.923 0.889 . . . . 71.239999999999995 110.289 174.392 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.4 -27.11 68.78 Favored 'General case' 0 CA--C 1.53 0.182 0 O-C-N 121.299 -0.875 . . . . 71.329999999999998 112.992 -176.476 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 9.2 mt -60.28 -49.02 79.27 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 119.031 0.832 . . . . 71.319999999999993 108.861 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.5 t -76.25 6.19 5.85 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 125.155 1.382 . . . . 74.329999999999998 112.04 179.242 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 98.6 t -119.48 94.04 2.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 C-N-CA 125.355 1.462 . . . . 63.020000000000003 108.41 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.5 p -140.93 157.46 22.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 106.533 -1.654 . . . . 73.010000000000005 106.533 155.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 13.4 t -171.49 -170.77 0.84 Allowed 'General case' 0 C--O 1.239 0.547 0 C-N-CA 126.233 1.813 . . . . 51.43 106.562 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 49.1 m -134.91 46.85 2.4 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.224 1.41 . . . . 73.0 110.07 -177.674 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -60.23 149.53 32.9 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 123.367 0.667 . . . . 72.319999999999993 111.92 -176.107 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 52.32 158.58 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 131.053 3.741 . . . . 74.239999999999995 112.615 -173.437 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 68.31 -24.46 0.13 Allowed 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 125.672 1.589 . . . . 65.140000000000001 113.328 -176.879 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -67.17 157.0 86.62 Favored Pre-proline 0 C--O 1.242 0.676 0 CA-C-N 119.308 0.958 . . . . 72.230000000000004 110.512 162.719 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -85.27 63.94 6.0 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 123.122 2.548 . . . . 70.040000000000006 111.865 -166.256 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -132.07 -170.99 12.7 Favored Glycine 0 CA--C 1.525 0.704 0 C-N-CA 126.472 1.987 . . . . 65.030000000000001 109.61 178.246 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -120.66 -74.76 0.6 Allowed 'General case' 0 C--O 1.233 0.228 0 N-CA-C 107.498 -1.297 . . . . 61.130000000000003 107.498 176.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -106.64 4.08 27.53 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.958 1.303 . . . . 74.120000000000005 112.431 178.229 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -72.81 -15.25 61.63 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.908 1.283 . . . . 45.43 113.749 -151.287 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 67.5 t -106.33 -41.57 6.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 O-C-N 120.331 -1.481 . . . . 73.400000000000006 109.684 168.266 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -49.6 -37.59 28.36 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.282 1.033 . . . . 74.120000000000005 111.438 176.518 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.0 -28.25 16.3 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.647 1.579 . . . . 72.140000000000001 113.932 175.329 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -86.25 -41.6 14.48 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 108.529 -0.915 . . . . 62.039999999999999 108.529 -176.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.21 -52.82 11.26 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.407 0.683 . . . . 74.340000000000003 110.728 -178.722 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.34 -21.92 66.75 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 125.17 1.388 . . . . 74.010000000000005 111.356 -175.362 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.25 -41.84 96.77 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 118.461 0.573 . . . . 73.219999999999999 111.001 169.254 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.02 -53.33 15.15 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 107.954 -1.128 . . . . 70.239999999999995 107.954 177.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.522 ' HA ' ' HE2' ' A' ' 79' ' ' LYS . 65.5 mt -83.91 33.12 0.48 Allowed 'General case' 0 C--O 1.233 0.218 0 C-N-CA 125.551 1.54 . . . . 74.319999999999993 111.794 -179.393 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -67.64 121.06 15.08 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 106.429 -1.693 . . . . 74.329999999999998 106.429 175.504 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 85.44 -0.27 88.4 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 124.977 1.275 . . . . 74.120000000000005 113.756 -173.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.522 ' HE2' ' HA ' ' A' ' 76' ' ' LEU . 36.3 mtmm -135.6 -5.28 2.25 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 118.744 1.272 . . . . 72.019999999999996 113.224 -161.944 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -164.07 122.4 1.85 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-N 119.99 1.268 . . . . 41.130000000000003 110.531 179.024 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.85 161.27 29.13 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.334 1.054 . . . . 64.0 108.896 175.196 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -49.08 -52.66 24.41 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 126.01 1.724 . . . . 73.329999999999998 108.664 165.382 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -66.78 -8.39 28.05 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.177 1.391 . . . . 72.120000000000005 112.225 -171.544 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 17.9 m -111.88 -44.18 3.5 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 126.512 1.925 . . . . 73.439999999999998 110.319 -179.77 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 74.5 mt -52.46 -56.46 6.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-N 119.654 1.115 . . . . 44.140000000000001 108.276 172.785 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -56.5 -29.95 62.43 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 123.515 0.726 . . . . 74.310000000000002 112.015 -175.125 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -84.16 -50.18 8.16 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 124.435 1.094 . . . . 65.239999999999995 109.242 -174.334 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.8 tppt? -60.17 -36.36 77.4 Favored 'General case' 0 N--CA 1.463 0.19 0 O-C-N 121.749 -0.594 . . . . 72.329999999999998 111.313 -173.66 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 28.7 mtt -54.26 -52.81 60.2 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.864 0.466 . . . . 63.130000000000003 109.775 173.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 79.3 t -61.78 -30.65 48.88 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 125.376 1.47 . . . . 70.099999999999994 110.854 -177.487 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 62.1 tt0 -69.5 -52.4 26.87 Favored 'General case' 0 CA--C 1.53 0.186 0 O-C-N 121.062 -1.024 . . . . 71.129999999999995 110.274 174.083 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 38.9 mt -67.52 -24.86 65.61 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.309 1.044 . . . . 73.420000000000002 110.44 -176.284 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 42.0 ttp180 -56.93 -33.39 66.93 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 124.955 1.302 . . . . 54.100000000000001 110.605 174.336 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -68.26 -47.88 66.53 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 118.533 -0.746 . . . . 63.130000000000003 111.11 177.128 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 31.0 m -56.0 -81.87 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 126.582 1.953 . . . . 71.310000000000002 110.098 -178.305 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 43.55 -75.03 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.306 1 C-N-CA 132.874 4.47 . . . . 72.310000000000002 113.983 165.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 20.0 ptt-85 -66.6 -40.24 88.77 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.235 -0.893 . . . . 74.230000000000004 109.727 -177.773 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -59.78 -36.16 76.13 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-O 117.973 -1.013 . . . . 71.140000000000001 110.589 -177.538 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -57.98 -42.18 84.56 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 118.981 0.81 . . . . 65.030000000000001 111.291 -177.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 24.1 mm -56.81 -45.49 83.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-N 119.775 1.171 . . . . 65.400000000000006 109.6 176.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 27.8 mt -74.15 -17.53 16.99 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 C-N-CA 124.379 1.072 . . . . 74.530000000000001 110.075 -177.841 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 21.0 t -87.38 -0.9 57.46 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.142 1.777 . . . . 74.120000000000005 110.578 172.572 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 78.8 mt-10 -132.12 42.61 3.12 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 126.325 1.85 . . . . 74.329999999999998 107.536 -166.143 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.0 mt . . . . . 0 C--O 1.251 1.18 0 N-CA-C 105.328 -2.101 . . . . 74.430000000000007 105.328 169.647 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.471 0.602 0 N-CA-C 106.843 -1.54 . . . . 75.530000000000001 106.843 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.3 m -150.5 101.34 2.95 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 107.843 -1.169 . . . . 64.109999999999999 107.843 -174.044 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 10.9 p -140.27 120.85 14.21 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 123.958 0.903 . . . . 74.219999999999999 108.587 -173.821 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -159.32 174.13 15.23 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.379 1.472 . . . . 73.120000000000005 107.916 170.465 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -64.86 -168.53 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 129.544 3.138 . . . . 74.099999999999994 113.179 -176.592 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -56.66 115.43 2.54 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 125.295 1.438 . . . . 62.200000000000003 111.426 -177.907 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.8 mtm180 -122.08 165.59 15.82 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 125.974 1.71 . . . . 73.109999999999999 108.618 -178.505 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.62 169.78 3.7 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 124.954 1.302 . . . . 73.099999999999994 114.132 -166.705 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.15 157.74 3.31 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 113.659 -1.609 . . . . 55.0 112.628 -162.316 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -124.3 61.37 1.12 Allowed 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 124.573 1.149 . . . . 71.540000000000006 110.46 -165.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -149.57 177.07 10.07 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.356 1.462 . . . . 73.099999999999994 112.809 -176.427 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . 0.285 5.1 pt-20 44.65 -84.98 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 128.998 2.919 . . . . 73.310000000000002 114.318 -178.91 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.91 -22.1 64.02 Favored 'General case' 0 N--CA 1.462 0.163 0 O-C-N 121.243 -0.911 . . . . 74.329999999999998 113.214 176.263 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.529 ' HB3' HD13 ' A' ' 21' ' ' LEU . 3.4 mptt -64.96 -19.52 66.0 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-O 117.034 -1.46 . . . . 75.129999999999995 113.798 171.796 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -54.29 -39.83 67.3 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 121.699 2.045 . . . . 62.43 112.278 -177.662 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.65 -11.47 45.1 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.451 1.1 . . . . 54.039999999999999 113.467 177.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 -104.24 164.05 11.99 Favored 'General case' 0 N--CA 1.445 -0.705 0 C-N-CA 126.732 2.013 . . . . 74.420000000000002 108.422 177.31 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 51.34 -154.93 0.15 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.402 1.081 . . . . 74.129999999999995 108.571 -176.02 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -133.99 -19.83 1.99 Allowed 'General case' 0 C--O 1.222 -0.363 0 C-N-CA 125.038 1.335 . . . . 71.129999999999995 109.086 148.522 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -44.21 -43.37 7.15 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 127.437 2.295 . . . . 54.229999999999997 111.959 177.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.529 HD13 ' HB3' ' A' ' 14' ' ' LYS . 11.9 mt -67.83 -44.15 77.91 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 125.649 1.58 . . . . 61.140000000000001 111.56 -176.442 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -83.88 -20.72 32.58 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 123.6 0.76 . . . . 74.420000000000002 111.813 -178.248 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.29 -55.13 19.9 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 124.257 1.023 . . . . 61.530000000000001 109.081 -169.606 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.7 pttp -45.01 -53.44 7.75 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 124.793 1.237 . . . . 72.420000000000002 113.36 176.369 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.592 ' HB1' ' HA ' ' A' ' 97' ' ' ARG . . . -52.83 -57.1 11.31 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.11 0.964 . . . . 72.519999999999996 110.335 -179.615 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -78.16 13.42 1.48 Allowed 'General case' 0 C--O 1.242 0.684 0 C-N-CA 124.568 1.147 . . . . 74.420000000000002 112.76 -176.318 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.1 3.21 2.63 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 124.823 1.249 . . . . 75.400000000000006 112.656 -173.351 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.94 7.48 13.22 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.655 1.116 . . . . 74.230000000000004 113.994 -173.185 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 20.3 ptt-85 -60.19 -33.69 72.57 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 121.025 1.738 . . . . 72.230000000000004 109.874 177.289 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.448 ' HB3' HG13 ' A' ' 56' ' ' VAL . 0.4 OUTLIER -70.63 -12.5 61.6 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 120.547 -1.346 . . . . 72.120000000000005 112.606 -179.762 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -81.71 -50.7 8.98 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 120.41 1.459 . . . . 64.219999999999999 109.516 -175.726 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.29 -13.37 62.35 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 115.633 -0.712 . . . . 75.439999999999998 112.452 -179.693 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 17.0 mt -58.36 -32.18 68.31 Favored 'General case' 0 N--CA 1.468 0.448 0 O-C-N 120.645 -1.284 . . . . 63.240000000000002 111.457 171.499 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -72.98 -6.56 68.22 Favored Glycine 0 CA--C 1.528 0.882 0 O-C-N 121.25 -0.906 . . . . 52.350000000000001 112.28 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -83.09 -20.52 34.72 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 120.94 -1.329 . . . . 73.340000000000003 111.822 171.372 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 36.7 t90 -74.68 -82.06 0.07 Allowed 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.336 1.054 . . . . 74.329999999999998 108.668 179.511 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.68 -17.25 21.0 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.211 1.404 . . . . 51.450000000000003 113.791 -171.455 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -51.66 -55.44 19.42 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.174 0.59 . . . . 71.340000000000003 110.363 172.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -62.26 -41.98 99.72 Favored Glycine 0 CA--C 1.527 0.814 0 N-CA-C 111.276 -0.73 . . . . 31.530000000000001 111.276 -175.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.0 mp -56.56 -34.11 66.8 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.57 1.548 . . . . 72.439999999999998 111.695 176.751 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 71.8 mt -94.54 4.37 53.94 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.766 2.027 . . . . 62.439999999999998 112.456 176.134 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 76.41 42.58 22.39 Favored Glycine 0 CA--C 1.527 0.833 0 O-C-N 120.849 -1.157 . . . . 52.439999999999998 113.109 176.314 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 30.5 mttm -127.34 132.66 50.18 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 126.358 1.863 . . . . 74.530000000000001 108.038 176.477 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 45.3 p -134.45 -179.1 5.37 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 124.797 1.239 . . . . 71.430000000000007 108.094 164.85 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 46.49 -123.08 6.92 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 125.398 1.475 . . . . 73.519999999999996 113.318 173.164 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -63.49 -31.42 72.58 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 117.405 0.602 . . . . 72.239999999999995 112.372 -174.394 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -77.07 -40.26 46.79 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.677 0.751 . . . . 64.409999999999997 110.846 -177.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.12 -33.3 74.2 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.846 -0.616 . . . . 74.510000000000005 110.272 168.367 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 7.0 ttm-85 -58.24 -55.95 28.4 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.417 -0.957 . . . . 75.450000000000003 108.417 173.881 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.68 -43.01 80.05 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.852 1.261 . . . . 74.310000000000002 111.103 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -60.67 -41.92 96.05 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.347 1.059 . . . . 54.420000000000002 111.344 175.538 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.97 -0.49 18.92 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 120.476 -1.39 . . . . 72.540000000000006 113.345 -178.547 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.4 mt -79.42 5.31 13.02 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 120.782 1.628 . . . . 74.409999999999997 112.331 177.803 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.31 -22.46 1.75 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.534 1.133 . . . . 64.319999999999993 112.466 -174.757 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 35.6 m -64.43 -12.08 11.66 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 N-CA-C 115.526 1.676 . . . . 74.439999999999998 115.526 -171.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.448 HG13 ' HB3' ' A' ' 30' ' ' ASN . 9.9 t -88.23 115.85 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 N-CA-C 107.935 -1.135 . . . . 72.209999999999994 107.935 -170.678 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.2 t -139.8 -53.69 0.54 Allowed 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 126.304 1.841 . . . . 73.25 106.359 -178.21 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.7 t 64.62 50.67 2.07 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.264 1.426 . . . . 74.109999999999999 110.432 176.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -132.08 117.68 18.66 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 104.251 -2.5 . . . . 60.420000000000002 104.251 -178.288 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.425 ' CZ ' ' HB3' ' A' ' 86' ' ' ARG . 0.2 OUTLIER -176.9 38.24 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.687 1.595 . . . . 74.099999999999994 109.491 177.16 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -119.07 -8.35 10.21 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 120.352 -1.468 . . . . 61.439999999999998 111.366 -163.921 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -140.63 162.42 49.17 Favored Pre-proline 0 CA--C 1.54 0.589 0 C-N-CA 125.528 1.531 . . . . 54.020000000000003 111.325 -171.735 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -73.2 -9.86 23.7 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 123.952 3.102 . . . . 63.439999999999998 113.701 -174.282 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -105.08 16.09 46.65 Favored Glycine 0 CA--C 1.526 0.75 0 C-N-CA 124.847 1.213 . . . . 74.349999999999994 111.801 178.685 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -93.88 4.39 54.0 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.314 1.057 . . . . 71.120000000000005 111.397 -179.129 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -53.96 -38.26 64.8 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 119.505 1.048 . . . . 71.319999999999993 112.085 -172.203 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -59.45 -25.38 64.33 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-O 119.033 -0.508 . . . . 75.140000000000001 111.298 -177.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.439 ' HA ' ' HE3' ' A' ' 71' ' ' LYS . 57.3 t -63.16 -36.74 77.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-N 119.255 0.934 . . . . 54.009999999999998 110.305 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -89.74 -19.1 25.17 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 123.797 0.839 . . . . 40.229999999999997 110.189 -179.181 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.5 -36.17 79.74 Favored 'General case' 0 CA--C 1.522 -0.133 0 N-CA-C 115.154 1.539 . . . . 74.540000000000006 115.154 -167.869 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.686 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -68.74 -53.44 21.93 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 106.635 -1.617 . . . . 61.240000000000002 106.635 -175.508 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -47.6 -61.39 1.96 Allowed 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 126.102 1.761 . . . . 71.150000000000006 109.064 172.881 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.89 -42.98 76.77 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 124.154 0.909 . . . . 35.210000000000001 111.405 -171.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -75.53 -35.64 60.68 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.776 1.028 . . . . 75.209999999999994 113.776 -179.531 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -73.75 -44.07 57.28 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 120.904 -1.123 . . . . 63.520000000000003 109.419 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 12.6 tp -86.04 13.76 7.21 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 128.332 2.653 . . . . 71.549999999999997 110.681 -179.28 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -55.73 123.08 12.94 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 125.407 1.483 . . . . 74.25 108.43 -178.304 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 98.75 -11.43 62.72 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 124.787 1.184 . . . . 63.549999999999997 113.728 -174.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.5 mtmm -128.71 6.6 5.62 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 119.058 1.429 . . . . 74.140000000000001 112.534 -171.387 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -146.92 174.32 11.61 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.997 0.919 . . . . 64.120000000000005 109.735 170.733 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -130.35 156.8 44.1 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 125.329 1.452 . . . . 73.310000000000002 107.595 -178.842 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 68.3 mm-40 -66.26 -20.76 66.2 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 125.207 1.403 . . . . 74.140000000000001 112.425 -177.524 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 21.8 pt-20 -94.78 -22.77 17.86 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 120.929 -1.107 . . . . 54.210000000000001 112.371 170.808 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.5 m -79.38 -40.71 29.45 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.028 0.931 . . . . 63.210000000000001 110.583 -172.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 77.6 mt -56.65 -57.34 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 CA-C-N 119.524 1.056 . . . . 75.340000000000003 108.507 -177.81 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.425 ' HB3' ' CZ ' ' A' ' 60' ' ' PHE . 0.1 OUTLIER -59.87 -41.11 90.81 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-N 118.15 0.432 . . . . 73.540000000000006 112.123 -179.646 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.51 -44.78 85.31 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 122.967 0.507 . . . . 71.430000000000007 110.385 -179.237 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.73 -26.17 61.43 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.861 0.864 . . . . 75.510000000000005 112.465 -179.482 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 21.9 mtt -73.1 -41.2 64.3 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 119.014 0.825 . . . . 64.099999999999994 110.803 177.607 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 11.9 t -73.11 -31.19 33.99 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.137 0.975 . . . . 63.310000000000002 110.129 178.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -48.61 -57.71 5.8 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 126.074 1.75 . . . . 61.520000000000003 111.769 -174.858 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.93 25.3 0.12 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.767 1.627 . . . . 61.109999999999999 114.138 -179.41 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 3.4 mtt-85 -50.54 -48.28 57.35 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 125.61 1.564 . . . . 74.299999999999997 113.539 -177.408 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.17 -38.88 21.75 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 123.924 0.89 . . . . 63.299999999999997 109.939 177.374 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.8 m -50.8 -39.09 51.98 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.561 1.544 . . . . 75.310000000000002 110.817 -179.122 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.3 -38.63 77.43 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.14 -0.975 . . . . 73.540000000000006 113.591 178.352 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.592 ' HA ' ' HB1' ' A' ' 25' ' ' ALA . 5.0 ptm180 -86.24 -27.02 24.71 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.313 0.96 . . . . 53.100000000000001 112.156 175.782 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -66.84 -48.91 67.42 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.99 0.916 . . . . 75.530000000000001 111.78 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -59.59 -29.25 67.83 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 118.297 0.498 . . . . 64.239999999999995 111.918 -169.69 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 42.3 mm -67.39 -32.42 57.22 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 124.488 1.115 . . . . 74.5 112.351 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 51.3 mt -88.95 -21.85 6.76 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 N-CA-C 108.529 -0.915 . . . . 75.420000000000002 108.529 176.294 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 4.3 t -71.34 -37.31 71.71 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.973 -0.454 . . . . 62.140000000000001 109.804 172.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -135.53 76.04 1.59 Allowed 'General case' 0 C--O 1.236 0.367 0 C-N-CA 127.012 2.125 . . . . 74.439999999999998 105.549 -165.815 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 9.1 mt . . . . . 0 C--O 1.247 0.951 0 C-N-CA 127.602 2.361 . . . . 74.510000000000005 107.896 -177.416 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.0 ttm . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 109.305 -0.628 . . . . 64.140000000000001 109.305 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -76.65 175.1 9.64 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 108.741 -0.837 . . . . 74.400000000000006 108.741 154.373 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -124.38 -53.24 1.71 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 127.525 2.33 . . . . 72.299999999999997 107.323 165.106 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 55.5 t80 70.86 77.19 0.18 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 127.411 2.285 . . . . 72.120000000000005 108.675 -177.556 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . 0.339 0.0 OUTLIER 45.56 -171.18 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 130.357 3.463 . . . . 71.299999999999997 111.326 -163.893 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -162.91 113.0 1.4 Allowed 'General case' 0 C--O 1.236 0.391 0 C-N-CA 126.188 1.795 . . . . 75.430000000000007 106.368 171.148 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -107.1 -175.28 2.75 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.62 1.168 . . . . 62.420000000000002 110.066 -169.449 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.6 pm0 -55.77 174.58 0.11 Allowed 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 122.229 1.014 . . . . 73.5 113.138 167.447 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.3 mtm180 -90.03 -67.55 0.84 Allowed 'General case' 0 N--CA 1.469 0.495 0 O-C-N 120.657 -1.277 . . . . 52.409999999999997 111.824 -174.531 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 44.64 71.1 0.28 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.869 2.068 . . . . 63.530000000000001 111.291 176.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -134.63 8.19 3.58 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.233 1.813 . . . . 75.540000000000006 110.719 -168.754 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -67.72 108.4 2.92 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 107.972 -1.121 . . . . 75.439999999999998 107.972 -174.637 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.15 14.33 5.41 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.242 1.417 . . . . 51.140000000000001 114.101 -179.284 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 13.3 mttt -85.15 -3.81 58.94 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.132 1.773 . . . . 72.519999999999996 113.44 176.478 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.435 ' CE1' HG21 ' A' ' 100' ' ' ILE . 0.1 OUTLIER -68.46 -32.65 72.82 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 120.732 -1.23 . . . . 53.439999999999998 110.321 -165.955 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -79.91 14.24 1.87 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.043 1.737 . . . . 71.519999999999996 113.309 171.223 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -127.47 -21.41 3.83 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.983 1.265 . . . . 71.299999999999997 114.123 -164.867 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -152.58 168.13 26.58 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.745 1.157 . . . . 74.540000000000006 110.361 176.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -69.88 -46.0 66.43 Favored 'General case' 0 C--O 1.224 -0.281 0 O-C-N 121.608 -0.682 . . . . 73.129999999999995 111.295 171.169 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -45.61 -54.55 7.52 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.349 1.46 . . . . 64.120000000000005 112.119 -166.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.83 ' H ' HD22 ' A' ' 21' ' ' LEU . 0.1 OUTLIER -63.77 -39.48 94.37 Favored 'General case' 0 N--CA 1.436 -1.134 0 O-C-N 120.869 -1.144 . . . . 74.540000000000006 111.441 -175.542 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -61.65 -42.94 99.6 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.859 0.863 . . . . 73.200000000000003 110.872 174.655 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -55.24 -39.76 70.11 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.705 0.802 . . . . 64.200000000000003 109.95 172.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.07 -40.21 73.22 Favored 'General case' 0 C--N 1.342 0.247 0 O-C-N 120.625 -1.297 . . . . 73.109999999999999 112.351 173.351 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.26 -47.76 72.66 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 119.465 1.029 . . . . 72.120000000000005 111.716 174.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -58.23 -30.4 66.48 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 121.41 0.624 . . . . 75.5 110.578 177.703 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -99.09 25.2 6.98 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 126.677 1.991 . . . . 73.430000000000007 110.856 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.666 ' HG3' HD11 ' A' ' 100' ' ' ILE . 6.9 mmt-85 -114.4 -6.75 12.91 Favored 'General case' 0 N--CA 1.463 0.223 0 O-C-N 120.852 -1.155 . . . . 75.310000000000002 111.303 165.014 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 30.9 ptt-85 -60.6 -29.92 69.5 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 119.632 1.105 . . . . 75.340000000000003 112.197 -176.646 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.547 ' HA ' HD12 ' A' ' 33' ' ' LEU . 16.4 m120 -94.92 -13.32 25.51 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 123.864 0.865 . . . . 72.120000000000005 112.401 177.927 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.407 ' HD2' HD12 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -57.66 -59.84 4.58 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 120.451 1.478 . . . . 74.530000000000001 110.032 178.889 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.407 HD12 ' HD2' ' A' ' 31' ' ' ARG . 3.5 mp -69.26 -25.53 64.32 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.51 -0.768 . . . . 74.450000000000003 109.91 -166.779 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.547 HD12 ' HA ' ' A' ' 30' ' ' ASN . 60.6 mt -51.96 -33.13 36.37 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.176 0.99 . . . . 71.140000000000001 112.69 173.875 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -75.24 -36.12 46.36 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 110.124 -1.191 . . . . 72.310000000000002 110.124 -179.113 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -69.17 -23.2 63.91 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.468 1.507 . . . . 64.420000000000002 111.486 -179.29 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 19.0 t90 -67.79 -78.52 0.06 Allowed 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.406 1.082 . . . . 61.049999999999997 108.477 166.276 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.5 -26.06 53.23 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 124.481 1.113 . . . . 61.020000000000003 113.242 -168.742 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -45.84 -54.22 8.46 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.309 0.958 . . . . 51.509999999999998 111.186 170.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.82 -44.12 97.33 Favored Glycine 0 CA--C 1.53 0.97 0 N-CA-C 111.558 -0.617 . . . . 54.109999999999999 111.558 -176.603 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.5 mp -58.47 -51.64 69.0 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 126.695 1.998 . . . . 73.329999999999998 110.61 176.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.4 mp -54.93 -42.19 71.97 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.678 1.191 . . . . 75.319999999999993 111.304 174.417 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 112.21 24.83 4.96 Favored Glycine 0 CA--C 1.519 0.307 0 C-N-CA 124.519 1.057 . . . . 64.109999999999999 112.225 -175.492 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 33.0 mttm -97.31 137.89 35.62 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 126.89 2.076 . . . . 75.450000000000003 107.249 172.534 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 36.4 p -139.42 167.91 21.03 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 123.806 0.842 . . . . 63.020000000000003 109.011 -178.324 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 54.04 -130.72 44.23 Favored Glycine 0 CA--C 1.521 0.469 0 C-N-CA 124.747 1.165 . . . . 35.119999999999997 110.81 173.452 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -71.39 -22.3 61.89 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 118.335 -0.84 . . . . 74.129999999999995 112.878 -179.605 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -64.16 -47.05 81.36 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.99 1.268 . . . . 74.409999999999997 110.599 175.21 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.54 -46.61 88.37 Favored 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 125.052 1.341 . . . . 52.340000000000003 109.76 173.737 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 6.3 ttm-85 -57.22 -50.5 72.68 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.624 0.77 . . . . 73.109999999999999 111.008 177.344 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.44 -29.51 70.19 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 126.535 1.934 . . . . 75.430000000000007 111.807 -178.616 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 82.5 t80 -73.31 -40.97 64.09 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.105 0.962 . . . . 73.209999999999994 109.516 171.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.16 7.18 0.61 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.55 1.14 . . . . 74.439999999999998 113.536 177.679 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 42.2 mt -88.28 -15.36 36.0 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.183 0.993 . . . . 72.219999999999999 111.863 172.796 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.9 t -125.01 3.65 8.0 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 119.211 0.914 . . . . 61.32 111.654 -169.303 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 5.9 p -62.7 -26.87 41.78 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 O-C-N 120.362 -1.461 . . . . 63.210000000000001 112.648 169.66 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 4.9 m -72.33 117.76 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.569 0 C-N-CA 127.017 2.127 . . . . 72.510000000000005 110.829 -173.482 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.45 HG23 ' H ' ' A' ' 58' ' ' SER . 0.7 OUTLIER -144.34 -85.69 0.13 Allowed 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 127.339 2.256 . . . . 72.430000000000007 107.106 175.217 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.45 ' H ' HG23 ' A' ' 57' ' ' THR . 10.0 m -161.23 -177.11 5.82 Favored 'General case' 0 N--CA 1.452 -0.373 1 C-N-CA 131.726 4.01 . . . . 75.219999999999999 105.059 174.886 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -101.44 -179.17 3.95 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 126.304 1.841 . . . . 74.329999999999998 108.636 168.338 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -135.21 144.91 47.19 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 125.334 1.453 . . . . 74.540000000000006 108.886 177.082 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -157.28 -11.6 0.09 Allowed 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 123.757 0.823 . . . . 73.140000000000001 112.861 -173.697 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -157.75 165.59 18.36 Favored Pre-proline 0 CA--C 1.553 1.065 0 CA-C-N 120.564 1.529 . . . . 74.230000000000004 110.638 178.833 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -85.17 71.75 4.82 Favored 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 122.706 2.271 . . . . 73.209999999999994 113.254 -155.58 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -159.38 -49.77 0.01 OUTLIER Glycine 0 CA--C 1.526 0.735 0 C-N-CA 123.71 0.672 . . . . 72.549999999999997 111.665 165.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -81.2 17.28 1.32 Allowed 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.028 1.331 . . . . 63.210000000000001 111.622 -175.206 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -61.85 82.05 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.692 1.597 . . . . 75.030000000000001 109.054 168.303 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -139.15 -5.21 1.46 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.851 1.26 . . . . 54.25 112.381 179.009 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.402 HG13 ' H ' ' A' ' 69' ' ' PHE . 4.8 p -93.78 -61.76 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 C-N-CA 124.663 1.185 . . . . 73.450000000000003 109.14 175.717 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.402 ' H ' HG13 ' A' ' 68' ' ' VAL . 0.3 OUTLIER -54.02 -30.82 49.09 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.435 1.494 . . . . 71.310000000000002 110.384 175.619 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.07 -32.87 16.72 Favored 'General case' 0 C--N 1.341 0.23 0 C-N-CA 126.57 1.948 . . . . 71.420000000000002 113.255 -171.765 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.8 mmtt -108.29 -32.97 7.25 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 118.327 -0.844 . . . . 54.25 110.946 175.088 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.36 -47.35 66.18 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.189 0.596 . . . . 64.420000000000002 110.7 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -57.01 -37.16 71.3 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 119.095 -0.478 . . . . 43.409999999999997 112.13 -178.536 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -80.23 -43.31 21.64 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.258 1.023 . . . . 74.140000000000001 111.532 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.15 -38.84 80.66 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 122.36 1.076 . . . . 72.439999999999998 109.194 178.319 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.534 HD23 ' HB2' ' A' ' 80' ' ' ALA . 9.2 tp -102.55 21.16 15.75 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 128.109 2.564 . . . . 61.119999999999997 111.071 -175.582 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 47.2 tt0 -52.48 114.95 1.54 Allowed 'General case' 0 C--O 1.233 0.234 0 C-N-CA 125.734 1.613 . . . . 63.130000000000003 109.919 -177.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.94 -3.66 81.03 Favored Glycine 0 CA--C 1.532 1.111 0 CA-C-O 118.432 -1.205 . . . . 71.340000000000003 113.112 175.099 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -118.59 3.74 11.73 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 126.701 2.001 . . . . 60.219999999999999 111.893 -172.92 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.534 ' HB2' HD23 ' A' ' 76' ' ' LEU . . . -142.68 173.18 11.77 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 126.765 2.026 . . . . 72.230000000000004 106.868 173.317 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -120.47 161.13 21.78 Favored 'General case' 0 C--O 1.24 0.554 0 N-CA-C 105.764 -1.939 . . . . 64.430000000000007 105.764 163.314 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -55.28 -53.65 53.45 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 123.589 0.756 . . . . 63.039999999999999 110.052 174.871 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -67.43 -19.25 65.35 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.41 -0.359 . . . . 75.209999999999994 110.655 -174.841 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 19.6 m -87.5 -39.7 14.94 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 124.788 1.235 . . . . 75.310000000000002 111.504 178.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 89.2 mt -56.79 -55.41 20.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-N 121.636 2.016 . . . . 75.439999999999998 108.377 171.451 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.65 -7.91 8.65 Favored 'General case' 0 N--CA 1.462 0.166 0 N-CA-C 112.553 0.575 . . . . 73.209999999999994 112.553 -179.107 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -122.5 42.26 3.21 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 125.567 1.547 . . . . 54.310000000000002 107.958 176.775 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -118.53 -41.27 2.83 Favored 'General case' 0 C--N 1.341 0.207 0 O-C-N 121.648 -0.658 . . . . 55.149999999999999 111.578 166.115 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -63.7 -44.51 93.45 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.28 0.632 . . . . 71.230000000000004 111.421 -175.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 42.2 t -67.76 -31.28 51.64 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 C-N-CA 125.332 1.453 . . . . 64.129999999999995 111.839 179.16 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.69 -60.36 3.78 Favored 'General case' 0 C--O 1.231 0.126 0 O-C-N 120.561 -1.337 . . . . 72.420000000000002 109.821 -169.266 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.88 16.9 1.68 Allowed 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 124.383 1.073 . . . . 75.530000000000001 112.103 -178.694 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 14.6 ttm180 -49.08 -44.78 42.29 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.451 1.101 . . . . 61.509999999999998 111.006 171.679 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.32 -58.62 7.52 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 118.713 -0.661 . . . . 31.219999999999999 109.961 175.095 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 5.8 m -52.57 -51.3 60.42 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.483 1.113 . . . . 74.5 110.538 -175.519 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -63.04 -23.68 67.56 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 113.682 0.994 . . . . 71.409999999999997 113.682 -176.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.2 -68.89 0.54 Allowed 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 106.064 -1.828 . . . . 71.530000000000001 106.064 165.679 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -44.97 -49.15 11.34 Favored 'General case' 0 CA--C 1.518 -0.278 0 C-N-CA 128.124 2.57 . . . . 71.519999999999996 113.197 -167.465 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -52.18 -35.72 49.71 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-O 117.919 -1.039 . . . . 75.530000000000001 112.27 -174.641 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.666 HD11 ' HG3' ' A' ' 28' ' ' ARG . 14.5 mm -57.94 -54.35 33.17 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 120.071 1.305 . . . . 75.519999999999996 111.056 -178.581 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 80.8 mt -62.63 -19.46 22.91 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 C-N-CA 123.67 0.788 . . . . 74.230000000000004 109.422 178.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.28 5.39 39.96 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 126.867 2.067 . . . . 52.240000000000002 113.153 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -121.26 11.82 10.87 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.94 1.696 . . . . 73.540000000000006 110.589 -175.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 35.2 mt . . . . . 0 C--O 1.248 1.007 0 C-N-CA 127.822 2.449 . . . . 71.219999999999999 110.733 -172.999 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 ptm . . . . . 0 N--CA 1.475 0.786 0 N-CA-C 113.574 0.953 . . . . 54.329999999999998 113.574 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.2 p -142.7 169.6 17.27 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 120.269 1.395 . . . . 71.549999999999997 108.475 178.156 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.85 15.28 2.29 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 120.75 -1.219 . . . . 70.420000000000002 112.956 -172.677 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 41.0 m-85 -65.75 -60.05 3.28 Favored 'General case' 0 C--O 1.234 0.287 0 O-C-N 120.715 -1.241 . . . . 62.549999999999997 112.261 -173.162 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.85 -55.44 6.65 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.344 0.974 . . . . 72.010000000000005 109.657 -173.844 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 45.8 t0 48.27 84.21 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 129.622 3.169 . . . . 65.109999999999999 112.911 175.079 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.0 mmt180 -137.06 126.75 25.41 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 125.09 1.356 . . . . 73.140000000000001 110.054 -166.383 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -102.51 -20.05 14.65 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.033 0.933 . . . . 73.129999999999995 112.309 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -88.45 -179.47 6.09 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 118.581 0.628 . . . . 70.010000000000005 110.152 177.551 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 56.83 36.46 27.75 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 126.567 1.947 . . . . 74.239999999999995 112.66 175.856 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' HIS . . . . . 0.456 ' HA ' HD13 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -63.27 -0.72 0.87 Allowed 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 115.069 1.507 . . . . 60.210000000000001 115.069 176.661 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -59.56 108.15 0.69 Allowed 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 127.666 2.386 . . . . 54.32 109.444 -173.489 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 55.8 -8.23 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 128.609 2.763 . . . . 64.430000000000007 115.806 -168.433 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 34.7 mttt -62.78 -23.29 67.15 Favored 'General case' 0 C--O 1.224 -0.254 0 C-N-CA 125.673 1.589 . . . . 73.150000000000006 113.137 -174.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -53.29 -29.36 32.92 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 119.651 1.114 . . . . 70.340000000000003 113.965 -176.01 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -97.83 2.62 49.53 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.715 0.806 . . . . 73.120000000000005 113.096 -178.612 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.4 m170 -125.45 -62.19 1.22 Allowed 'General case' 0 C--O 1.237 0.428 0 C-N-CA 125.929 1.692 . . . . 43.25 109.077 -170.815 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -85.93 112.14 20.89 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 106.793 -1.558 . . . . 74.010000000000005 106.793 174.443 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.53 -36.55 78.99 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-O 118.104 -0.951 . . . . 74.329999999999998 110.987 -175.115 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.494 ' H ' ' CD ' ' A' ' 20' ' ' GLU . 3.4 mp0 -54.5 -41.51 69.69 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.737 1.153 . . . . 65.129999999999995 111.368 -172.417 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.456 HD13 ' HA ' ' A' ' 11' ' ' HIS . 32.8 mt -64.01 -31.93 73.29 Favored 'General case' 0 C--O 1.233 0.234 0 O-C-N 121.599 -0.688 . . . . 72.349999999999994 111.989 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -84.83 -32.99 22.99 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 125.908 1.683 . . . . 74.040000000000006 110.861 176.422 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -55.14 -50.52 69.05 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 125.799 1.64 . . . . 70.040000000000006 109.183 -170.118 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.446 ' HE3' ' HA ' ' A' ' 21' ' ' LEU . 13.7 ptpt -52.05 -46.02 64.93 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.58 0.752 . . . . 74.439999999999998 111.992 175.247 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.21 -36.93 80.29 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 124.285 1.034 . . . . 43.509999999999998 111.016 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -71.49 -17.32 62.35 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.673 1.589 . . . . 64.129999999999995 111.201 176.267 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -123.97 25.58 7.89 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.573 1.949 . . . . 54.210000000000001 113.683 -169.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.321 0.0 OUTLIER -137.03 11.98 3.08 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 115.087 1.514 . . . . 74.010000000000005 115.087 177.421 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.8 ptt-85 -60.87 -18.71 57.77 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.955 1.465 . . . . 73.200000000000003 114.955 176.138 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -94.81 -24.02 17.24 Favored 'General case' 0 C--O 1.225 -0.217 0 CA-C-N 120.476 1.489 . . . . 72.140000000000001 110.671 172.157 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.39 -55.4 21.98 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 119.879 1.218 . . . . 73.209999999999994 111.132 -177.18 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -63.7 -20.7 65.93 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.07 -0.968 . . . . 72.120000000000005 113.307 -174.266 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.4 -38.33 90.65 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.37 1.468 . . . . 70.010000000000005 110.085 -176.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.48 -33.79 88.18 Favored Glycine 0 CA--C 1.527 0.82 0 CA-C-O 119.561 -0.577 . . . . 74.420000000000002 111.774 178.16 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -65.3 -38.33 89.87 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 117.866 0.833 . . . . 72.329999999999998 110.679 -177.259 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.482 ' CD1' ' HE2' ' A' ' 88' ' ' LYS . 28.8 t90 -60.51 -60.65 3.48 Favored 'General case' 0 C--O 1.228 -0.071 0 N-CA-C 108.291 -1.003 . . . . 74.030000000000001 108.291 177.366 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.05 -45.97 64.91 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 118.816 -0.611 . . . . 63.109999999999999 111.297 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -45.73 -57.5 4.21 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.209 1.004 . . . . 51.420000000000002 112.387 179.51 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.97 -32.08 80.84 Favored Glycine 0 CA--C 1.529 0.944 0 N-CA-C 112.069 -0.412 . . . . 75.299999999999997 112.069 -176.126 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 80.7 mt -71.07 -48.05 54.81 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 124.139 0.975 . . . . 74.409999999999997 110.66 178.212 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.6 mp -52.83 -31.66 40.23 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 124.859 1.263 . . . . 74.0 111.386 168.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 101.22 8.75 46.51 Favored Glycine 0 CA--C 1.526 0.781 0 C-N-CA 125.748 1.642 . . . . 55.240000000000002 112.394 -177.787 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.427 ' HE3' ' CD1' ' A' ' 51' ' ' TYR . 48.5 mttm -72.39 127.69 33.35 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 106.554 -1.647 . . . . 74.109999999999999 106.554 167.758 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 17.7 p -144.5 170.02 16.84 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.707 -0.849 . . . . 73.140000000000001 108.707 177.299 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.53 -131.84 15.19 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 109.205 -1.558 . . . . 73.049999999999997 109.205 -177.486 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -76.47 -30.8 57.45 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 118.843 -0.598 . . . . 64.120000000000005 111.003 177.347 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -57.6 -41.31 80.98 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 119.576 1.08 . . . . 72.329999999999998 111.585 -176.597 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.1 -46.52 90.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.645 -1.161 . . . . 64.310000000000002 111.387 174.405 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.8 ttt85 -57.48 -55.09 39.3 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 124.904 1.282 . . . . 71.409999999999997 109.165 178.558 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.65 -43.7 97.28 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 126.653 1.981 . . . . 52.43 111.376 -178.607 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.427 ' CD1' ' HE3' ' A' ' 43' ' ' LYS . 43.5 t80 -61.71 -44.39 97.02 Favored 'General case' 0 C--N 1.333 -0.13 0 O-C-N 121.709 -0.619 . . . . 74.409999999999997 109.995 174.908 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.53 -25.27 62.28 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 121.243 -0.91 . . . . 43.399999999999999 112.766 -175.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 37.7 mt -64.47 -21.04 66.54 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.766 1.227 . . . . 73.230000000000004 114.045 -173.441 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.9 t -100.71 -5.85 25.9 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.305 0.957 . . . . 74.299999999999997 111.009 -173.765 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 6.3 t -93.45 82.87 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 O-C-N 120.403 -1.436 . . . . 74.200000000000003 109.535 -164.112 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 3.7 m -132.93 87.8 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.96 0 C-N-CA 127.57 2.348 . . . . 64.5 110.156 -177.173 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.0 t -155.57 133.01 11.01 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 106.022 -1.844 . . . . 70.310000000000002 106.022 -169.369 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.2 t -161.26 76.24 0.53 Allowed 'General case' 0 C--O 1.232 0.138 0 CA-C-N 120.327 1.421 . . . . 41.140000000000001 108.473 -172.743 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.459 ' H ' ' CG2' ' A' ' 68' ' ' VAL . 26.9 m-20 -144.68 90.47 2.08 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 106.91 -1.515 . . . . 72.540000000000006 106.91 -163.054 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -154.86 -3.9 0.15 Allowed 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.55 1.54 . . . . 73.430000000000007 111.418 -169.461 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -64.06 -43.71 94.67 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 120.695 -1.253 . . . . 53.439999999999998 111.791 -161.526 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -132.6 163.24 52.09 Favored Pre-proline 0 C--O 1.235 0.33 0 C-N-CA 126.176 1.79 . . . . 64.5 110.298 -176.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -80.55 64.3 8.87 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.352 2.701 . . . . 50.32 111.631 -172.608 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -134.5 -70.66 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 107.789 -2.124 . . . . 73.409999999999997 107.789 171.769 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.23 -55.1 37.85 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 125.641 1.576 . . . . 71.430000000000007 111.691 -159.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 52.95 11.41 0.21 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 129.178 2.991 . . . . 70.329999999999998 115.719 169.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -74.87 -23.21 58.37 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 113.01 0.744 . . . . 62.299999999999997 113.01 -158.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.459 ' CG2' ' H ' ' A' ' 59' ' ' ASP . 18.0 t -71.2 -62.33 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.219 0 C-N-CA 124.064 0.945 . . . . 70.319999999999993 108.662 177.003 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -60.12 -32.92 71.46 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-O 118.695 -0.669 . . . . 73.219999999999999 110.808 -165.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 25.7 ttp180 -48.42 -58.14 5.07 Favored 'General case' 0 CA--C 1.517 -0.311 0 C-N-CA 123.489 0.716 . . . . 74.230000000000004 110.955 172.254 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.5 mmtp -74.1 -43.6 57.02 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.884 -0.413 . . . . 62.299999999999997 109.884 -177.327 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.12 -58.72 7.4 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 124.071 0.948 . . . . 71.030000000000001 110.252 -171.266 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.19 -34.43 70.35 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 118.489 -0.767 . . . . 62.409999999999997 111.486 -175.467 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.62 -33.6 62.62 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 119.412 1.005 . . . . 64.120000000000005 112.299 176.126 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.49 -27.67 67.2 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.95 -1.094 . . . . 65.439999999999998 109.488 172.594 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.6 tp -120.48 22.85 11.12 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 127.013 2.125 . . . . 65.120000000000005 111.782 -165.729 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -48.45 114.18 0.91 Allowed 'General case' 0 C--O 1.233 0.199 0 C-N-CA 127.584 2.354 . . . . 72.040000000000006 108.829 173.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 77.54 6.22 86.56 Favored Glycine 0 CA--C 1.538 1.503 0 N-CA-C 114.636 0.614 . . . . 62.340000000000003 114.636 174.593 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 5.4 pttm -129.28 3.94 5.19 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 119.032 1.416 . . . . 71.310000000000002 113.556 -174.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -139.8 -162.44 1.34 Allowed 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.752 1.221 . . . . 74.230000000000004 108.426 164.536 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -136.17 147.19 47.58 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 125.595 1.558 . . . . 72.129999999999995 107.772 -176.392 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -69.16 -15.67 63.46 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.792 0.837 . . . . 65.409999999999997 113.239 -176.232 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -104.95 -2.08 25.01 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.57 1.148 . . . . 72.040000000000006 112.723 171.686 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.1 m -101.37 -35.9 9.06 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 121.059 -1.025 . . . . 74.420000000000002 112.982 -175.385 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 22.7 mt -55.09 -53.99 28.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 119.192 0.905 . . . . 45.509999999999998 109.342 -178.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -50.14 -51.36 43.93 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 124.026 0.931 . . . . 65.209999999999994 109.507 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -73.37 -9.13 58.38 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 124.404 1.082 . . . . 53.310000000000002 112.6 -172.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.482 ' HE2' ' CD1' ' A' ' 36' ' ' TRP . 57.6 tptt -84.79 -65.21 1.03 Allowed 'General case' 0 CA--C 1.519 -0.243 0 O-C-N 120.184 -1.573 . . . . 75.010000000000005 107.977 178.799 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 3.2 ptt? -61.74 -33.78 74.65 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 113.178 0.807 . . . . 73.439999999999998 113.178 -170.006 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 96.3 t -65.18 -49.19 80.41 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.223 0 C-N-CA 123.917 0.887 . . . . 74.329999999999998 109.497 176.683 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -62.06 -36.57 82.04 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 121.034 -1.041 . . . . 71.209999999999994 110.932 -173.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 83.2 mt -65.93 -6.11 11.43 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 125.424 1.489 . . . . 63.310000000000002 112.113 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -53.56 -51.82 61.69 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 120.191 1.359 . . . . 74.200000000000003 111.866 -178.009 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -78.95 -9.15 59.43 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.204 0.602 . . . . 70.299999999999997 112.563 -175.205 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 31.7 m -64.57 -38.21 90.22 Favored 'General case' 0 C--O 1.226 -0.165 0 O-C-N 120.827 -1.171 . . . . 62.439999999999998 110.108 -179.63 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -64.32 -27.06 68.77 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 120.834 -1.166 . . . . 62.039999999999999 113.276 -170.169 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 12.7 tpt85 -65.02 -53.96 37.87 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.53 1.132 . . . . 73.430000000000007 108.713 173.507 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -63.07 -56.18 19.17 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 124.385 1.074 . . . . 63.350000000000001 110.893 -177.43 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -63.67 -18.5 64.03 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.541 1.136 . . . . 70.129999999999995 113.27 -164.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 11.6 mm -87.09 -38.53 12.27 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.156 0 C-N-CA 125.767 1.627 . . . . 73.450000000000003 110.076 177.351 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 76.6 mt -71.84 -28.3 30.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 O-C-N 121.027 -1.046 . . . . 74.109999999999999 108.325 172.681 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 2.9 t -73.12 -43.72 61.28 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.57 0.748 . . . . 73.319999999999993 109.434 177.623 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -132.81 82.85 2.02 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 106.015 -1.846 . . . . 61.450000000000003 106.015 -174.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.757 HD12 ' H ' ' A' ' 104' ' ' ILE . 2.0 mp . . . . . 0 C--O 1.253 1.244 0 N-CA-C 106.626 -1.62 . . . . 71.010000000000005 106.626 173.371 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.7 ttt . . . . . 0 N--CA 1.468 0.43 0 CA-C-O 117.918 -1.039 . . . . 71.219999999999999 109.381 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 61.4 m -54.83 108.9 0.44 Allowed 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.677 1.126 . . . . 75.109999999999999 110.864 179.74 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 14.2 t -155.0 151.93 29.05 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.502 1.121 . . . . 75.120000000000005 108.351 164.324 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -152.32 102.91 2.8 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 105.093 -2.188 . . . . 62.240000000000002 105.093 162.697 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -139.44 20.26 2.56 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 126.212 1.805 . . . . 73.430000000000007 110.339 -166.785 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 75.01 -56.84 0.62 Allowed 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 129.831 3.252 . . . . 72.129999999999995 110.808 174.088 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.5 mtt180 -69.89 164.11 24.49 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 125.342 1.457 . . . . 71.219999999999999 108.431 164.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -161.12 -55.85 0.05 Allowed 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 115.746 -0.661 . . . . 71.340000000000003 110.474 -156.378 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.4 ptp85 -130.56 150.89 51.55 Favored 'General case' 0 CA--C 1.497 -1.067 0 C-N-CA 125.157 1.383 . . . . 74.439999999999998 113.045 -154.764 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -148.31 81.28 1.47 Allowed 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 113.112 -1.858 . . . . 72.540000000000006 109.749 -157.058 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -56.51 -32.21 64.84 Favored 'General case' 0 C--O 1.206 -1.233 0 CA-C-O 117.748 -1.12 . . . . 73.129999999999995 113.362 166.511 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . 0.263 11.0 pt-20 43.99 58.36 3.69 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-N 121.088 1.767 . . . . 64.150000000000006 111.911 -177.422 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 55.84 12.21 0.83 Allowed 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 127.667 2.387 . . . . 70.120000000000005 116.219 -172.729 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 11.7 mmtt -70.61 -7.26 42.8 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 119.908 -1.745 . . . . 70.150000000000006 113.867 174.591 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.3 m-30 -59.71 -32.5 70.59 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 121.197 1.817 . . . . 65.540000000000006 111.122 176.733 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -73.95 15.6 0.29 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.642 1.177 . . . . 64.219999999999999 113.54 176.35 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -153.31 178.04 10.21 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 125.268 1.427 . . . . 70.329999999999998 109.774 -164.52 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 51.07 -162.46 0.07 Allowed 'General case' 0 C--O 1.236 0.362 0 C-N-CA 128.077 2.551 . . . . 70.239999999999995 111.974 168.084 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -145.46 8.98 1.19 Allowed 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 125.945 1.698 . . . . 73.030000000000001 110.971 169.394 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -72.14 -52.37 16.96 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-N 119.288 0.949 . . . . 64.409999999999997 109.725 169.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.903 ' H ' HD22 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -69.69 -46.02 66.99 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 124.658 1.183 . . . . 70.349999999999994 112.288 -169.578 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 39.4 t-20 -58.43 -41.43 85.01 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 124.218 1.007 . . . . 64.239999999999995 110.942 -175.719 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -47.98 -51.84 22.18 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.832 2.053 . . . . 71.340000000000003 111.748 177.066 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 3.7 mttp -55.51 -57.65 11.03 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 108.917 -0.772 . . . . 65.319999999999993 108.917 172.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.98 2.96 0.92 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.441 1.496 . . . . 72.129999999999995 113.983 -176.25 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -98.41 -28.47 13.62 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 120.504 -1.372 . . . . 72.25 110.388 171.057 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -128.87 34.7 4.43 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 120.714 -1.241 . . . . 62.109999999999999 113.451 -159.886 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.452 ' CD ' ' HB1' ' A' ' 96' ' ' ALA . 0.0 OUTLIER -125.12 -6.29 7.22 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 115.262 1.578 . . . . 73.140000000000001 115.262 -172.356 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 76.5 mtt85 -53.89 -22.93 11.06 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 120.109 1.322 . . . . 70.209999999999994 113.535 176.529 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -95.17 -17.6 21.64 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 113.151 0.797 . . . . 71.510000000000005 113.151 177.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.6 ttt180 -56.03 -56.37 21.6 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.548 1.067 . . . . 64.430000000000007 110.784 -179.37 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -70.67 -16.28 62.79 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 114.085 1.142 . . . . 74.329999999999998 114.085 -176.156 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 12.4 mt -61.9 -25.9 67.84 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.564 1.074 . . . . 74.450000000000003 110.521 167.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.13 -37.42 92.83 Favored Glycine 0 N--CA 1.442 -0.947 0 CA-C-O 119.268 -0.74 . . . . 43.109999999999999 111.963 173.641 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -65.84 -27.64 68.39 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 118.544 1.172 . . . . 73.239999999999995 110.694 179.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 28.9 t90 -71.77 -62.14 1.53 Allowed 'General case' 0 CA--C 1.534 0.354 0 O-C-N 121.213 -0.929 . . . . 70.439999999999998 109.25 171.126 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -54.85 -48.95 72.23 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 113.692 0.997 . . . . 63.240000000000002 113.692 -176.157 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -47.58 -50.38 24.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 119.252 0.933 . . . . 72.340000000000003 111.731 175.476 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -65.34 -7.13 31.08 Favored Glycine 0 CA--C 1.534 1.265 0 C-N-CA 125.337 1.446 . . . . 71.409999999999997 114.611 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 18.3 mt -102.93 -45.85 4.84 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 126.316 1.846 . . . . 63.520000000000003 109.731 172.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.407 HD22 ' CZ ' ' A' ' 51' ' ' TYR . 1.8 mp -62.33 -10.59 11.6 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 127.099 2.16 . . . . 63.119999999999997 114.805 -176.05 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 89.03 34.41 8.88 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 110.875 -0.89 . . . . 71.310000000000002 110.875 -179.737 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 16.2 mttm -117.45 143.98 45.48 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 106.755 -1.572 . . . . 63.509999999999998 106.755 172.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 10.2 p -141.92 172.18 13.04 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 107.128 -1.434 . . . . 64.439999999999998 107.128 167.13 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 60.73 -142.98 48.3 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 111.742 -0.543 . . . . 73.099999999999994 111.742 175.018 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -60.98 -32.02 71.59 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.05 0.389 . . . . 64.400000000000006 112.05 -177.105 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -59.92 -47.19 86.8 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 124.514 1.126 . . . . 73.5 111.199 177.404 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.59 -45.42 94.17 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.29 -0.868 . . . . 71.120000000000005 110.69 172.731 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.9 ttt180 -58.59 -50.29 74.34 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 123.995 0.918 . . . . 74.409999999999997 111.083 -176.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.19 -48.74 80.44 Favored 'General case' 0 C--O 1.233 0.184 0 C-N-CA 126.984 2.113 . . . . 73.430000000000007 111.412 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.407 ' CZ ' HD22 ' A' ' 41' ' ' LEU . 72.3 t80 -63.67 -37.95 89.28 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.474 -0.766 . . . . 73.519999999999996 110.656 176.688 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.2 -14.25 61.59 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 120.858 -1.151 . . . . 75.439999999999998 112.741 177.259 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 22.8 mt -70.08 -31.98 69.82 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 120.169 1.35 . . . . 63.32 110.405 172.853 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 17.0 p -90.35 -20.06 23.3 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 120.929 -1.107 . . . . 43.310000000000002 111.247 -171.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 57.5 t -68.85 88.35 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 125.787 1.635 . . . . 71.329999999999998 108.615 168.184 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 20.1 t -134.83 138.97 48.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 106.773 -1.565 . . . . 65.230000000000004 106.773 148.701 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 66.3 p -154.47 167.99 28.19 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 128.437 2.695 . . . . 74.420000000000002 107.362 175.654 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.5 m -163.42 100.38 0.93 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 125.997 1.719 . . . . 71.049999999999997 106.726 169.625 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -156.1 45.72 0.45 Allowed 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 119.74 1.155 . . . . 61.409999999999997 113.453 161.391 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -132.55 -12.87 3.02 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 120.945 -1.097 . . . . 70.140000000000001 111.576 179.54 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -65.85 -19.05 65.74 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.949 -1.094 . . . . 73.409999999999997 110.794 174.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -145.91 155.78 51.65 Favored Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 126.375 1.87 . . . . 72.040000000000006 108.536 -163.616 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -73.74 101.16 1.35 Allowed 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 122.942 2.428 . . . . 54.350000000000001 111.968 -161.131 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -109.22 169.0 13.55 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 124.879 1.228 . . . . 53.140000000000001 113.243 -173.548 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.403 ' CG ' ' H ' ' A' ' 66' ' ' GLU . 7.1 p-10 -84.06 -82.06 0.17 Allowed 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 105.955 -1.869 . . . . 71.010000000000005 105.955 173.475 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.403 ' H ' ' CG ' ' A' ' 65' ' ' ASP . 9.1 tt0 -162.61 81.19 0.51 Allowed 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 119.911 1.232 . . . . 74.439999999999998 109.662 -178.829 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -111.26 -60.8 1.79 Allowed 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 118.316 -0.85 . . . . 42.130000000000003 110.907 -171.597 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.5 p -79.13 -53.62 13.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 C-N-CA 123.559 0.744 . . . . 64.430000000000007 110.536 176.483 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -56.62 -35.42 68.28 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-O 118.745 -0.645 . . . . 73.319999999999993 109.855 -175.022 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -48.05 -59.27 3.5 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.078 0.951 . . . . 64.319999999999993 111.578 174.342 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -72.44 -37.93 68.44 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 118.819 -0.61 . . . . 73.340000000000003 110.058 -175.236 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.58 -47.27 70.27 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 119.152 0.887 . . . . 73.140000000000001 110.544 -176.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.69 -16.76 63.92 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.473 1.109 . . . . 72.319999999999993 111.121 179.139 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -77.28 -47.42 20.13 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.013 0.824 . . . . 60.109999999999999 110.843 168.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.95 -24.08 67.71 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.473 1.109 . . . . 73.219999999999999 111.203 177.467 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 79.3 mt -117.17 31.43 6.75 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 126.345 1.858 . . . . 74.450000000000003 111.478 177.503 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -55.78 117.92 4.09 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 107.211 -1.403 . . . . 72.120000000000005 107.211 168.668 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 95.63 -10.54 68.76 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 126.317 1.913 . . . . 55.219999999999999 113.713 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.2 mtpp -126.7 1.52 6.78 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 119.696 1.748 . . . . 63.450000000000003 113.756 -165.297 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -151.0 174.31 13.29 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 119.043 0.838 . . . . 73.239999999999995 110.356 172.27 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -140.47 168.82 18.89 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 127.26 2.224 . . . . 52.420000000000002 105.798 174.331 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -57.98 -46.16 85.62 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.007 0.923 . . . . 61.109999999999999 111.64 -171.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -76.35 -16.47 59.74 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-O 119.485 -0.293 . . . . 73.420000000000002 110.903 -174.626 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 95.1 m -70.14 -56.81 5.91 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 107.947 -1.131 . . . . 74.549999999999997 107.947 165.525 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 47.8 mt -60.38 -55.96 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 C-N-CA 124.482 1.113 . . . . 74.340000000000003 109.938 -171.331 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.69 -28.08 63.47 Favored 'General case' 0 N--CA 1.456 -0.126 0 O-C-N 122.076 -0.39 . . . . 73.439999999999998 111.524 -175.01 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.62 -46.88 13.76 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.794 0.837 . . . . 74.420000000000002 110.285 -179.583 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.52 -40.52 75.18 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 122.939 0.495 . . . . 73.140000000000001 110.329 -165.292 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 9.5 mtt -61.26 -43.86 98.18 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 119.143 -0.456 . . . . 61.310000000000002 110.845 -179.719 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 49.8 t -65.41 -34.89 73.53 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 125.18 1.392 . . . . 71.230000000000004 110.656 -176.361 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 -55.82 -54.65 41.9 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 108.748 -0.834 . . . . 74.519999999999996 108.748 178.072 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 42.6 mt -71.89 -1.97 16.24 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 126.563 1.945 . . . . 62.119999999999997 112.601 -172.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 27.5 ttp180 -57.13 -52.15 66.46 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 123.912 0.885 . . . . 74.25 110.625 -175.586 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.85 -49.79 73.51 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.355 1.062 . . . . 71.530000000000001 110.028 177.802 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.8 m -52.63 -49.99 64.05 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 129.563 3.145 . . . . 61.439999999999998 109.927 -174.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.452 ' HB1' ' CD ' ' A' ' 28' ' ' ARG . . . -53.3 -34.88 59.15 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.577 0.751 . . . . 65.540000000000006 111.637 -179.025 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 9.1 mtm180 -79.01 -45.58 19.93 Favored 'General case' 0 C--O 1.233 0.233 0 O-C-N 121.107 -0.995 . . . . 72.150000000000006 109.032 -177.86 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -60.35 -39.24 86.46 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 125.0 1.32 . . . . 72.150000000000006 111.164 178.542 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -56.54 -42.49 78.61 Favored 'General case' 0 C--O 1.221 -0.43 0 C-N-CA 124.577 1.151 . . . . 64.239999999999995 112.715 -177.033 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.5 mm -58.62 -44.9 90.6 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-N 119.996 1.271 . . . . 74.109999999999999 108.979 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 86.9 mt -73.46 -9.72 13.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 124.809 1.244 . . . . 72.430000000000007 110.056 -179.58 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -109.38 16.77 22.1 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.918 1.687 . . . . 45.049999999999997 109.705 177.105 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -122.63 18.11 10.37 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.51 1.924 . . . . 72.450000000000003 108.491 177.03 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 61.8 mt . . . . . 0 C--O 1.251 1.16 0 CA-C-O 115.859 -2.02 . . . . 70.430000000000007 106.593 173.951 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.477 0.889 0 N-CA-C 116.792 2.145 . . . . 72.230000000000004 116.792 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -45.93 106.6 0.08 Allowed 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.017 1.727 . . . . 71.450000000000003 112.714 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 54.57 -5.32 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 128.525 2.73 . . . . 73.510000000000005 116.392 -171.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 48.7 mttt -58.0 -26.97 63.07 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 127.071 2.148 . . . . 62.149999999999999 113.952 -168.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -63.73 -9.42 14.21 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 114.106 1.15 . . . . 74.530000000000001 114.106 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -132.92 39.09 3.34 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 119.336 0.971 . . . . 24.440000000000001 110.143 173.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -146.44 -65.1 0.29 Allowed 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 107.057 -1.46 . . . . 64.420000000000002 107.057 169.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -67.04 158.05 31.99 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 127.052 2.141 . . . . 61.219999999999999 111.004 -172.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -89.04 -57.75 2.79 Favored 'General case' 0 C--O 1.223 -0.311 0 N-CA-C 108.811 -0.811 . . . . 73.540000000000006 108.811 163.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -49.58 -50.96 40.38 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.701 1.0 . . . . 40.210000000000001 113.701 -162.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 15.0 mt -76.43 -26.56 55.6 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 113.509 0.929 . . . . 75.129999999999995 113.509 -178.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -65.69 -51.35 60.11 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.975 1.31 . . . . 72.510000000000005 107.591 175.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -44.4 -49.24 9.76 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 128.936 2.895 . . . . 73.450000000000003 111.359 -171.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.1 pttp -53.7 -51.61 62.72 Favored 'General case' 0 C--O 1.233 0.234 0 O-C-N 121.258 -0.901 . . . . 62.539999999999999 111.984 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.85 -30.4 50.97 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 113.283 0.845 . . . . 61.450000000000003 113.283 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -53.56 -41.25 66.3 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.704 1.602 . . . . 60.119999999999997 108.692 176.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.18 -86.03 0.32 Allowed 'General case' 0 C--N 1.345 0.389 0 CA-C-O 118.674 -0.679 . . . . 54.229999999999997 109.273 178.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.455 ' HB3' ' HB1' ' A' ' 96' ' ' ALA . 0.1 OUTLIER 48.61 -24.98 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.201 1 C-N-CA 132.121 4.168 . . . . 74.439999999999998 118.559 179.02 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.99 -36.81 13.37 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 128.516 2.726 . . . . 75.409999999999997 114.202 -167.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -107.67 -19.65 13.48 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.159 0.984 . . . . 72.530000000000001 110.155 -174.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.73 -32.16 71.44 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.973 1.309 . . . . 73.129999999999995 110.969 -176.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.503 ' CD1' HD23 ' A' ' 92' ' ' LEU . 0.2 OUTLIER -90.17 -5.71 56.14 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.912 0.885 . . . . 75.239999999999995 112.76 -175.288 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.432 HD11 ' HB2' ' A' ' 89' ' ' MET . 13.1 mt -81.19 -28.44 34.93 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 119.383 0.992 . . . . 60.340000000000003 113.464 -170.527 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -69.92 -34.32 71.18 Favored Glycine 0 C--O 1.223 -0.572 0 N-CA-C 109.089 -1.604 . . . . 51.25 109.089 169.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -65.2 -19.29 65.9 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 118.628 1.214 . . . . 62.43 112.295 176.391 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 32.1 t90 -77.13 -66.21 0.85 Allowed 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 125.594 1.558 . . . . 61.240000000000002 109.363 167.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.41 -31.18 61.65 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 118.407 -0.806 . . . . 61.119999999999997 112.805 -174.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -46.76 -63.29 1.06 Allowed 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 125.656 1.582 . . . . 34.299999999999997 110.567 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -55.63 -44.86 86.18 Favored Glycine 0 C--N 1.336 0.535 0 N-CA-C 111.235 -0.746 . . . . 55.030000000000001 111.235 -178.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 28.4 mt -62.85 -36.03 81.91 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.491 0.716 . . . . 73.439999999999998 111.814 -177.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 77.8 mt -82.7 1.17 39.96 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.114 1.766 . . . . 62.109999999999999 112.495 176.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 84.24 12.18 76.74 Favored Glycine 0 CA--C 1.527 0.797 0 C-N-CA 125.202 1.382 . . . . 74.450000000000003 113.915 177.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -87.78 133.07 33.94 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.852 1.261 . . . . 75.209999999999994 107.969 -177.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 33.0 p -140.84 167.84 21.22 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 125.966 1.706 . . . . 51.539999999999999 107.883 -179.025 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 56.19 -134.69 50.43 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 111.476 -0.65 . . . . 55.210000000000001 111.476 175.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -68.3 -26.96 65.9 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 117.59 0.695 . . . . 74.25 111.542 178.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.24 -35.56 77.57 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 123.606 0.762 . . . . 72.219999999999999 110.474 176.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.61 -48.02 24.05 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.178 -0.675 . . . . 54.149999999999999 109.178 173.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -62.49 -47.57 83.37 Favored 'General case' 0 C--O 1.226 -0.141 0 N-CA-C 109.846 -0.427 . . . . 71.310000000000002 109.846 -168.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.87 -42.83 84.96 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.454 1.102 . . . . 73.450000000000003 110.511 -177.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 31.6 t80 -58.32 -46.33 86.4 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 122.669 0.387 . . . . 72.109999999999999 110.274 175.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.17 -36.44 68.33 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 121.465 -0.772 . . . . 45.409999999999997 111.75 178.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 44.2 mt -75.17 10.14 1.68 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.292 1.437 . . . . 55.009999999999998 112.259 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.7 t -133.68 34.52 3.42 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 120.098 1.317 . . . . 72.430000000000007 111.248 169.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 81.4 t -132.18 85.33 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 O-C-N 121.081 -1.012 . . . . 72.120000000000005 108.853 177.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 16.4 t -151.1 122.54 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 124.615 1.166 . . . . 54.530000000000001 109.5 170.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 6.5 t -149.17 -38.97 0.15 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.202 1.001 . . . . 75.439999999999998 111.445 162.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.5 m . . . . . 0 CA--C 1.542 0.64 0 C-N-CA 126.312 1.845 . . . . 73.239999999999995 112.958 -176.125 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.514 ' OD2' ' HE2' ' A' ' 71' ' ' LYS . 0.6 OUTLIER . . . . . 0 N--CA 1.465 0.298 0 CA-C-O 118.777 -0.63 . . . . 74.329999999999998 110.225 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 72.4 t -57.07 -43.81 81.89 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 CA-C-N 120.304 1.411 . . . . 73.409999999999997 111.342 -173.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -56.91 -53.97 51.89 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.694 1.198 . . . . 54.049999999999997 109.185 175.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 26.8 ttm-85 -53.83 -42.18 68.19 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 125.679 1.591 . . . . 74.150000000000006 112.067 178.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.514 ' HE2' ' OD2' ' A' ' 67' ' ' ASP . 5.5 mptp? -75.25 -47.61 27.25 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 118.322 0.51 . . . . 74.329999999999998 109.749 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 16.3 mt -59.55 -44.33 93.27 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 117.689 -1.148 . . . . 74.510000000000005 110.444 -179.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.22 -18.79 64.86 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.988 1.267 . . . . 60.109999999999999 112.364 -177.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -87.4 -52.67 5.24 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.513 1.125 . . . . 62.240000000000002 110.371 170.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -60.18 -48.08 83.25 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 121.044 -1.035 . . . . 72.129999999999995 110.012 -174.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.8 tp -91.32 15.62 11.71 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 130.348 3.459 . . . . 64.340000000000003 111.577 -175.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -55.87 109.87 0.64 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.488 1.515 . . . . 72.319999999999993 109.88 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 110.05 -4.38 30.25 Favored Glycine 0 CA--C 1.528 0.847 0 C-N-CA 125.425 1.488 . . . . 52.409999999999997 112.511 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -133.05 -5.76 3.08 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.046 1.338 . . . . 73.319999999999993 113.275 -171.463 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -146.33 130.07 17.08 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.507 0.67 . . . . 52.539999999999999 110.602 169.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.39 161.13 25.88 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 126.262 1.825 . . . . 74.409999999999997 107.616 164.498 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -58.54 -45.13 89.56 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.973 0.892 . . . . 71.310000000000002 109.35 175.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -70.52 -27.89 64.53 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.689 0.796 . . . . 74.120000000000005 112.373 179.294 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 47.6 m -68.28 -36.19 79.0 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.665 0.786 . . . . 65.420000000000002 110.209 175.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 10.4 mt -69.65 -60.83 2.05 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 CA-C-N 119.937 1.244 . . . . 60.439999999999998 108.566 169.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.55 -18.5 65.4 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 114.173 1.175 . . . . 73.120000000000005 114.173 -164.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -91.91 -31.27 15.73 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 119.208 0.913 . . . . 62.240000000000002 110.419 178.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -64.34 -66.86 0.49 Allowed 'General case' 0 CA--C 1.514 -0.419 0 CA-C-N 119.21 0.914 . . . . 71.519999999999996 111.028 -173.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.432 ' HB2' HD11 ' A' ' 33' ' ' LEU . 5.3 ptt? -66.66 -14.91 63.06 Favored 'General case' 0 N--CA 1.462 0.162 0 N-CA-C 113.592 0.96 . . . . 54.149999999999999 113.592 -162.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 37.4 t -45.67 -49.2 4.29 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 C-N-CA 127.019 2.128 . . . . 72.140000000000001 111.794 166.391 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -82.0 -21.26 37.16 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 119.502 1.046 . . . . 72.510000000000005 111.838 -169.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.503 HD23 ' CD1' ' A' ' 32' ' ' LEU . 7.0 mp -66.47 -7.37 19.19 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 126.855 2.062 . . . . 73.430000000000007 111.454 -168.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 30.3 mtp180 -54.39 -42.17 70.08 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 122.95 0.5 . . . . 71.340000000000003 110.408 168.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.3 -52.59 8.93 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.617 0.767 . . . . 61.420000000000002 110.293 174.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.0 m -52.84 -29.59 28.77 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.048 0.939 . . . . 74.530000000000001 112.039 -177.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.455 ' HB1' ' HB3' ' A' ' 28' ' ' ARG . . . -55.18 -50.87 68.25 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 125.647 1.579 . . . . 44.520000000000003 114.135 177.65 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 9.3 ptt180 -75.47 -41.56 55.29 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 109.566 -0.531 . . . . 74.230000000000004 109.566 178.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -48.78 -55.87 10.28 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 126.687 1.995 . . . . 60.210000000000001 111.711 177.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -64.28 -25.39 68.03 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.792 0.724 . . . . 73.140000000000001 112.523 -174.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.8 mm -77.36 -44.58 30.26 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.254 0 O-C-N 120.707 -1.246 . . . . 71.340000000000003 109.452 176.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 91.8 mt -71.67 -10.46 13.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 C-N-CA 124.844 1.258 . . . . 75.510000000000005 110.501 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 10.7 t -86.72 -56.14 3.54 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.926 1.29 . . . . 60.119999999999997 108.65 170.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 66.8 mt-10 -101.61 56.87 0.83 Allowed 'General case' 0 C--O 1.236 0.385 0 N-CA-C 106.881 -1.525 . . . . 65.430000000000007 106.881 -168.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 83.6 mt . . . . . 0 C--O 1.25 1.107 0 C-N-CA 123.816 0.847 . . . . 71.430000000000007 109.038 -172.202 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . 0.327 1.1 p-80 . . . . . 0 CA--C 1.546 0.801 0 N-CA-C 113.637 0.976 . . . . 73.400000000000006 113.637 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 44.75 90.38 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.358 1.863 . . . . 70.439999999999998 113.988 177.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 60.69 -3.54 0.14 Allowed 'General case' 0 C--O 1.237 0.397 0 C-N-CA 128.2 2.6 . . . . 74.540000000000006 115.786 -166.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -60.56 -13.73 15.8 Favored 'General case' 0 C--O 1.218 -0.594 0 O-C-N 120.488 -1.382 . . . . 74.340000000000003 112.507 159.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -48.6 -41.05 29.61 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.868 1.213 . . . . 72.510000000000005 112.198 163.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -82.54 -41.83 19.15 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 118.401 0.546 . . . . 54.399999999999999 111.217 174.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -72.41 -44.63 62.18 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.245 1.018 . . . . 54.399999999999999 112.704 -167.507 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -120.08 105.62 11.19 Favored 'General case' 0 CA--C 1.517 -0.316 0 C-N-CA 127.088 2.155 . . . . 62.43 105.59 -175.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.36 -14.52 56.81 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 113.087 0.773 . . . . 51.200000000000003 113.087 -172.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -64.11 -35.72 81.67 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.952 0.901 . . . . 64.129999999999995 109.683 175.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.8 mt -70.85 -37.69 73.13 Favored 'General case' 0 C--O 1.234 0.265 0 O-C-N 120.881 -1.137 . . . . 74.409999999999997 111.086 174.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -60.01 -50.5 73.51 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 118.946 -0.55 . . . . 74.120000000000005 110.153 172.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -52.61 -56.91 12.08 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 126.103 1.761 . . . . 74.140000000000001 109.68 -178.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -45.12 -49.14 12.02 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 124.731 1.212 . . . . 63.439999999999998 111.407 -179.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -76.82 -40.18 48.83 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.055 0.761 . . . . 62.119999999999997 113.055 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -66.78 -19.03 65.66 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.063 -1.023 . . . . 73.5 110.256 178.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -90.15 13.88 13.93 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 127.656 2.382 . . . . 72.430000000000007 112.289 170.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.6 mmt85 -108.77 -30.37 8.2 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 120.065 1.302 . . . . 71.510000000000005 112.411 172.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.3 ptt85 -57.43 -15.95 8.13 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 115.582 1.697 . . . . 65.510000000000005 115.582 -169.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -121.3 -15.09 8.2 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 126.218 1.807 . . . . 74.140000000000001 111.168 -178.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.62 -22.56 65.33 Favored 'General case' 0 N--CA 1.471 0.591 0 O-C-N 120.698 -1.251 . . . . 74.239999999999995 111.64 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.447 HD12 ' H ' ' A' ' 32' ' ' LEU . 0.1 OUTLIER -106.17 -14.17 15.22 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.575 1.55 . . . . 71.150000000000006 114.128 -171.873 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.52 -34.35 17.01 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 125.422 1.489 . . . . 53.140000000000001 113.355 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -61.81 -24.34 64.42 Favored Glycine 0 CA--C 1.526 0.732 0 CA-C-O 118.386 -1.23 . . . . 63.140000000000001 113.379 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -65.24 -31.0 71.93 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.687 2.243 . . . . 63.43 112.488 -177.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.431 ' CD1' ' HE3' ' A' ' 88' ' ' LYS . 22.9 t90 -63.8 -72.37 0.14 Allowed 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 125.6 1.56 . . . . 73.239999999999995 108.492 175.02 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.47 -17.13 63.56 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 124.916 1.287 . . . . 60.140000000000001 113.917 -176.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -54.34 -57.41 11.37 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 119.352 0.978 . . . . 60.350000000000001 109.066 173.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.65 -38.25 93.49 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 111.347 -0.701 . . . . 75.109999999999999 111.347 -179.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.5 mp -61.22 -38.37 86.37 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.495 -1.003 . . . . 74.040000000000006 111.064 178.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 95.6 mt -89.14 5.84 42.76 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 127.04 2.136 . . . . 73.450000000000003 113.068 176.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 74.54 9.65 82.18 Favored Glycine 0 CA--C 1.534 1.226 0 C-N-CA 125.388 1.47 . . . . 44.240000000000002 114.424 177.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.9 mttt -85.82 137.96 32.4 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 119.341 1.57 . . . . 52.549999999999997 106.983 173.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 37.0 p -138.85 -178.0 5.13 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.664 -0.865 . . . . 75.230000000000004 108.664 168.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 47.47 -117.28 3.22 Favored Glycine 0 CA--C 1.524 0.619 0 C-N-CA 125.288 1.423 . . . . 31.239999999999998 112.941 174.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -82.65 -16.59 47.69 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.015 1.726 . . . . 75.140000000000001 112.686 -172.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -76.14 -48.8 19.27 Favored 'General case' 0 CA--C 1.512 -0.486 0 O-C-N 120.912 -1.118 . . . . 62.240000000000002 109.016 169.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -56.81 -42.99 80.51 Favored 'General case' 0 N--CA 1.445 -0.72 0 N-CA-C 108.748 -0.834 . . . . 61.119999999999997 108.748 175.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.3 ttm-85 -51.42 -47.72 62.91 Favored 'General case' 0 N--CA 1.437 -1.107 0 N-CA-C 112.96 0.726 . . . . 75.329999999999998 112.96 173.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.69 -49.25 66.69 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 118.091 0.405 . . . . 73.450000000000003 110.435 -178.037 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -52.34 -44.93 65.45 Favored 'General case' 0 N--CA 1.457 -0.093 0 C-N-CA 123.435 0.694 . . . . 72.230000000000004 110.696 175.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.46 -30.82 63.36 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 118.421 -0.8 . . . . 43.409999999999997 112.623 -174.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 18.0 mt -75.5 -3.89 36.63 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.2 1.0 . . . . 64.25 111.861 -175.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.6 t -133.3 49.27 2.31 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.589 1.156 . . . . 63.149999999999999 109.575 179.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 2.0 t -127.98 12.98 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 O-C-N 120.857 -1.152 . . . . 71.450000000000003 110.669 173.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 4.5 m -74.24 53.21 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 125.938 1.695 . . . . 64.549999999999997 112.144 176.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.1 t -79.76 60.82 3.52 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.275 1.43 . . . . 65.140000000000001 108.912 178.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.3 m . . . . . 0 C--O 1.238 0.497 0 N-CA-C 109.919 -0.4 . . . . 64.25 109.919 169.602 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.464 0.273 0 N-CA-C 112.431 0.53 . . . . 64.25 112.431 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 78.3 t -57.99 -43.62 85.25 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 123.823 0.849 . . . . 65.530000000000001 110.315 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -76.27 -32.51 58.85 Favored 'General case' 0 C--O 1.233 0.224 0 O-C-N 121.118 -0.989 . . . . 74.109999999999999 109.546 -179.084 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -50.56 -50.38 53.71 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 125.071 1.348 . . . . 71.219999999999999 112.089 -172.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -71.7 -23.6 61.67 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 119.301 0.955 . . . . 63.520000000000003 111.515 -171.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 9.5 mt -74.75 -61.31 1.92 Allowed 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.25 -1.019 . . . . 74.219999999999999 108.25 168.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.12 -37.6 64.5 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.293 1.037 . . . . 53.039999999999999 113.09 -173.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.18 -38.79 87.78 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 123.29 0.636 . . . . 74.209999999999994 111.491 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -74.52 -56.88 4.35 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 122.858 1.313 . . . . 72.25 108.43 175.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.4 tp -77.15 16.67 0.54 Allowed 'General case' 0 CA--C 1.534 0.329 1 C-N-CA 131.836 4.054 . . . . 64.209999999999994 113.963 -168.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 55.6 tt0 -52.4 122.33 8.6 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 127.14 2.176 . . . . 70.540000000000006 110.464 -174.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 102.27 -15.43 56.3 Favored Glycine 0 CA--C 1.53 1.01 0 C-N-CA 127.249 2.357 . . . . 31.120000000000001 113.034 178.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 35.3 mtmt -126.06 -5.46 6.75 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 119.276 1.538 . . . . 70.120000000000005 114.88 -158.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -154.74 126.43 7.52 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 120.57 1.532 . . . . 73.349999999999994 110.026 171.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.14 163.52 27.77 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.72 1.208 . . . . 74.319999999999993 110.573 -178.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 77.0 mt-10 -48.56 -59.22 3.68 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 124.642 1.177 . . . . 73.340000000000003 110.433 170.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -68.29 -20.73 64.78 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.813 -0.631 . . . . 64.140000000000001 112.114 -175.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 18.8 m -80.16 -40.71 26.77 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.788 1.635 . . . . 61.210000000000001 110.032 176.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 77.4 mt -59.71 -56.56 16.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 C-N-CA 124.788 1.235 . . . . 64.299999999999997 107.689 173.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.81 -47.3 80.57 Favored 'General case' 0 C--N 1.341 0.199 0 O-C-N 123.614 0.571 . . . . 64.5 110.998 -174.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.54 -43.27 89.2 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.273 0.629 . . . . 54.439999999999998 111.559 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.431 ' HE3' ' CD1' ' A' ' 36' ' ' TRP . 12.3 tptp -66.7 -39.03 87.89 Favored 'General case' 0 C--O 1.223 -0.29 0 O-C-N 121.265 -0.897 . . . . 74.019999999999996 111.216 -176.003 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 18.0 ptp -72.14 -31.4 65.94 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 119.073 -1.051 . . . . 61.509999999999998 112.369 -174.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 71.9 t -49.97 -47.15 23.69 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 123.47 0.708 . . . . 65.109999999999999 109.233 167.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -50.58 -45.41 57.2 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.136 1.374 . . . . 62.329999999999998 113.501 -163.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -75.6 11.89 1.18 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.213 1.19 . . . . 65.420000000000002 114.213 -173.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 3.3 tpt85 -49.91 -53.07 28.38 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.844 1.258 . . . . 72.400000000000006 111.3 -178.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -63.01 -50.28 71.31 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 123.823 0.849 . . . . 61.210000000000001 109.999 175.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.8 m -50.18 -45.65 53.66 Favored 'General case' 0 C--N 1.333 -0.125 0 C-N-CA 125.912 1.685 . . . . 74.319999999999993 110.147 -173.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -54.63 -40.65 69.15 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 124.305 1.042 . . . . 71.150000000000006 112.676 -177.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -81.68 -40.32 23.01 Favored 'General case' 0 C--N 1.341 0.202 0 CA-C-O 117.463 -1.256 . . . . 74.140000000000001 111.929 172.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -52.35 -41.78 63.34 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 119.391 0.996 . . . . 73.439999999999998 110.834 -179.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 -56.27 -50.14 72.21 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 118.966 0.803 . . . . 73.120000000000005 112.024 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 43.8 mm -68.07 -42.74 85.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 123.353 0.661 . . . . 73.430000000000007 110.26 -175.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 24.1 mt -66.38 -21.14 28.25 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 N-CA-C 109.036 -0.727 . . . . 74.25 109.036 177.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 33.8 t -89.54 -6.07 56.68 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.584 1.154 . . . . 62.219999999999999 111.783 177.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -122.72 35.79 4.8 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 125.818 1.647 . . . . 72.030000000000001 108.812 -171.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 21.8 mm . . . . . 0 C--O 1.252 1.19 0 N-CA-C 107.46 -1.311 . . . . 74.209999999999994 107.46 172.687 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.54 0.573 0 N-CA-C 108.514 -0.921 . . . . 63.439999999999998 108.514 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 64.6 95.17 0.05 Allowed 'General case' 0 C--O 1.235 0.341 0 C-N-CA 126.87 2.068 . . . . 72.319999999999993 111.063 174.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 57.71 0.21 0.1 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 127.729 2.412 . . . . 64.129999999999995 114.21 -166.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 18.5 mmtm -66.33 -16.73 64.29 Favored 'General case' 0 C--O 1.221 -0.433 0 O-C-N 120.194 -1.566 . . . . 73.439999999999998 112.988 -178.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -50.22 -28.33 7.4 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 125.612 1.565 . . . . 72.409999999999997 114.826 173.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.95 -15.67 63.71 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.632 0.604 . . . . 71.239999999999995 112.632 178.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 64.4 t-80 -130.28 141.57 50.6 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 126.138 1.775 . . . . 74.120000000000005 108.129 -164.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 59.51 -175.84 0.1 Allowed 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.839 1.256 . . . . 74.150000000000006 109.532 -160.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -119.37 -19.07 8.39 Favored 'General case' 0 C--O 1.225 -0.21 0 O-C-N 121.146 -0.971 . . . . 74.349999999999994 111.883 164.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.88 -41.86 83.4 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.613 0.765 . . . . 73.140000000000001 110.516 -170.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.0 mt -71.96 -46.4 57.54 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 108.672 -0.862 . . . . 71.25 108.672 -175.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -61.45 -43.84 98.16 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 124.538 1.135 . . . . 73.439999999999998 111.977 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -58.79 -36.9 75.19 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 124.185 0.994 . . . . 74.140000000000001 111.014 -177.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.06 -29.65 44.97 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.821 0.848 . . . . 72.129999999999995 111.498 178.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.786 ' HB1' ' HA ' ' A' ' 97' ' ' ARG . . . -74.53 -54.06 8.24 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 124.717 1.207 . . . . 61.229999999999997 112.049 178.263 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.8 tp10 -55.87 -32.97 64.15 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.588 -0.695 . . . . 72.329999999999998 109.886 174.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -75.34 8.56 2.66 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.513 1.125 . . . . 70.349999999999994 112.31 178.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.2 mmt180 -87.91 -23.71 23.84 Favored 'General case' 0 C--O 1.231 0.111 0 O-C-N 120.656 -1.278 . . . . 74.209999999999994 111.142 166.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.3 ptt180 -67.19 -23.0 65.71 Favored 'General case' 0 C--N 1.344 0.364 0 CA-C-N 120.976 1.716 . . . . 54.299999999999997 115.185 -149.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -110.45 -12.33 14.4 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-O 118.222 -0.894 . . . . 73.420000000000002 112.02 170.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.46 -55.01 31.74 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 125.057 1.343 . . . . 74.0 110.405 171.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -66.22 -9.61 33.84 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.859 1.059 . . . . 73.299999999999997 113.859 -172.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.7 tp -56.33 -31.93 64.2 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 126.946 2.098 . . . . 65.329999999999998 111.291 171.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.49 -31.71 81.68 Favored Glycine 0 CA--C 1.532 1.141 0 O-C-N 121.252 -0.905 . . . . 74.430000000000007 112.325 176.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -68.86 -26.99 65.42 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.797 1.298 . . . . 74.239999999999995 110.768 -178.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 20.6 t90 -68.6 -65.26 0.72 Allowed 'General case' 0 N--CA 1.462 0.144 0 C-N-CA 124.87 1.268 . . . . 74.340000000000003 109.152 173.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.18 -41.36 71.83 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 118.765 -0.636 . . . . 63.119999999999997 111.878 -174.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -44.87 -60.8 1.87 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.523 1.129 . . . . 65.010000000000005 112.92 -178.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.65 -30.4 77.52 Favored Glycine 0 CA--C 1.528 0.898 0 CA-C-N 118.577 0.626 . . . . 72.340000000000003 112.58 -175.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 56.9 mt -68.13 -41.51 81.58 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.131 0.972 . . . . 72.129999999999995 110.012 175.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.8 mp -69.96 -1.84 10.81 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 126.387 1.875 . . . . 50.329999999999998 113.72 168.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 74.5 4.22 69.08 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 125.54 1.543 . . . . 65.319999999999993 113.679 -179.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 53.1 mttm -76.12 128.75 35.61 Favored 'General case' 0 CA--C 1.524 -0.033 0 CA-C-N 119.875 1.838 . . . . 71.430000000000007 106.856 170.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 p -134.72 166.29 23.29 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 123.823 0.849 . . . . 64.310000000000002 109.066 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 55.21 -129.74 46.42 Favored Glycine 0 CA--C 1.525 0.663 0 C-N-CA 123.667 0.651 . . . . 33.130000000000003 112.057 176.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -61.1 -36.2 79.05 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 124.645 1.178 . . . . 72.430000000000007 111.005 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.42 -37.33 86.88 Favored 'General case' 0 N--CA 1.465 0.303 0 O-C-N 121.179 -0.95 . . . . 70.319999999999993 111.296 177.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.44 -43.43 63.8 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 123.112 0.565 . . . . 74.310000000000002 109.858 177.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.5 ptp180 -65.6 -46.09 80.66 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 109.279 -0.637 . . . . 64.310000000000002 109.279 -173.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.25 -36.6 84.19 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.681 1.192 . . . . 62.310000000000002 111.542 -178.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -65.23 -45.8 83.18 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.646 0.779 . . . . 74.409999999999997 110.588 173.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -69.36 -14.95 63.2 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 114.211 1.189 . . . . 71.019999999999996 114.211 -174.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 64.3 mt -58.44 -20.54 45.77 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 119.432 1.014 . . . . 71.140000000000001 112.759 -176.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.0 t -135.32 32.12 3.13 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.352 1.061 . . . . 71.400000000000006 110.586 -168.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 95.0 t -113.61 99.57 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 N-CA-C 106.446 -1.687 . . . . 74.310000000000002 106.446 177.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 9.6 p -156.12 135.88 3.99 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 N-CA-C 107.089 -1.449 . . . . 71.230000000000004 107.089 164.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.7 t 177.21 155.77 0.29 Allowed 'General case' 0 C--O 1.235 0.341 0 C-N-CA 128.353 2.661 . . . . 73.239999999999995 105.477 172.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.2 p . . . . . 0 C--O 1.237 0.402 0 CA-C-N 119.012 0.824 . . . . 73.099999999999994 108.966 167.401 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.546 0.823 0 N-CA-C 116.195 1.924 . . . . 70.329999999999998 116.195 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 2.1 p -70.12 -57.49 7.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 C-N-CA 126.923 2.089 . . . . 52.509999999999998 109.388 174.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -63.48 -18.54 63.89 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 124.949 1.3 . . . . 74.430000000000007 112.282 -179.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -44.91 -46.81 11.14 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 119.967 1.258 . . . . 74.310000000000002 112.431 -172.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.1 mppt? -78.85 -1.4 34.82 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.163 0.985 . . . . 74.140000000000001 112.918 -174.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 72.1 mt -104.51 -54.33 2.54 Favored 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 126.265 1.826 . . . . 53.109999999999999 108.285 168.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.33 -54.15 44.21 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 126.133 1.773 . . . . 72.319999999999993 111.352 -170.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -76.18 -19.31 58.56 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 111.881 0.326 . . . . 74.299999999999997 111.881 -177.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.37 -50.79 35.21 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 108.007 -1.109 . . . . 71.030000000000001 108.007 173.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 79.9 mt -80.62 43.35 0.66 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 129.144 2.978 . . . . 70.420000000000002 110.573 175.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -52.56 104.25 0.09 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.729 1.611 . . . . 70.0 109.76 177.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 69.03 14.15 67.79 Favored Glycine 0 CA--C 1.533 1.179 0 CA-C-O 118.799 -1.001 . . . . 63.020000000000003 113.844 -177.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 25.0 mtmm -113.46 -11.19 13.13 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.287 1.543 . . . . 74.409999999999997 112.055 178.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -148.69 138.93 22.42 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.204 -1.035 . . . . 64.010000000000005 108.204 165.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.41 161.82 25.9 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 125.787 1.635 . . . . 62.210000000000001 109.407 176.386 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 85.0 mt-10 -59.83 -46.31 89.66 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.46 0.704 . . . . 74.439999999999998 110.091 175.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -74.01 -15.18 61.1 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 121.379 -0.826 . . . . 70.319999999999993 111.311 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.6 m -74.46 -32.88 62.74 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 117.785 -1.102 . . . . 54.43 109.975 171.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 11.7 mt -58.5 -60.31 2.47 Favored 'Isoleucine or valine' 0 C--O 1.239 0.516 0 CA-C-N 120.624 1.557 . . . . 74.310000000000002 108.874 177.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -53.37 -39.73 64.41 Favored 'General case' 0 C--N 1.343 0.314 0 O-C-N 124.679 1.237 . . . . 72.0 109.978 -178.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.25 -45.51 76.49 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 119.625 -0.226 . . . . 50.399999999999999 110.567 -176.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.36 -38.31 71.59 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.592 0.589 . . . . 74.340000000000003 112.592 -163.019 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 33.1 mtt -66.93 -0.73 3.31 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.251 -0.905 . . . . 44.409999999999997 112.684 176.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 46.6 t -120.58 -29.15 1.76 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 C-N-CA 126.482 1.913 . . . . 63.039999999999999 110.132 -178.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -55.67 -48.66 74.69 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.368 1.467 . . . . 74.430000000000007 109.007 175.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 15.3 mt -77.43 4.51 10.8 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.013 1.116 . . . . 54.310000000000002 114.013 -176.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 63.9 ttt180 -66.28 -20.64 66.16 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 120.654 -1.279 . . . . 61.240000000000002 113.543 -166.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -88.27 -46.19 9.42 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 119.658 1.117 . . . . 43.210000000000001 110.355 170.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 52.4 m -50.38 -36.19 31.51 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.261 1.024 . . . . 65.439999999999998 110.532 177.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -46.13 -49.58 16.54 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.22 1.008 . . . . 51.350000000000001 113.037 175.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.786 ' HA ' ' HB1' ' A' ' 25' ' ' ALA . 15.9 ptt-85 -79.88 -37.82 34.01 Favored 'General case' 0 C--N 1.342 0.259 0 CA-C-N 118.421 0.555 . . . . 64.450000000000003 110.911 -179.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -56.72 -38.11 71.9 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 124.572 1.149 . . . . 70.310000000000002 110.426 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -57.38 -36.73 71.63 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 119.203 0.911 . . . . 74.209999999999994 112.441 -175.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.9 mm -72.62 -48.47 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 CA-C-N 120.196 1.362 . . . . 64.230000000000004 107.885 177.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 70.1 mt -61.02 -13.63 7.9 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 C-N-CA 126.031 1.732 . . . . 71.329999999999998 110.745 -177.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -120.79 10.69 11.0 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.972 1.309 . . . . 62.439999999999998 112.106 -178.18 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 84.4 mt-10 -121.76 22.39 10.5 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.703 1.201 . . . . 73.329999999999998 110.446 174.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 35.2 mm . . . . . 0 C--O 1.256 1.407 0 C-N-CA 128.66 2.784 . . . . 73.120000000000005 110.599 -170.526 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.54 0.579 0 N-CA-C 114.84 1.422 . . . . 60.240000000000002 114.84 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -81.17 -85.6 0.1 Allowed 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.125 -0.985 . . . . 73.120000000000005 108.868 171.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.97 -14.76 61.08 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.95 0.722 . . . . 61.539999999999999 112.95 -174.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 25.2 mmtm -64.04 -12.22 36.57 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 118.227 -0.892 . . . . 74.120000000000005 113.154 -179.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -62.23 -17.26 57.84 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 120.622 1.555 . . . . 74.510000000000005 113.578 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -93.59 17.46 11.65 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.901 0.88 . . . . 75.510000000000005 111.825 173.487 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -143.37 -64.91 0.39 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.806 1.643 . . . . 75.450000000000003 110.813 -174.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -86.59 123.29 31.61 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 124.52 1.128 . . . . 75.329999999999998 111.406 -166.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.0 -33.99 75.66 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.386 1.074 . . . . 74.209999999999994 110.894 178.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -59.82 -24.39 64.13 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.869 0.867 . . . . 75.519999999999996 111.32 -175.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 48.7 mt -84.65 -46.07 11.86 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 124.992 1.317 . . . . 63.020000000000003 109.398 -179.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -50.6 -51.39 48.89 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.62 1.568 . . . . 62.340000000000003 108.68 176.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.79 -46.91 88.68 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 124.297 1.039 . . . . 71.409999999999997 111.606 -178.004 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -66.52 -39.26 88.54 Favored 'General case' 0 N--CA 1.44 -0.938 0 O-C-N 119.632 -1.917 . . . . 63.450000000000003 109.628 -177.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.8 -44.79 95.24 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 118.068 0.394 . . . . 74.340000000000003 111.894 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.3 tm-20 -53.61 -38.47 64.02 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.388 0.613 . . . . 75.010000000000005 110.307 173.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -78.24 1.76 20.52 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.945 0.898 . . . . 63.350000000000001 113.38 -175.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.4 mmt-85 -80.23 -19.08 47.74 Favored 'General case' 0 N--CA 1.464 0.245 0 O-C-N 120.268 -1.52 . . . . 72.450000000000003 110.95 164.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 45.2 mtp180 -52.95 -41.94 64.99 Favored 'General case' 0 C--N 1.342 0.279 0 N-CA-C 114.587 1.328 . . . . 72.030000000000001 114.587 -169.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -95.23 -31.02 13.69 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 123.813 0.695 . . . . 60.420000000000002 111.671 -177.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -44.6 -52.57 7.99 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.047 1.339 . . . . 74.239999999999995 111.536 -178.182 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.98 -5.08 44.59 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 114.805 1.409 . . . . 74.430000000000007 114.805 -169.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 25.7 tp -71.52 -32.52 68.29 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 127.141 2.176 . . . . 72.200000000000003 110.508 171.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -57.19 -48.59 78.78 Favored Glycine 0 C--N 1.34 0.793 0 N-CA-C 110.568 -1.013 . . . . 63.420000000000002 110.568 173.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -63.88 -30.13 71.24 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 124.807 1.243 . . . . 63.329999999999998 112.803 -170.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 9.1 t90 -63.89 -71.6 0.17 Allowed 'General case' 0 C--O 1.231 0.117 0 N-CA-C 107.446 -1.316 . . . . 72.120000000000005 107.446 171.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.1 -32.35 34.77 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 125.496 1.518 . . . . 72.040000000000006 112.394 -173.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -45.17 -52.95 8.75 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 119.383 0.992 . . . . 73.430000000000007 111.53 174.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.58 -42.22 97.64 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 111.63 -0.588 . . . . 73.209999999999994 111.63 -178.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.6 mp -61.68 -46.29 90.35 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 125.365 1.466 . . . . 74.319999999999993 109.988 177.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.2 mp -63.2 -28.49 70.08 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.89 0.876 . . . . 42.43 110.478 175.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 104.21 20.38 10.49 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 126.237 1.875 . . . . 63.32 112.181 176.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 39.7 mttm -89.97 133.26 34.9 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 107.461 -1.311 . . . . 74.430000000000007 107.461 169.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.6 p -132.71 162.28 31.84 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 123.577 0.751 . . . . 55.420000000000002 109.479 165.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.51 -135.75 22.51 Favored Glycine 0 N--CA 1.448 -0.508 0 N-CA-C 110.322 -1.111 . . . . 33.149999999999999 110.322 175.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -66.22 -27.22 67.81 Favored 'General case' 0 C--O 1.226 -0.175 0 O-C-N 122.297 -0.531 . . . . 60.310000000000002 112.389 -177.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -56.61 -50.08 73.04 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.997 1.319 . . . . 75.239999999999995 109.123 174.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.13 -40.14 71.6 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 125.44 1.496 . . . . 72.030000000000001 110.299 -177.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.7 ttt85 -59.84 -49.96 75.68 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 123.334 0.654 . . . . 60.340000000000003 109.596 177.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.62 -44.78 95.92 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.153 0.981 . . . . 55.240000000000002 110.684 -178.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 88.6 t80 -57.08 -39.02 74.15 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.498 1.119 . . . . 73.239999999999995 111.099 175.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.85 -4.19 30.24 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 120.59 -1.319 . . . . 61.439999999999998 113.229 178.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 12.9 mt -84.62 -0.07 52.01 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 120.547 1.522 . . . . 62.229999999999997 112.145 176.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 12.0 t -130.49 37.72 3.82 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 120.621 1.555 . . . . 52.32 112.054 -173.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 1.8 p -134.88 99.0 2.37 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 O-C-N 121.021 -1.049 . . . . 73.439999999999998 110.552 -175.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.2 p -159.59 109.36 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 124.147 0.979 . . . . 55.399999999999999 113.246 166.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.4 t -149.45 57.9 1.0 Allowed 'General case' 0 CA--C 1.554 1.098 0 O-C-N 121.202 -0.936 . . . . 44.240000000000002 111.246 177.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.4 t . . . . . 0 CA--C 1.542 0.641 0 O-C-N 120.218 -1.551 . . . . 61.049999999999997 110.026 -175.059 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.5 t0 . . . . . 0 N--CA 1.469 0.512 0 N-CA-C 112.868 0.692 . . . . 62.119999999999997 112.868 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.2 t -55.19 -59.44 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-N 118.761 0.71 . . . . 75.439999999999998 109.499 174.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -57.59 -36.51 71.83 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.497 0.719 . . . . 75.040000000000006 110.612 -178.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.6 tpt180 -58.88 -26.58 64.41 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 124.489 1.116 . . . . 72.120000000000005 112.439 -178.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.7 mmmt -99.41 -43.84 6.41 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 118.488 0.585 . . . . 75.329999999999998 109.505 175.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -57.44 -54.8 42.7 Favored 'General case' 0 C--O 1.223 -0.341 0 C-N-CA 124.857 1.263 . . . . 75.010000000000005 110.204 -174.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.09 -4.0 15.46 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 114.006 1.113 . . . . 32.030000000000001 114.006 -178.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -87.19 -57.47 2.95 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 108.399 -0.963 . . . . 74.200000000000003 108.399 166.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.05 -43.3 70.09 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 125.068 1.347 . . . . 74.439999999999998 110.653 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.3 tp -110.88 19.85 18.13 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 126.841 2.056 . . . . 75.439999999999998 111.512 -165.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 69.5 tt0 -48.64 118.9 2.76 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 126.007 1.723 . . . . 71.219999999999999 108.284 172.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 81.11 -0.58 87.21 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 125.517 1.532 . . . . 75.120000000000005 114.78 178.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 11.3 mtpp -119.54 1.88 11.18 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 118.899 1.35 . . . . 75.239999999999995 111.785 -172.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -148.68 -163.08 1.7 Allowed 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 125.654 1.582 . . . . 75.230000000000004 107.194 168.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -145.65 158.2 43.88 Favored 'General case' 0 CA--C 1.51 -0.562 0 C-N-CA 125.898 1.679 . . . . 60.340000000000003 108.05 -175.004 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -59.85 -42.52 93.83 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 118.577 0.626 . . . . 51.329999999999998 111.596 -178.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.92 -39.41 72.72 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.021 0.373 . . . . 75.430000000000007 111.128 176.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 53.7 m -59.81 -48.18 82.71 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.197 0.999 . . . . 75.200000000000003 110.819 177.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 64.6 mt -63.34 -50.41 78.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 108.447 -0.945 . . . . 73.129999999999995 108.447 -177.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.97 -40.44 97.73 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 120.703 -0.399 . . . . 74.25 110.071 -176.479 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.8 -54.82 41.82 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 118.156 -0.926 . . . . 71.030000000000001 110.37 176.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.21 -56.58 12.1 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 118.937 0.789 . . . . 73.209999999999994 111.698 -176.737 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 8.9 ptp -66.09 -26.88 67.68 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 119.468 -0.893 . . . . 61.119999999999997 111.603 -173.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 59.7 t -78.9 -51.99 16.07 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 O-C-N 121.089 -1.007 . . . . 75.340000000000003 110.432 176.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -61.1 -31.46 71.15 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.594 1.158 . . . . 73.310000000000002 112.305 -162.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 18.1 mt -75.63 1.1 15.36 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.57 1.548 . . . . 74.140000000000001 112.894 -177.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 30.4 ttt180 -50.89 -45.81 60.3 Favored 'General case' 0 C--N 1.34 0.195 0 C-N-CA 124.433 1.093 . . . . 60.310000000000002 111.008 177.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -56.21 -61.61 2.28 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.707 0.803 . . . . 71.049999999999997 110.961 174.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 10.9 m -49.26 -37.35 23.26 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 127.265 2.226 . . . . 75.219999999999999 111.993 -175.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -51.08 -30.7 16.66 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.623 1.169 . . . . 72.329999999999998 113.469 -178.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 34.2 ttp180 -69.2 -60.3 2.44 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 108.582 -0.896 . . . . 74.310000000000002 108.582 174.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 11.8 mp0 -55.52 -35.1 65.28 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 118.002 -0.999 . . . . 63.329999999999998 110.651 -173.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -50.63 -45.77 57.89 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-O 118.409 -0.805 . . . . 72.340000000000003 112.483 -178.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 45.7 mm -63.77 -46.37 94.66 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-N 119.33 0.968 . . . . 62.149999999999999 109.72 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 32.4 mt -70.11 -12.03 15.62 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 124.614 1.166 . . . . 74.519999999999996 109.452 179.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 13.1 t -108.21 10.2 27.93 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.93 1.692 . . . . 41.030000000000001 109.154 179.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -112.81 12.53 19.54 Favored 'General case' 0 C--O 1.232 0.162 0 O-C-N 119.93 -1.732 . . . . 72.329999999999998 109.941 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 31.8 mt . . . . . 0 C--O 1.251 1.163 0 N-CA-C 107.704 -1.221 . . . . 72.450000000000003 107.704 -178.619 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.473 0.678 0 N-CA-C 116.256 1.947 . . . . 61.310000000000002 116.256 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -61.96 119.58 9.12 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.984 0.914 . . . . 73.219999999999999 110.679 -177.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 56.06 -22.4 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 130.447 3.499 . . . . 42.539999999999999 116.883 -174.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 32.6 mmtt -50.01 -28.86 7.59 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 128.754 2.822 . . . . 63.229999999999997 113.37 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.49 -25.31 64.34 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 113.014 0.746 . . . . 72.129999999999995 113.014 -176.076 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.39 -8.13 43.82 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.152 0.797 . . . . 71.219999999999999 113.152 176.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 13.3 t-80 -145.06 -171.39 3.64 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 125.96 1.704 . . . . 74.040000000000006 108.03 -160.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 58.3 -164.19 0.19 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.228 1.411 . . . . 60.299999999999997 110.365 170.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -143.44 -39.18 0.32 Allowed 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.847 1.259 . . . . 63.020000000000003 110.756 167.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -54.67 -43.67 72.62 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 119.554 1.07 . . . . 64.239999999999995 111.586 -172.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 80.4 mt -75.1 -33.89 61.68 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 123.872 0.869 . . . . 74.439999999999998 112.444 177.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -69.93 -36.8 75.62 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.343 1.457 . . . . 72.099999999999994 110.698 -177.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -46.13 -35.96 5.47 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 128.458 2.703 . . . . 60.240000000000002 113.76 -173.06 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.09 -53.44 57.78 Favored 'General case' 0 C--O 1.225 -0.212 0 O-C-N 120.652 -1.28 . . . . 73.299999999999997 111.138 175.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.74 -39.41 84.25 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 118.985 0.811 . . . . 73.030000000000001 111.884 178.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -50.94 -37.57 45.15 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.73 1.212 . . . . 74.5 110.814 -176.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -110.08 -85.34 0.55 Allowed 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.607 -0.886 . . . . 74.540000000000006 108.607 178.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 50.37 -12.95 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 129.128 2.971 . . . . 73.239999999999995 117.414 -173.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 30.7 mtm180 -44.45 -48.59 9.99 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 126.958 2.103 . . . . 74.109999999999999 113.186 -158.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -100.25 -24.3 14.59 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 122.456 0.302 . . . . 62.119999999999997 111.257 -177.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -7.89 1.06 Allowed 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 126.949 2.1 . . . . 75.150000000000006 114.225 -173.126 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.415 ' H ' HD23 ' A' ' 32' ' ' LEU . 2.4 pt? -120.72 -15.16 8.45 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 119.872 1.215 . . . . 62.399999999999999 112.919 -178.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 12.3 tp -60.56 -21.14 62.23 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 127.707 2.403 . . . . 55.219999999999999 111.891 172.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -70.22 -42.29 66.87 Favored Glycine 0 C--O 1.224 -0.499 0 N-CA-C 110.48 -1.048 . . . . 61.039999999999999 110.48 175.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -61.82 -39.35 91.47 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.548 1.174 . . . . 71.219999999999999 110.663 179.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 36.1 t90 -55.03 -63.47 1.14 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.627 0.771 . . . . 75.140000000000001 109.375 172.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.83 -29.4 69.86 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.069 0.948 . . . . 54.350000000000001 113.337 -173.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -55.59 -54.46 43.82 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 124.317 1.047 . . . . 60.420000000000002 110.136 -177.011 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -67.37 -5.83 37.67 Favored Glycine 0 CA--C 1.532 1.117 0 CA-C-O 119.032 -0.871 . . . . 73.239999999999995 113.687 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 35.8 mt -90.93 -37.06 13.76 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 119.339 1.57 . . . . 63.020000000000003 110.42 171.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.416 HD23 ' HE2' ' A' ' 79' ' ' LYS . 47.2 mt -91.36 8.79 34.43 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.58 1.952 . . . . 73.150000000000006 113.163 -173.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 75.65 5.25 78.13 Favored Glycine 0 CA--C 1.527 0.786 0 CA-C-O 119.274 -0.737 . . . . 41.549999999999997 113.0 -177.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.1 mttm -78.91 119.66 22.41 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 119.072 1.436 . . . . 64.040000000000006 107.125 -179.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 67.1 p -135.29 175.95 9.12 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 107.789 -1.189 . . . . 64.140000000000001 107.789 159.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 58.12 -145.25 41.26 Favored Glycine 0 CA--C 1.532 1.096 0 N-CA-C 111.571 -0.612 . . . . 60.409999999999997 111.571 -172.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -58.0 -31.32 66.84 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.312 1.045 . . . . 72.340000000000003 111.348 -172.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -63.57 -42.86 98.29 Favored 'General case' 0 C--O 1.225 -0.224 0 C-N-CA 123.8 0.84 . . . . 73.030000000000001 110.966 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.3 -41.54 69.81 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.856 -0.794 . . . . 71.439999999999998 108.856 177.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.8 ptt-85 -73.07 -41.64 63.91 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 119.368 -0.933 . . . . 73.439999999999998 108.928 -169.088 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.18 -42.33 99.36 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 123.517 0.727 . . . . 74.129999999999995 110.958 176.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -58.1 -46.09 86.1 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.3 0.5 . . . . 75.329999999999998 110.318 173.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.97 -12.93 5.15 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.541 1.136 . . . . 75.230000000000004 113.226 176.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 56.3 mt -101.6 1.44 37.82 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.759 1.624 . . . . 75.349999999999994 112.63 -177.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.8 t -125.23 -9.77 7.02 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 119.501 1.046 . . . . 75.150000000000006 112.502 176.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 12.3 m -70.71 84.39 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 C-N-CA 126.13 1.772 . . . . 64.230000000000004 111.756 175.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 2.9 p -139.99 132.98 35.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 O-C-N 121.167 -0.958 . . . . 61.32 111.804 151.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.1 t -148.47 -164.86 2.12 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 106.058 -1.83 . . . . 74.310000000000002 106.058 162.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.543 0.677 0 C-N-CA 125.435 1.494 . . . . 75.129999999999995 112.303 -178.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 38.2 t70 . . . . . 0 CA--C 1.529 0.173 0 CA-C-O 118.91 -0.567 . . . . 72.319999999999993 109.665 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.3 p -60.22 -44.93 96.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-N 119.543 1.065 . . . . 72.439999999999998 111.198 179.178 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -62.08 -21.07 64.65 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 121.062 -1.024 . . . . 63.509999999999998 113.492 177.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -53.56 -38.85 64.25 Favored 'General case' 0 C--N 1.343 0.287 0 CA-C-N 119.124 0.875 . . . . 73.239999999999995 110.949 -174.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -66.96 -31.62 72.31 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.612 -0.514 . . . . 73.519999999999996 109.612 -171.12 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -78.2 -51.18 10.59 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-O 118.487 -0.768 . . . . 74.439999999999998 109.12 169.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.58 -40.83 72.53 Favored 'General case' 0 C--N 1.334 -0.107 0 C-N-CA 125.074 1.35 . . . . 74.25 113.214 -171.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.81 -17.07 62.18 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.355 1.062 . . . . 73.420000000000002 112.503 179.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -97.95 -55.02 2.91 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 108.782 -0.821 . . . . 74.519999999999996 108.782 -178.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.7 mt -78.71 40.4 0.38 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 127.43 2.292 . . . . 74.409999999999997 111.055 170.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -57.97 113.07 1.72 Allowed 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.836 1.254 . . . . 73.239999999999995 108.312 175.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 75.31 12.05 83.81 Favored Glycine 0 CA--C 1.528 0.884 0 C-N-CA 124.708 1.147 . . . . 52.219999999999999 112.949 -178.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.416 ' HE2' HD23 ' A' ' 41' ' ' LEU . 25.4 mtpp -133.02 -8.63 3.05 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.013 1.325 . . . . 74.239999999999995 112.153 -172.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -157.69 114.83 2.98 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.883 1.273 . . . . 73.140000000000001 108.25 163.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -67.44 170.65 7.1 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 124.72 1.208 . . . . 63.509999999999998 110.912 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -47.42 -55.74 8.36 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.123 1.769 . . . . 75.439999999999998 110.12 166.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -69.84 -30.48 67.99 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 122.967 0.507 . . . . 75.439999999999998 111.119 -176.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 30.5 m -65.09 -53.63 42.43 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 109.268 -0.642 . . . . 71.219999999999999 109.268 176.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 41.2 mt -61.74 -52.46 60.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 CA-C-N 119.575 1.079 . . . . 75.140000000000001 109.017 -178.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.04 -23.41 67.43 Favored 'General case' 0 C--N 1.34 0.157 0 N-CA-C 111.849 0.314 . . . . 75.120000000000005 111.849 -175.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.42 -54.73 5.21 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 108.717 -0.845 . . . . 35.530000000000001 108.717 174.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.9 tppm? -54.56 -57.1 12.73 Favored 'General case' 0 CA--C 1.512 -0.518 0 C-N-CA 125.948 1.699 . . . . 44.100000000000001 112.136 -171.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 5.2 ptm -59.56 -26.93 65.79 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 120.067 -0.653 . . . . 64.5 111.237 -175.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 59.7 t -88.25 -27.08 5.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 125.625 1.57 . . . . 64.530000000000001 111.832 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -55.52 -57.82 10.34 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 126.342 1.857 . . . . 73.099999999999994 108.053 172.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.2 pp -80.8 11.58 3.81 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.912 1.685 . . . . 73.219999999999999 113.275 -172.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -53.37 -50.99 63.91 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 120.945 -1.097 . . . . 74.219999999999999 110.971 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.99 -45.41 85.73 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.232 0.539 . . . . 75.439999999999998 110.694 175.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.9 m -50.92 -35.92 35.72 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.625 1.57 . . . . 51.130000000000003 111.517 -178.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -47.79 -45.57 29.61 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.26 1.424 . . . . 74.019999999999996 113.547 177.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -78.86 -43.44 25.08 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.807 1.185 . . . . 60.299999999999997 111.038 174.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.14 -31.91 67.65 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 124.434 1.094 . . . . 54.5 112.538 -175.131 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -61.73 -24.48 66.83 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.338 0.972 . . . . 71.319999999999993 112.448 177.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 26.7 mm -81.77 -38.38 15.92 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 C-N-CA 124.106 0.962 . . . . 43.119999999999997 110.03 175.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 23.0 mm -59.41 -27.17 36.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 123.733 0.813 . . . . 61.299999999999997 109.648 174.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.63 -17.41 61.67 Favored 'General case' 0 N--CA 1.44 -0.928 0 C-N-CA 125.889 1.675 . . . . 51.229999999999997 112.021 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -139.37 62.23 1.53 Allowed 'General case' 0 C--O 1.237 0.422 0 N-CA-C 106.403 -1.702 . . . . 60.0 106.403 -175.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 95.8 mt . . . . . 0 C--O 1.255 1.383 0 N-CA-C 107.089 -1.448 . . . . 71.010000000000005 107.089 162.582 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . 0.466 ' HA ' HD13 ' A' ' 21' ' ' LEU . 0.4 OUTLIER . . . . . 0 CA--C 1.541 0.603 0 N-CA-C 113.882 1.068 . . . . 74.099999999999994 113.882 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -50.1 109.26 0.28 Allowed 'General case' 0 C--O 1.238 0.451 0 C-N-CA 126.635 1.974 . . . . 74.200000000000003 109.708 175.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 48.43 33.58 4.06 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 126.969 2.108 . . . . 75.319999999999993 113.759 -175.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 26.2 mttt -114.4 -10.3 12.65 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.346 1.059 . . . . 71.230000000000004 113.175 174.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -66.15 -21.51 66.34 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 119.311 0.959 . . . . 75.530000000000001 112.863 -171.222 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -122.67 72.55 1.08 Allowed 'General case' 0 C--O 1.232 0.155 0 N-CA-C 107.261 -1.385 . . . . 63.310000000000002 107.261 162.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -164.44 -46.98 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.031 0.932 . . . . 74.219999999999999 110.48 173.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.58 161.27 13.71 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 121.52 -0.737 . . . . 64.530000000000001 111.488 -167.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -93.8 -38.67 11.14 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.199 0.999 . . . . 73.239999999999995 109.576 162.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -44.76 -62.14 1.32 Allowed 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.295 1.438 . . . . 73.540000000000006 111.041 -175.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.466 HD13 ' HA ' ' A' ' 11' ' ' HIS . 13.4 mt -84.31 -29.5 26.32 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 125.38 1.472 . . . . 51.109999999999999 110.735 -172.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 51.4 t30 -69.55 -21.45 63.63 Favored 'General case' 0 C--O 1.216 -0.689 0 CA-C-O 117.88 -1.057 . . . . 73.540000000000006 111.837 176.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -48.2 -55.24 10.94 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 120.214 1.37 . . . . 74.519999999999996 111.174 -170.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.5 pttm -56.44 -53.3 59.04 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 121.131 -0.981 . . . . 74.129999999999995 111.242 173.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.84 -11.51 27.92 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.306 1.042 . . . . 74.420000000000002 113.684 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -87.84 -14.45 39.47 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 120.545 -1.347 . . . . 75.120000000000005 110.469 176.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -153.81 92.12 1.53 Allowed 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.355 1.062 . . . . 72.400000000000006 110.416 178.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.743 ' HD3' ' HB1' ' A' ' 96' ' ' ALA . 0.0 OUTLIER -118.62 -17.51 9.26 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-O 118.389 -0.815 . . . . 64.310000000000002 111.903 169.16 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.74 -35.79 33.27 Favored 'General case' 0 C--N 1.342 0.257 0 CA-C-N 119.974 1.261 . . . . 75.140000000000001 113.344 -173.495 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -83.53 -22.02 32.54 Favored 'General case' 0 C--O 1.223 -0.309 0 CA-C-O 118.028 -0.987 . . . . 75.540000000000006 113.629 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.561 ' HD3' HD12 ' A' ' 32' ' ' LEU . 0.1 OUTLIER -64.02 -54.76 29.28 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 120.541 1.518 . . . . 73.239999999999995 109.778 166.94 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.561 HD12 ' HD3' ' A' ' 31' ' ' ARG . 3.0 mp -68.73 -24.77 64.51 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.596 0.758 . . . . 73.510000000000005 110.443 -167.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 mt -46.14 -38.51 8.28 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.664 1.185 . . . . 72.5 111.569 167.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -69.54 -40.17 78.46 Favored Glycine 0 C--N 1.34 0.774 0 O-C-N 121.419 -0.8 . . . . 73.129999999999995 112.465 177.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -64.2 -30.02 71.1 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 118.537 1.168 . . . . 74.420000000000002 111.667 -177.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 20.5 t90 -61.51 -77.24 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 108.421 -0.955 . . . . 75.099999999999994 108.421 166.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.72 -30.76 63.84 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.015 1.326 . . . . 71.129999999999995 113.867 -166.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.39 -54.99 24.77 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 123.943 0.897 . . . . 71.409999999999997 109.743 171.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -55.1 -45.45 81.94 Favored Glycine 0 CA--C 1.522 0.476 0 C-N-CA 124.195 0.902 . . . . 52.119999999999997 111.746 -178.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 9.0 mp -54.68 -41.89 70.75 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 125.695 1.598 . . . . 63.299999999999997 110.937 177.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.456 HD23 ' HE3' ' A' ' 79' ' ' LYS . 51.5 mt -87.87 6.03 37.49 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 126.303 1.841 . . . . 75.540000000000006 112.177 -178.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 73.51 15.47 79.14 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-O 119.108 -0.829 . . . . 50.009999999999998 112.83 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 52.2 mttt -89.07 127.3 35.69 Favored 'General case' 0 CA--C 1.519 -0.231 0 N-CA-C 106.443 -1.688 . . . . 72.239999999999995 106.443 174.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.3 p -141.28 169.72 17.08 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.684 -0.858 . . . . 73.420000000000002 108.684 177.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 55.94 -130.2 48.53 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 110.23 -1.148 . . . . 75.530000000000001 110.23 179.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.88 -29.16 66.3 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 112.174 0.435 . . . . 74.319999999999993 112.174 -174.355 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.62 -33.38 75.79 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 121.234 -0.916 . . . . 74.329999999999998 110.031 177.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.36 -40.44 62.13 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.488 0.715 . . . . 75.540000000000006 109.718 177.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.0 ptp180 -67.23 -44.24 79.98 Favored 'General case' 0 C--O 1.227 -0.124 0 N-CA-C 109.765 -0.458 . . . . 63.399999999999999 109.765 -178.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.59 -43.79 84.89 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 125.983 1.713 . . . . 75.510000000000005 110.131 176.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -60.85 -47.95 84.04 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 122.78 0.432 . . . . 64.200000000000003 111.299 173.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.46 -16.14 44.22 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.352 -0.842 . . . . 75.430000000000007 112.932 -176.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 50.1 mt -61.87 -11.37 12.55 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 119.462 1.028 . . . . 75.519999999999996 113.732 178.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 8.9 t -132.52 -3.17 3.37 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 120.351 1.432 . . . . 75.329999999999998 112.831 -172.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 6.0 p -80.05 11.45 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.932 0 O-C-N 120.668 -1.27 . . . . 64.420000000000002 113.107 -171.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 2.1 p -115.8 120.7 65.56 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.173 0 O-C-N 120.666 -1.271 . . . . 74.400000000000006 110.605 -164.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.405 HG23 HG22 ' A' ' 68' ' ' VAL . 5.9 t -161.98 -178.35 6.38 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 130.372 3.469 . . . . 63.140000000000001 105.615 -176.003 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.5 m . . . . . 0 CA--C 1.532 0.278 0 O-C-N 120.244 -1.535 . . . . 72.530000000000001 110.384 170.498 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 t70 . . . . . 0 C--O 1.233 0.192 0 CA-C-O 120.311 0.101 . . . . 62.409999999999997 110.848 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.405 HG22 HG23 ' A' ' 57' ' ' THR . 54.9 t -83.51 -35.82 11.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 109.05 -0.722 . . . . 64.310000000000002 109.05 177.029 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -58.85 -44.62 91.02 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-O 117.958 -1.02 . . . . 74.540000000000006 109.308 169.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.405 ' CZ ' ' HE3' ' A' ' 71' ' ' LYS . 34.2 ttp85 -45.68 -58.47 3.42 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.684 0.794 . . . . 75.519999999999996 111.57 -177.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.405 ' HE3' ' CZ ' ' A' ' 70' ' ' ARG . 1.0 OUTLIER -69.83 -40.1 76.07 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 118.38 -0.819 . . . . 75.239999999999995 111.44 -175.831 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 38.6 mt -64.88 -48.06 75.62 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-N 119.2 0.909 . . . . 61.509999999999998 110.695 -179.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.73 -28.71 67.06 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 124.961 1.304 . . . . 74.5 111.816 -179.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.99 -47.88 67.31 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 118.899 0.772 . . . . 62.210000000000001 110.659 172.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.55 -55.26 18.74 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 107.738 -1.208 . . . . 71.299999999999997 107.738 -178.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 87.0 mt -87.18 34.57 0.69 Allowed 'General case' 0 C--O 1.233 0.222 0 C-N-CA 127.416 2.286 . . . . 74.239999999999995 111.907 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -53.24 115.37 1.86 Allowed 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 107.251 -1.388 . . . . 75.319999999999993 107.251 171.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 87.37 4.24 80.87 Favored Glycine 0 CA--C 1.532 1.102 0 C-N-CA 124.929 1.252 . . . . 35.210000000000001 114.163 176.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.456 ' HE3' HD23 ' A' ' 41' ' ' LEU . 28.9 mtmm -133.64 5.34 3.68 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 125.134 1.374 . . . . 73.519999999999996 112.416 -174.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -144.62 177.73 8.48 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.052 1.341 . . . . 74.230000000000004 108.91 170.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -143.51 164.74 29.5 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 126.754 2.022 . . . . 75.400000000000006 107.319 177.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -58.93 -54.81 42.95 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 124.085 0.954 . . . . 71.540000000000006 110.666 176.264 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -71.96 -11.77 60.93 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 122.978 0.511 . . . . 74.140000000000001 111.943 -178.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 54.3 m -84.09 -52.07 6.58 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 108.498 -0.927 . . . . 41.299999999999997 108.498 174.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 71.8 mt -55.77 -46.65 79.86 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 120.23 1.377 . . . . 74.530000000000001 109.068 178.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.46 -28.92 60.95 Favored 'General case' 0 C--N 1.344 0.347 0 N-CA-C 112.55 0.574 . . . . 63.399999999999999 112.55 -177.527 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.3 -44.47 12.83 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 124.121 0.969 . . . . 73.310000000000002 109.952 176.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 6.3 tptt -66.59 -48.82 68.36 Favored 'General case' 0 CA--C 1.521 -0.149 0 C-N-CA 125.98 1.712 . . . . 72.319999999999993 111.738 -166.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.44 -29.02 69.66 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.13 0.877 . . . . 72.430000000000007 111.183 -178.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 57.1 t -72.92 -31.12 34.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 123.805 0.842 . . . . 54.100000000000001 110.562 174.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.06 -53.75 54.08 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 126.981 2.112 . . . . 72.109999999999999 112.946 -162.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -67.24 22.82 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 127.988 2.515 . . . . 63.509999999999998 113.88 -171.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 6.7 ppt_? -65.3 -25.68 67.73 Favored 'General case' 0 N--CA 1.466 0.368 0 O-C-N 120.139 -1.601 . . . . 74.400000000000006 113.58 -169.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.85 -47.19 9.25 Favored 'General case' 0 C--N 1.332 -0.172 0 O-C-N 121.026 -1.047 . . . . 74.109999999999999 109.044 178.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.8 m -55.14 -29.66 58.22 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.79 1.236 . . . . 65.400000000000006 110.891 175.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.743 ' HB1' ' HD3' ' A' ' 28' ' ' ARG . . . -56.59 -45.54 81.34 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.826 1.25 . . . . 32.219999999999999 112.49 173.169 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 26.1 ttt-85 -63.36 -51.83 64.29 Favored 'General case' 0 CA--C 1.517 -0.292 0 O-C-N 120.828 -1.17 . . . . 73.519999999999996 108.663 175.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.62 -55.41 32.38 Favored 'General case' 0 N--CA 1.444 -0.754 0 O-C-N 125.022 1.451 . . . . 74.319999999999993 110.669 -168.478 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -57.51 -42.28 82.5 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-O 118.732 -0.652 . . . . 74.420000000000002 112.427 -174.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 39.4 mm -64.25 -39.75 86.62 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-N 119.903 1.229 . . . . 53.039999999999999 110.541 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 61.8 mt -71.37 -11.74 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 O-C-N 121.5 -0.75 . . . . 71.400000000000006 109.355 178.173 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.16 4.91 34.57 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.26 1.424 . . . . 74.200000000000003 111.579 176.009 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 80.5 mt-10 -124.52 29.18 6.37 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 125.198 1.399 . . . . 75.430000000000007 108.791 -174.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.6 mm . . . . . 0 C--O 1.251 1.163 0 N-CA-C 105.54 -2.022 . . . . 74.239999999999995 105.54 169.532 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . 0.32 0.1 OUTLIER . . . . . 0 N--CA 1.475 0.784 0 N-CA-C 113.467 0.914 . . . . 73.510000000000005 113.467 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.9 114.1 14.14 Favored 'General case' 0 N--CA 1.444 -0.759 0 O-C-N 119.751 -1.843 . . . . 73.129999999999995 108.061 -171.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 60.81 31.67 20.07 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.896 2.078 . . . . 65.420000000000002 114.862 -174.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -100.11 -25.33 14.32 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 115.429 1.64 . . . . 74.129999999999995 115.429 -177.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -74.99 0.32 16.25 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 114.705 1.372 . . . . 73.530000000000001 114.705 -166.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -113.11 25.47 11.34 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.577 1.081 . . . . 65.510000000000005 110.085 173.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -151.38 174.65 13.09 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 124.925 1.29 . . . . 64.409999999999997 108.656 -179.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 60.85 -160.11 0.31 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.635 1.174 . . . . 74.319999999999993 108.852 171.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -137.11 -35.81 0.68 Allowed 'General case' 0 C--N 1.332 -0.173 0 O-C-N 120.375 -1.453 . . . . 73.109999999999999 111.237 161.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -47.83 -54.44 12.45 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.245 1.018 . . . . 74.430000000000007 112.712 -170.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.4 mt -77.74 -29.91 51.33 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.852 -0.53 . . . . 61.329999999999998 111.739 -172.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -63.52 -49.48 73.34 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 108.974 -0.75 . . . . 74.340000000000003 108.974 174.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -55.7 -39.5 71.12 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.949 0.899 . . . . 70.519999999999996 110.934 -178.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -44.8 -48.36 10.95 Favored 'General case' 0 C--N 1.344 0.336 0 C-N-CA 124.281 1.032 . . . . 61.100000000000001 111.777 173.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.433 ' HB1' ' HA ' ' A' ' 97' ' ' ARG . . . -64.72 -49.15 71.99 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.565 1.146 . . . . 74.129999999999995 111.441 -178.266 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -71.0 -18.09 62.61 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 121.975 -0.453 . . . . 71.510000000000005 110.982 -176.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -113.37 55.06 0.72 Allowed 'General case' 0 C--O 1.237 0.41 0 C-N-CA 125.265 1.426 . . . . 74.200000000000003 109.025 -176.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.4 mmt-85 -121.97 -7.66 8.91 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 126.048 1.739 . . . . 53.009999999999998 112.261 172.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 36.8 mtm-85 -53.38 -53.85 45.24 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 119.599 1.091 . . . . 71.430000000000007 112.192 -168.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -82.34 -15.23 53.6 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.501 -0.75 . . . . 74.430000000000007 112.604 -167.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.83 -14.21 59.65 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 119.033 0.833 . . . . 61.420000000000002 112.808 -169.013 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -127.83 3.65 6.02 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.973 2.109 . . . . 54.399999999999999 112.027 -171.334 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 56.7 tp -56.41 -30.13 62.41 Favored 'General case' 0 N--CA 1.461 0.1 0 C-N-CA 128.607 2.763 . . . . 72.310000000000002 111.807 174.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.403 ' HA3' ' HA ' ' A' ' 52' ' ' ALA . . . -45.8 -46.81 13.81 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 124.791 1.186 . . . . 71.430000000000007 113.016 170.154 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -63.0 -22.49 66.89 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.768 1.227 . . . . 71.230000000000004 111.938 -172.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.438 ' CD2' ' HG2' ' A' ' 88' ' ' LYS . 5.8 t90 -64.07 -72.66 0.14 Allowed 'General case' 0 C--N 1.343 0.307 0 N-CA-C 107.913 -1.143 . . . . 71.239999999999995 107.913 168.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.93 -29.2 62.89 Favored 'General case' 0 C--O 1.221 -0.441 0 C-N-CA 126.314 1.846 . . . . 52.240000000000002 112.193 -171.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -47.36 -49.27 24.86 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.987 0.812 . . . . 23.510000000000002 111.52 -179.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.46 -35.9 91.75 Favored Glycine 0 CA--C 1.534 1.242 0 CA-C-N 118.352 0.523 . . . . 62.219999999999999 112.869 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.413 HD12 ' N ' ' A' ' 40' ' ' LEU . 3.2 mp -64.98 -39.29 93.26 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.649 1.58 . . . . 71.430000000000007 109.339 178.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.9 mp -73.04 -9.68 58.98 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 127.324 2.25 . . . . 50.0 112.977 172.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 71.44 29.7 67.76 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 125.806 1.67 . . . . 75.209999999999994 112.188 -176.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -111.22 139.06 46.91 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 119.551 1.676 . . . . 62.299999999999997 107.228 170.746 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.1 p -135.73 175.87 9.2 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 107.254 -1.387 . . . . 75.319999999999993 107.254 168.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 60.48 -126.74 41.99 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.487 -1.045 . . . . 72.430000000000007 110.487 173.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -78.29 -34.69 48.65 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 123.974 0.91 . . . . 75.409999999999997 110.512 -170.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.79 -35.2 79.82 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.773 0.829 . . . . 55.399999999999999 109.621 173.309 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.32 -42.06 69.08 Favored 'General case' 0 C--N 1.339 0.109 0 O-C-N 121.961 -0.462 . . . . 64.510000000000005 111.15 170.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.0 ttm180 -55.79 -47.43 77.12 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.436 0.694 . . . . 62.329999999999998 111.603 -176.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.76 -50.6 73.19 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.357 0.526 . . . . 73.129999999999995 110.203 -178.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -53.31 -42.78 67.0 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.693 1.197 . . . . 70.430000000000007 111.477 173.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.403 ' HA ' ' HA3' ' A' ' 34' ' ' GLY . . . -60.25 -24.62 65.03 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 124.071 0.948 . . . . 72.319999999999993 113.519 -178.438 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 43.9 mt -84.68 -14.8 47.42 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 118.05 -0.976 . . . . 73.329999999999998 111.977 -171.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 11.7 t -102.77 -28.14 12.27 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 119.989 1.268 . . . . 63.5 112.273 -173.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 1.6 p -72.43 96.57 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.325 0 C-N-CA 127.31 2.244 . . . . 64.120000000000005 109.892 172.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 11.0 p -148.97 152.42 12.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 C-N-CA 125.421 1.488 . . . . 73.510000000000005 108.701 152.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.449 HG23 HG23 ' A' ' 68' ' ' VAL . 0.1 OUTLIER -149.24 -85.91 0.09 Allowed 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 118.219 -0.896 . . . . 73.340000000000003 108.826 155.836 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.9 t . . . . . 0 C--O 1.226 -0.133 0 CA-C-N 120.012 1.278 . . . . 64.530000000000001 108.367 179.733 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 117.886 -1.054 . . . . 64.209999999999994 111.125 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.449 HG23 HG23 ' A' ' 57' ' ' THR . 14.1 p -63.06 -32.46 56.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 121.115 1.779 . . . . 73.540000000000006 110.646 178.666 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -78.1 -18.12 56.08 Favored 'General case' 0 C--O 1.221 -0.408 0 N-CA-C 116.084 1.883 . . . . 65.099999999999994 116.084 176.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 22.1 ttt180 -55.36 -57.37 12.14 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 122.375 2.352 . . . . 70.200000000000003 114.286 -169.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -74.57 3.33 7.9 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 122.989 0.516 . . . . 65.540000000000006 111.559 -174.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 18.1 tp -112.78 -63.94 1.37 Allowed 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 127.872 2.469 . . . . 65.519999999999996 108.465 -174.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -51.29 -40.37 58.81 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 127.02 2.128 . . . . 73.129999999999995 111.418 177.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -76.27 -27.01 56.5 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 112.87 0.692 . . . . 74.400000000000006 112.87 -179.203 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.55 -9.22 59.5 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.693 0.797 . . . . 65.409999999999997 110.492 172.252 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 69.0 mt -116.48 34.99 4.75 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 128.723 2.809 . . . . 73.109999999999999 110.916 177.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -54.55 110.93 0.7 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.157 1.383 . . . . 53.109999999999999 108.618 176.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 86.2 2.64 85.51 Favored Glycine 0 CA--C 1.529 0.956 0 C-N-CA 125.439 1.495 . . . . 41.030000000000001 114.957 -179.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -127.24 1.25 6.41 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 118.871 1.336 . . . . 74.310000000000002 112.193 -165.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -147.64 -172.85 4.13 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.733 1.213 . . . . 63.43 109.498 172.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.519 ' H ' ' HB ' ' A' ' 84' ' ' THR . 33.0 m-20 -146.84 170.38 17.16 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 126.976 2.11 . . . . 73.109999999999999 105.799 165.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -55.13 -47.55 74.89 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.227 1.011 . . . . 61.140000000000001 110.356 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -82.88 -24.21 33.28 Favored 'General case' 0 CA--C 1.534 0.354 0 O-C-N 121.333 -0.854 . . . . 70.510000000000005 111.339 -177.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.519 ' HB ' ' H ' ' A' ' 81' ' ' ASP . 79.5 m -64.29 -39.13 93.3 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 120.737 -1.227 . . . . 70.400000000000006 108.909 172.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 96.8 mt -61.15 -50.33 80.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 O-C-N 121.116 -0.99 . . . . 50.119999999999997 109.345 173.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.53 -32.26 73.83 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 118.966 -1.094 . . . . 61.520000000000003 111.087 -174.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.09 -53.05 60.87 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 109.203 -0.666 . . . . 73.519999999999996 109.203 172.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.438 ' HG2' ' CD2' ' A' ' 36' ' ' TRP . 0.0 OUTLIER -60.66 -44.88 95.94 Favored 'General case' 0 N--CA 1.463 0.178 0 O-C-N 120.956 -1.09 . . . . 74.140000000000001 113.366 -173.101 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 59.7 mtt -59.92 -20.97 60.36 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 118.662 0.665 . . . . 71.430000000000007 111.828 178.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 66.4 t -98.3 -25.51 4.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 125.028 1.331 . . . . 74.439999999999998 110.542 -176.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -60.19 -54.03 50.63 Favored 'General case' 0 N--CA 1.463 0.201 0 O-C-N 120.75 -1.219 . . . . 61.399999999999999 108.56 173.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 4.0 pp -73.97 7.01 2.88 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.45 1.1 . . . . 73.420000000000002 112.85 -178.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 21.5 ttt-85 -56.24 -50.46 71.24 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 120.011 -1.681 . . . . 73.420000000000002 112.692 -176.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.34 -31.91 72.98 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 119.409 1.004 . . . . 73.5 112.388 -178.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 73.7 m -47.42 -36.64 10.15 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.284 1.434 . . . . 64.519999999999996 110.147 178.072 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -53.94 -46.65 71.61 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 124.983 1.313 . . . . 51.200000000000003 113.192 -175.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.433 ' HA ' ' HB1' ' A' ' 25' ' ' ALA . 15.6 ptt-85 -82.72 -34.78 27.15 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 120.541 -0.464 . . . . 63.399999999999999 111.364 178.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -59.29 -41.24 88.5 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.242 1.017 . . . . 65.439999999999998 109.634 -179.023 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 60.8 mm-40 -50.18 -49.92 50.91 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 126.463 1.905 . . . . 74.099999999999994 112.645 174.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 21.6 mm -59.61 -48.31 87.85 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-N 118.925 0.784 . . . . 65.329999999999998 109.047 178.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 97.7 mt -68.38 -5.16 4.01 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 C-N-CA 126.846 2.058 . . . . 63.420000000000002 110.888 -178.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -103.74 -17.86 14.92 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 125.419 1.488 . . . . 73.099999999999994 111.381 175.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -132.55 46.0 2.68 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 125.026 1.331 . . . . 70.400000000000006 109.324 -168.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 24.5 mt . . . . . 0 C--O 1.249 1.027 0 C-N-CA 130.277 3.431 . . . . 73.400000000000006 108.197 -176.455 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.539 0.547 0 N-CA-C 115.719 1.748 . . . . 73.209999999999994 115.719 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -45.0 -42.75 8.56 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 115.921 1.823 . . . . 72.239999999999995 115.921 -162.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -129.12 -1.16 5.17 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.969 1.308 . . . . 62.43 112.096 169.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.1 mtpt -63.57 -19.97 65.26 Favored 'General case' 0 C--O 1.223 -0.295 0 O-C-N 121.016 -1.052 . . . . 51.009999999999998 113.634 -171.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -49.22 -33.24 12.18 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 127.415 2.286 . . . . 73.299999999999997 114.559 -173.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.59 -20.67 63.63 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.154 0.582 . . . . 74.5 112.287 -178.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -113.98 -169.18 1.47 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 129.95 3.3 . . . . 70.540000000000006 105.915 178.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 57.94 -169.99 0.11 Allowed 'General case' 0 C--O 1.239 0.515 0 C-N-CA 124.516 1.126 . . . . 73.319999999999993 110.644 177.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -143.34 -48.06 0.3 Allowed 'General case' 0 C--N 1.333 -0.146 0 O-C-N 120.4 -1.437 . . . . 53.030000000000001 110.71 171.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 64.3 tt0 -60.55 -32.24 71.31 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.079 0.552 . . . . 72.140000000000001 110.937 -171.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 72.3 mt -71.81 -41.2 68.53 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.225 -0.922 . . . . 73.409999999999997 110.491 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -63.57 -42.72 98.29 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.3 1.04 . . . . 72.120000000000005 110.514 173.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -54.53 -41.55 69.83 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.001 0.92 . . . . 75.400000000000006 109.884 174.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.36 -16.66 6.01 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 117.267 -1.349 . . . . 64.219999999999999 114.1 175.452 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -97.01 -32.01 12.22 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 121.145 1.793 . . . . 70.540000000000006 113.642 173.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.0 tp10 -46.1 -43.09 14.5 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.805 1.642 . . . . 65.329999999999998 112.035 -176.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -91.42 26.3 2.31 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.046 1.338 . . . . 61.399999999999999 112.277 -167.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 2.8 mmt180 -112.23 2.73 16.75 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 120.569 -1.332 . . . . 73.430000000000007 111.924 177.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 19.3 mtt-85 -63.53 -23.92 67.59 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.332 1.423 . . . . 73.120000000000005 112.295 -175.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -135.11 -16.17 1.92 Allowed 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 117.067 -1.444 . . . . 63.530000000000001 114.559 173.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.07 6.88 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 128.112 2.565 . . . . 71.400000000000006 114.578 -173.117 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.443 HD13 HD22 ' A' ' 92' ' ' LEU . 0.3 OUTLIER -137.35 -1.7 2.08 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 127.456 2.302 . . . . 65.129999999999995 110.693 -166.956 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 52.3 tp -66.8 -30.75 71.03 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 127.104 2.162 . . . . 70.329999999999998 110.824 170.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -65.69 -43.8 93.62 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.924 -0.87 . . . . 52.130000000000003 110.924 170.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -65.08 -23.85 67.28 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 118.376 1.088 . . . . 71.519999999999996 111.996 -173.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 22.5 t90 -60.15 -69.28 0.22 Allowed 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 124.415 1.086 . . . . 74.230000000000004 108.97 168.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.0 -40.45 80.75 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 122.954 0.502 . . . . 72.409999999999997 111.699 -177.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.26 -54.72 27.7 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.669 1.187 . . . . 61.32 109.908 173.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -64.08 -36.44 93.25 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-N 117.866 0.303 . . . . 25.440000000000001 112.389 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 38.2 mt -62.63 -38.98 92.37 Favored 'General case' 0 C--O 1.233 0.225 0 O-C-N 120.766 -1.432 . . . . 65.439999999999998 110.696 176.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 92.5 mt -88.16 6.87 34.51 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 126.951 2.1 . . . . 63.140000000000001 113.282 -178.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 81.82 12.95 80.63 Favored Glycine 0 CA--C 1.531 1.093 0 CA-C-N 119.839 1.2 . . . . 72.099999999999994 113.996 171.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -90.83 149.47 21.95 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 126.026 1.73 . . . . 53.210000000000001 109.888 172.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.0 p -148.72 175.71 10.98 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 126.863 2.065 . . . . 71.5 110.054 178.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 58.08 -135.51 51.74 Favored Glycine 0 CA--C 1.525 0.667 0 C-N-CA 124.322 0.963 . . . . 71.099999999999994 111.72 172.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -51.62 -46.41 63.62 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.934 1.294 . . . . 73.340000000000003 111.163 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.8 -38.35 87.78 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.325 -0.852 . . . . 72.540000000000006 110.385 -173.647 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.0 -45.09 52.05 Favored 'General case' 0 N--CA 1.455 -0.22 0 O-C-N 121.887 -0.508 . . . . 34.409999999999997 111.075 171.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 52.0 mtm-85 -59.07 -55.23 37.69 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 118.058 -0.972 . . . . 73.430000000000007 112.633 -172.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.18 -34.39 77.92 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 118.331 -0.842 . . . . 52.32 110.196 -172.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -61.82 -45.47 93.69 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-O 121.835 0.826 . . . . 74.430000000000007 109.858 173.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.18 -26.61 68.44 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 120.563 -1.336 . . . . 73.420000000000002 113.277 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 41.3 mt -84.22 -12.82 54.16 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.757 1.223 . . . . 75.319999999999993 111.158 177.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 40.9 p -105.27 3.37 29.91 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 119.609 1.095 . . . . 75.400000000000006 111.699 175.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.2 t -118.1 98.68 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 C-N-CA 126.039 1.736 . . . . 72.239999999999995 108.191 -173.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 1.9 t -129.65 66.66 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 N-CA-C 107.658 -1.238 . . . . 54.439999999999998 107.658 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.278 6.6 t 51.28 -164.67 0.05 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.199 1.8 . . . . 74.430000000000007 111.425 -178.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.239 0.532 0 C-N-CA 129.253 3.021 . . . . 74.230000000000004 103.411 156.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.5 t70 . . . . . 0 N--CA 1.467 0.38 0 CA-C-O 118.94 -0.553 . . . . 61.43 110.362 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 7.1 p -61.74 -45.7 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 CA-C-N 119.091 0.859 . . . . 72.25 110.276 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.91 -23.05 67.11 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 115.037 1.495 . . . . 75.409999999999997 115.037 170.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 75.7 ttt-85 -63.12 -54.29 40.2 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 121.172 1.806 . . . . 70.430000000000007 110.604 -178.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -71.74 9.35 0.9 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.995 0.918 . . . . 63.299999999999997 111.567 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 69.0 mt -132.86 -5.07 3.16 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 124.794 1.238 . . . . 65.219999999999999 114.185 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -100.75 -79.65 0.5 Allowed 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.86 1.264 . . . . 74.310000000000002 108.053 173.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.02 -45.73 91.82 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 118.422 0.556 . . . . 65.200000000000003 110.339 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.77 -29.51 66.85 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.078 0.551 . . . . 74.219999999999999 110.858 -175.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.4 tp -111.7 19.35 18.14 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 127.085 2.154 . . . . 73.219999999999999 111.213 -166.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -44.56 126.82 5.69 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 127.075 2.15 . . . . 65.430000000000007 111.635 -169.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 86.54 -12.21 61.7 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 126.231 1.872 . . . . 74.230000000000004 113.579 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 32.2 mtmm -117.31 10.63 13.76 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.689 1.195 . . . . 71.510000000000005 110.445 -175.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -147.03 175.03 11.0 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 126.39 1.876 . . . . 71.340000000000003 110.02 177.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.505 ' H ' ' HB ' ' A' ' 84' ' ' THR . 2.8 m-20 -150.14 172.38 15.38 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 105.617 -1.994 . . . . 63.539999999999999 105.617 154.254 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -55.67 -52.03 65.25 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 124.672 1.189 . . . . 73.120000000000005 109.38 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -66.42 -29.98 70.25 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.821 0.848 . . . . 71.409999999999997 111.036 -178.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.505 ' HB ' ' H ' ' A' ' 81' ' ' ASP . 99.0 m -70.19 -44.48 68.6 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 118.541 -0.742 . . . . 65.409999999999997 109.193 -179.205 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 69.7 mt -55.15 -46.48 77.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 CA-C-N 119.829 1.195 . . . . 71.409999999999997 109.616 -175.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.98 -47.97 76.7 Favored 'General case' 0 C--N 1.347 0.496 0 CA-C-O 121.595 0.712 . . . . 72.209999999999994 109.568 -179.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -88.01 29.38 0.94 Allowed 'General case' 0 N--CA 1.443 -0.808 0 C-N-CA 125.552 1.541 . . . . 73.310000000000002 111.025 -176.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.31 -48.51 2.88 Favored 'General case' 0 CA--C 1.513 -0.466 0 O-C-N 121.111 -0.993 . . . . 62.539999999999999 109.132 158.349 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 27.0 mtm -57.49 -42.64 83.09 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 117.771 0.26 . . . . 74.340000000000003 111.052 -176.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 27.1 t -79.81 -31.88 13.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 124.347 1.059 . . . . 63.439999999999998 111.957 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -62.18 -24.81 67.41 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.883 1.273 . . . . 71.549999999999997 112.604 -170.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.443 HD22 HD13 ' A' ' 32' ' ' LEU . 20.8 mt -86.84 -1.05 57.48 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 114.941 1.46 . . . . 73.420000000000002 114.941 -165.151 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 73.6 mtp180 -56.45 -50.01 72.94 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 120.306 -1.496 . . . . 71.510000000000005 112.844 -171.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.02 -20.39 59.64 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 120.031 1.287 . . . . 62.43 112.105 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.6 m -56.5 -25.35 51.12 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.064 0.847 . . . . 74.420000000000002 110.373 176.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.13 -51.34 69.71 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 114.556 1.317 . . . . 74.430000000000007 114.556 176.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -74.93 -38.22 61.83 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 108.994 -0.743 . . . . 70.409999999999997 108.994 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.2 -53.68 54.28 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 124.955 1.302 . . . . 72.420000000000002 109.454 -175.739 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -58.29 -44.58 88.55 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-O 118.839 -0.601 . . . . 74.219999999999999 112.529 -174.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 16.9 mm -65.2 -42.02 93.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 119.079 0.854 . . . . 73.200000000000003 109.003 -178.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 98.0 mt -69.74 -15.71 19.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 N-CA-C 109.479 -0.563 . . . . 74.310000000000002 109.479 177.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -85.78 -11.0 54.62 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 126.012 1.725 . . . . 62.310000000000002 111.225 174.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 66.6 mt-10 -129.77 42.03 3.34 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 128.177 2.591 . . . . 61.340000000000003 108.925 -166.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 92.7 mt . . . . . 0 C--O 1.255 1.372 0 N-CA-C 108.697 -0.853 . . . . 71.510000000000005 108.697 -177.145 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . 0.497 ' HB3' HD13 ' A' ' 21' ' ' LEU . 0.7 OUTLIER . . . . . 0 CA--C 1.535 0.391 0 N-CA-C 113.325 0.861 . . . . 62.420000000000002 113.325 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -46.38 -42.46 15.02 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 128.87 2.868 . . . . 73.219999999999999 112.75 -172.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.07 13.82 13.03 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.8 1.24 . . . . 71.109999999999999 111.329 178.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 19.0 mttm -108.25 -13.24 14.94 Favored 'General case' 0 C--O 1.225 -0.199 0 C-N-CA 124.596 1.159 . . . . 54.439999999999998 112.398 176.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -64.35 -27.02 68.73 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 120.494 1.497 . . . . 74.030000000000001 110.86 170.288 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -86.94 26.24 1.18 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.698 1.599 . . . . 63.210000000000001 112.36 173.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -167.54 -167.94 0.96 Allowed 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 119.465 1.03 . . . . 74.030000000000001 109.965 -178.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 57.8 -160.7 0.24 Allowed 'General case' 0 C--O 1.238 0.474 0 C-N-CA 125.765 1.626 . . . . 72.239999999999995 110.499 165.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -140.19 -32.86 0.59 Allowed 'General case' 0 C--O 1.219 -0.532 0 O-C-N 120.985 -1.072 . . . . 72.329999999999998 111.029 160.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -49.31 -41.66 38.99 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 125.274 1.43 . . . . 64.540000000000006 111.985 -168.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.497 HD13 ' HB3' ' A' ' 11' ' ' HIS . 67.9 mt -91.62 -37.28 13.17 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 119.048 -0.501 . . . . 73.349999999999994 110.785 -176.266 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 27.0 t30 -53.33 -45.18 68.97 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 119.106 0.867 . . . . 63.240000000000002 110.539 170.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -60.87 -39.77 90.45 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 125.801 1.641 . . . . 73.140000000000001 110.499 -178.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -45.78 -44.92 14.36 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 121.181 -0.949 . . . . 75.019999999999996 110.964 171.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.581 ' HB1' ' HA ' ' A' ' 97' ' ' ARG . . . -75.31 -62.19 1.65 Allowed 'General case' 0 C--O 1.235 0.312 0 C-N-CA 126.208 1.803 . . . . 74.329999999999998 112.915 177.076 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -61.51 -16.54 48.48 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.741 1.216 . . . . 71.420000000000002 111.713 -173.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -119.49 37.39 4.18 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.331 1.852 . . . . 33.140000000000001 111.366 -177.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.13 6.12 4.2 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 121.289 -0.882 . . . . 60.329999999999998 112.634 168.387 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.2 ptt85 -63.36 -19.05 64.31 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 120.566 -1.334 . . . . 72.400000000000006 113.27 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -78.72 -20.36 50.24 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 119.803 1.183 . . . . 75.120000000000005 112.142 175.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.49 -19.06 63.75 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 120.323 1.419 . . . . 74.349999999999994 112.65 -168.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.19 2.14 9.18 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.709 2.004 . . . . 60.030000000000001 111.684 -168.495 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.5 mt -60.96 -28.8 69.24 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.702 1.201 . . . . 64.430000000000007 111.336 171.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -61.24 -37.2 93.61 Favored Glycine 0 C--O 1.223 -0.533 0 N-CA-C 111.317 -0.713 . . . . 61.229999999999997 111.317 -178.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -62.28 -33.51 74.78 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.419 1.088 . . . . 72.150000000000006 110.227 -170.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 10.2 t90 -62.65 -65.09 0.74 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.689 1.596 . . . . 64.109999999999999 110.044 170.268 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.26 -21.09 66.69 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.412 0.685 . . . . 61.119999999999997 112.481 -171.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -70.77 -55.3 8.9 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 125.024 1.33 . . . . 55.43 109.257 168.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -49.26 -45.07 35.16 Favored Glycine 0 CA--C 1.527 0.842 0 C-N-CA 124.231 0.919 . . . . 54.5 112.042 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 16.1 mt -61.06 -32.74 72.37 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.496 1.118 . . . . 74.329999999999998 113.89 179.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 95.7 mt -85.66 -3.45 58.89 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.365 1.066 . . . . 73.030000000000001 112.446 176.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.11 19.69 56.87 Favored Glycine 0 CA--C 1.526 0.763 0 CA-C-O 118.424 -1.209 . . . . 42.409999999999997 113.374 -175.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 14.3 mmtp -101.53 119.18 38.37 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 125.81 1.644 . . . . 72.430000000000007 108.655 177.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.8 p -152.6 135.56 15.57 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.433 0.693 . . . . 55.340000000000003 110.827 -179.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 87.59 -148.85 21.39 Favored Glycine 0 CA--C 1.533 1.2 0 N-CA-C 110.894 -0.883 . . . . 75.310000000000002 110.894 -164.23 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -63.96 -22.11 66.78 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.937 1.458 . . . . 73.019999999999996 114.937 -161.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.76 -51.29 23.44 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 108.253 -1.018 . . . . 74.230000000000004 108.253 175.31 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -56.51 -40.19 74.6 Favored 'General case' 0 C--N 1.344 0.334 0 O-C-N 121.69 -0.631 . . . . 71.310000000000002 109.886 171.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.02 -25.58 67.74 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.756 1.223 . . . . 75.319999999999993 113.002 179.623 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.05 -51.66 11.83 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 119.533 1.06 . . . . 74.010000000000005 109.663 169.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -60.15 -29.08 68.42 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.266 1.026 . . . . 64.349999999999994 112.822 -177.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.0 -18.97 49.92 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 120.461 -1.399 . . . . 55.420000000000002 112.513 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 22.0 mt -90.74 -15.38 30.33 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.126 0.97 . . . . 71.209999999999994 111.651 -168.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.8 t -95.92 -29.26 14.28 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.64 1.176 . . . . 63.340000000000003 111.411 -178.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 5.3 p -70.8 8.53 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 126.202 1.801 . . . . 43.509999999999998 114.374 -166.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 5.2 m -104.14 49.12 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 O-C-N 119.196 -2.19 . . . . 75.319999999999993 112.004 -163.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.4 t -58.74 -50.48 73.76 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 109.797 -0.446 . . . . 63.0 109.797 172.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.0 t . . . . . 0 CA--C 1.533 0.317 0 C-N-CA 124.539 1.136 . . . . 64.299999999999997 108.784 -167.56 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . 0.268 5.1 t70 . . . . . 0 CA--C 1.518 -0.278 0 CA-C-O 118.974 -0.536 . . . . 71.230000000000004 111.725 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 30.1 t -47.76 -63.57 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 125.448 1.499 . . . . 74.409999999999997 108.476 170.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -79.37 -5.23 54.12 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 115.011 1.486 . . . . 75.140000000000001 115.011 -179.382 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.2 ptt180 -54.07 -19.85 5.55 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 115.486 1.661 . . . . 74.299999999999997 115.486 -172.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -113.21 -10.84 13.33 Favored 'General case' 0 CA--C 1.516 -0.345 0 C-N-CA 124.034 0.934 . . . . 62.229999999999997 112.648 177.339 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 17.9 tp -94.34 -58.43 2.21 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.881 1.273 . . . . 73.120000000000005 108.086 -175.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.32 -49.14 70.38 Favored 'General case' 0 C--O 1.223 -0.291 0 C-N-CA 124.897 1.279 . . . . 43.119999999999997 109.529 170.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.9 -20.58 65.94 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 114.314 1.227 . . . . 53.399999999999999 114.314 -178.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.08 -52.75 8.26 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 106.954 -1.498 . . . . 62.43 106.954 170.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 90.5 mt -80.39 39.67 0.47 Allowed 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 127.264 2.225 . . . . 73.340000000000003 110.785 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 62.0 tt0 -55.67 113.26 1.39 Allowed 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 126.579 1.952 . . . . 75.010000000000005 107.504 173.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 80.19 6.95 88.95 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 124.491 1.043 . . . . 53.140000000000001 114.58 -177.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 27.2 mtmm -130.43 -2.58 4.36 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 118.779 1.29 . . . . 75.040000000000006 113.443 -176.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -151.33 106.68 3.33 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 119.993 1.269 . . . . 74.040000000000006 110.379 175.036 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -64.53 166.48 8.43 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 108.458 -0.942 . . . . 71.239999999999995 108.458 167.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -55.46 -39.47 70.39 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 120.85 -1.156 . . . . 64.409999999999997 110.47 177.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -75.73 -16.73 60.1 Favored 'General case' 0 CA--C 1.53 0.188 0 O-C-N 121.483 -0.761 . . . . 75.230000000000004 111.276 -177.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 96.3 m -68.75 -43.81 75.04 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 118.64 0.655 . . . . 54.119999999999997 109.625 170.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.1 mt -62.29 -57.08 13.7 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-N 119.9 1.227 . . . . 75.299999999999997 108.82 -176.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.96 -44.58 67.22 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 118.274 0.488 . . . . 74.109999999999999 111.528 178.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.28 -52.67 64.64 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 108.922 -0.77 . . . . 73.120000000000005 108.922 -177.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -63.85 -43.76 95.17 Favored 'General case' 0 CA--C 1.518 -0.285 0 C-N-CA 123.748 0.819 . . . . 72.319999999999993 112.869 -174.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 10.0 mtt -58.29 -42.92 87.65 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 118.887 0.767 . . . . 60.219999999999999 110.757 177.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 60.0 t -68.68 -40.24 81.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 124.086 0.954 . . . . 35.210000000000001 110.39 179.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -58.26 -52.5 65.34 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 119.655 1.116 . . . . 72.310000000000002 110.947 -173.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 22.3 mt -67.97 1.68 2.53 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.509 1.924 . . . . 60.210000000000001 112.765 -168.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -67.83 -19.39 65.05 Favored 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 125.307 1.443 . . . . 72.200000000000003 112.112 -176.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -76.81 -56.27 4.75 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 119.994 1.27 . . . . 63.229999999999997 109.293 172.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 55.3 m -51.21 -36.85 43.57 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.21 1.404 . . . . 64.129999999999995 110.566 177.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.33 -50.82 68.64 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.693 0.797 . . . . 60.229999999999997 113.033 175.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.581 ' HA ' ' HB1' ' A' ' 25' ' ' ALA . 12.1 ptm180 -76.87 -35.7 57.28 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 118.522 0.601 . . . . 74.019999999999996 110.645 -179.175 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -61.47 -37.99 85.62 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 124.955 1.302 . . . . 73.329999999999998 111.817 179.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -63.37 -20.76 65.81 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 119.235 0.925 . . . . 73.219999999999999 112.854 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 41.9 mm -79.34 -29.49 13.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 CA-C-N 119.328 0.967 . . . . 73.019999999999996 110.605 174.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 15.9 mm -61.14 -23.78 31.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 N-CA-C 108.641 -0.874 . . . . 75.049999999999997 108.641 167.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -93.76 9.65 36.25 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.523 0.729 . . . . 74.409999999999997 111.779 176.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 88.3 mt-10 -132.29 37.49 3.54 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.582 1.953 . . . . 73.349999999999994 108.886 -179.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 96.9 mt . . . . . 0 C--O 1.254 1.339 0 C-N-CA 125.779 1.631 . . . . 75.310000000000002 109.331 166.456 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.536 0.431 0 N-CA-C 115.444 1.646 . . . . 74.420000000000002 115.444 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.443 ' HG3' ' H ' ' A' ' 13' ' ' ALA . 7.0 pt-20 -44.94 -78.75 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.951 2.101 . . . . 73.099999999999994 113.306 -168.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.443 ' H ' ' HG3' ' A' ' 12' ' ' GLU . . . -81.56 -2.57 50.46 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.627 0.771 . . . . 72.0 112.655 -179.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 31.4 mttm -75.6 -11.04 59.93 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.115 0.966 . . . . 64.129999999999995 112.329 176.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -61.56 -27.04 68.34 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 120.536 1.516 . . . . 75.439999999999998 112.571 -174.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -86.86 16.0 5.3 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.583 1.553 . . . . 62.219999999999999 113.033 174.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 50.9 m-70 -140.69 -65.55 0.45 Allowed 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.077 1.751 . . . . 74.219999999999999 109.966 -173.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -84.24 84.78 7.5 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 126.047 1.739 . . . . 74.409999999999997 107.427 -172.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.87 -26.07 57.94 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 114.811 -1.086 . . . . 75.239999999999995 110.912 175.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.01 -34.19 77.84 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.505 1.122 . . . . 64.129999999999995 111.592 174.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 82.0 mt -77.51 -36.96 52.04 Favored 'General case' 0 C--O 1.232 0.184 0 O-C-N 120.215 -1.553 . . . . 73.299999999999997 109.451 173.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -66.52 -29.74 69.9 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 121.244 -0.91 . . . . 74.400000000000006 111.062 176.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -58.62 -45.9 88.22 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.809 1.244 . . . . 63.109999999999999 110.879 172.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.31 -30.92 13.07 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.773 0.829 . . . . 73.200000000000003 112.247 174.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.18 -24.65 34.86 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 113.73 1.011 . . . . 73.209999999999994 113.73 -174.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -79.84 -16.57 55.19 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 119.352 0.978 . . . . 62.439999999999998 110.972 173.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -74.26 -160.12 0.09 Allowed 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 126.389 1.876 . . . . 71.109999999999999 108.932 166.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.4 mmt180 59.7 -29.65 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 128.973 2.909 . . . . 44.32 115.818 -176.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.1 ptt180 -50.9 -12.86 0.12 Allowed 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 130.89 3.676 . . . . 75.420000000000002 116.114 -174.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 25.4 m120 -113.4 -23.57 9.79 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 119.574 1.079 . . . . 62.509999999999998 112.275 178.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.9 -44.45 91.23 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 120.9 1.682 . . . . 72.030000000000001 110.301 173.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -79.69 -13.39 59.51 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 113.451 0.908 . . . . 71.420000000000002 113.451 -171.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.43 HD11 ' HB2' ' A' ' 89' ' ' MET . 15.7 mt -62.02 -24.99 67.39 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.642 0.777 . . . . 70.430000000000007 111.681 173.45 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -57.55 -39.44 90.88 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.899 -0.88 . . . . 11.34 110.899 176.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -65.36 -35.05 79.81 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.631 1.215 . . . . 72.420000000000002 111.108 -179.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.5 ' CD1' ' HE2' ' A' ' 88' ' ' LYS . 56.4 t90 -66.19 -61.88 1.78 Allowed 'General case' 0 C--N 1.342 0.242 0 C-N-CA 123.738 0.815 . . . . 71.140000000000001 108.969 178.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.08 -39.95 83.71 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 119.123 -0.465 . . . . 74.409999999999997 110.985 -178.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.0 -50.31 73.09 Favored 'General case' 0 C--N 1.339 0.15 0 CA-C-N 118.981 0.81 . . . . 53.219999999999999 110.889 172.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -52.28 -50.4 46.86 Favored Glycine 0 C--N 1.335 0.504 0 C-N-CA 124.977 1.275 . . . . 71.329999999999998 110.96 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 91.4 mt -58.53 -51.34 70.28 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 123.816 0.846 . . . . 73.129999999999995 109.764 175.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 32.1 mt -66.19 -6.11 12.45 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 115.406 1.632 . . . . 65.25 115.406 -176.315 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 80.61 12.48 82.86 Favored Glycine 0 CA--C 1.529 0.929 0 CA-C-N 119.078 0.854 . . . . 54.350000000000001 112.626 -177.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 57.8 mttt -87.86 129.1 35.31 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 118.834 1.317 . . . . 64.519999999999996 108.4 170.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 61.2 p -144.53 160.43 41.14 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.825 0.85 . . . . 70.319999999999993 108.764 167.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.82 -145.33 32.41 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 110.488 -1.045 . . . . 53.140000000000001 110.488 -175.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -57.36 -35.23 69.69 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.741 1.217 . . . . 45.25 110.583 -178.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -54.21 -43.56 70.89 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.309 1.044 . . . . 53.439999999999998 111.24 175.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -77.59 -42.56 34.71 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 121.997 -0.439 . . . . 72.349999999999994 109.924 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.3 ptt180 -63.29 -46.07 88.46 Favored 'General case' 0 C--O 1.225 -0.186 0 N-CA-C 109.511 -0.551 . . . . 74.439999999999998 109.511 -174.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.59 -44.16 96.57 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 126.13 1.772 . . . . 54.229999999999997 110.212 -176.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 17.1 t80 -60.78 -55.5 32.34 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.281 0.632 . . . . 74.430000000000007 109.445 171.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.81 -5.52 2.08 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 125.416 1.486 . . . . 54.32 114.045 -176.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 45.5 mt -65.11 -34.38 78.27 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 120.708 -1.245 . . . . 71.239999999999995 110.369 169.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 13.8 t -133.98 73.45 1.5 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 122.51 1.147 . . . . 53.020000000000003 109.943 -165.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.6 m -136.03 12.98 0.97 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 126.023 1.729 . . . . 54.020000000000003 111.688 -178.143 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 16.0 t -82.78 90.23 2.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 O-C-N 120.626 -1.296 . . . . 44.219999999999999 109.99 -171.493 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 5.3 t -147.51 131.6 17.3 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 126.171 1.788 . . . . 74.319999999999993 106.554 176.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.6 p . . . . . 0 CA--C 1.521 -0.143 0 C-N-CA 124.113 0.965 . . . . 62.119999999999997 108.402 176.895 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.473 0.676 0 CA-C-O 122.328 1.061 . . . . 75.530000000000001 113.602 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 1.6 p -131.31 -57.67 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 C-N-CA 127.83 2.452 . . . . 62.450000000000003 107.655 179.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 46.9 t80 -55.78 -44.02 77.33 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 119.526 1.057 . . . . 62.549999999999997 109.56 172.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.3 ttt180 -62.1 -11.75 15.72 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 114.824 1.416 . . . . 62.539999999999999 114.824 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 55.8 mmtt -105.63 -48.79 3.57 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 120.04 1.291 . . . . 74.519999999999996 109.368 175.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 13.8 mt -70.72 -27.83 64.27 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 118.48 -0.771 . . . . 72.549999999999997 110.956 -172.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.05 -53.25 21.36 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-N 119.434 1.015 . . . . 53.109999999999999 108.529 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.92 -20.96 66.72 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 117.955 -1.021 . . . . 74.109999999999999 113.05 174.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.88 -56.78 6.15 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 103.741 -2.689 . . . . 63.539999999999999 103.741 170.187 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 97.2 mt -77.6 31.56 0.16 Allowed 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 127.135 2.174 . . . . 64.230000000000004 112.141 -174.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -57.06 105.15 0.2 Allowed 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 126.779 2.032 . . . . 64.349999999999994 109.306 174.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 101.84 -1.36 52.04 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 126.153 1.835 . . . . 65.230000000000004 114.788 -177.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 28.9 mtmm -133.24 10.96 4.17 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 126.027 1.731 . . . . 74.329999999999998 113.088 -177.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -151.33 176.04 11.64 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 121.842 0.83 . . . . 44.25 111.683 175.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.431 ' H ' ' HB ' ' A' ' 84' ' ' THR . 7.6 m-20 -140.65 163.68 32.22 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 127.582 2.353 . . . . 71.519999999999996 105.599 172.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -46.05 -61.78 1.61 Allowed 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 126.109 1.763 . . . . 62.310000000000002 110.358 169.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -67.57 -38.11 83.61 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.188 0.595 . . . . 51.409999999999997 111.821 -176.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.431 ' HB ' ' H ' ' A' ' 81' ' ' ASP . 28.5 m -55.57 -46.39 77.2 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.802 0.841 . . . . 64.409999999999997 110.895 174.508 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 7.5 mt -70.28 -56.84 9.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 120.181 1.355 . . . . 72.439999999999998 110.301 173.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.87 -17.65 61.82 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 119.676 1.126 . . . . 75.25 113.153 -170.272 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -88.99 -32.86 17.42 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 119.541 1.064 . . . . 72.519999999999996 112.823 171.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.5 ' HE2' ' CD1' ' A' ' 36' ' ' TRP . 57.7 tptt -63.64 -70.27 0.23 Allowed 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.718 1.207 . . . . 74.530000000000001 112.178 -169.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.43 ' HB2' HD11 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -61.02 -31.64 71.26 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 112.806 0.669 . . . . 75.129999999999995 112.806 -167.553 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 74.2 t -58.74 -38.76 73.95 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 C-N-CA 124.925 1.29 . . . . 71.540000000000006 109.428 176.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -73.4 -21.4 60.5 Favored 'General case' 0 C--O 1.232 0.181 0 O-C-N 121.67 -0.644 . . . . 72.439999999999998 111.336 -172.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 89.0 mt -72.25 8.17 1.44 Allowed 'General case' 0 C--O 1.227 -0.127 0 C-N-CA 123.785 0.834 . . . . 64.430000000000007 111.661 -170.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 38.1 ttp85 -57.88 -44.52 86.75 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 121.224 -0.923 . . . . 54.509999999999998 110.015 174.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.52 -50.24 74.68 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-N 118.466 0.576 . . . . 62.350000000000001 110.851 171.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -58.3 -36.91 74.04 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.609 -0.682 . . . . 61.450000000000003 110.713 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -71.23 -48.82 49.0 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.718 1.207 . . . . 33.119999999999997 111.754 -177.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -63.2 -30.22 71.41 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 117.723 0.238 . . . . 75.219999999999999 110.659 177.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -57.66 -53.56 56.75 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 125.565 1.546 . . . . 71.019999999999996 111.048 170.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -57.2 -16.76 8.87 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 114.037 1.125 . . . . 61.43 114.037 -174.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 50.0 mm -71.23 -61.86 1.52 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 118.927 0.785 . . . . 73.400000000000006 110.168 168.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 84.5 mt -67.71 -19.36 24.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 124.478 1.111 . . . . 72.239999999999995 110.48 -173.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -69.55 -16.38 63.41 Favored 'General case' 0 N--CA 1.429 -1.517 0 C-N-CA 124.247 1.019 . . . . 73.109999999999999 111.839 172.053 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -145.7 67.84 1.21 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-N 119.899 1.227 . . . . 64.239999999999995 109.867 -173.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 15.2 mm . . . . . 0 C--O 1.252 1.185 0 C-N-CA 125.249 1.42 . . . . 74.230000000000004 108.74 173.876 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.543 0.682 0 N-CA-C 115.249 1.574 . . . . 74.420000000000002 115.249 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -62.34 129.58 41.36 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 108.823 -0.806 . . . . 73.150000000000006 108.823 -177.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 57.26 -8.63 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 127.889 2.476 . . . . 70.340000000000003 115.535 -169.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -77.33 -25.13 50.85 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 119.93 1.241 . . . . 72.150000000000006 112.066 174.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.39 -17.6 59.53 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 114.18 1.178 . . . . 74.329999999999998 114.18 -169.614 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -126.28 40.29 3.76 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 125.622 1.569 . . . . 73.340000000000003 108.847 173.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -149.37 -75.54 0.16 Allowed 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 107.79 -1.189 . . . . 72.349999999999994 107.79 179.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.57 117.77 9.23 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 124.804 1.241 . . . . 74.25 108.631 -178.178 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.74 -31.13 72.2 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 124.168 0.987 . . . . 62.520000000000003 111.669 -173.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -60.74 -62.55 1.77 Allowed 'General case' 0 C--O 1.231 0.095 0 C-N-CA 125.717 1.607 . . . . 71.129999999999995 112.163 -177.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 36.0 mt -72.03 -32.81 67.49 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 121.788 -0.57 . . . . 64.230000000000004 109.481 -169.218 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 58.0 t-20 -53.57 -59.93 3.96 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 126.36 1.864 . . . . 74.109999999999999 108.744 169.4 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -56.22 -45.6 79.86 Favored 'General case' 0 CA--C 1.517 -0.298 0 C-N-CA 123.665 0.786 . . . . 73.319999999999993 111.483 179.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.37 -31.4 33.61 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 119.234 0.924 . . . . 74.340000000000003 112.268 -177.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -91.58 -53.97 4.09 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 125.274 1.43 . . . . 72.239999999999995 111.868 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -58.29 -25.12 61.46 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.73 -0.606 . . . . 74.310000000000002 110.962 179.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -106.88 7.54 30.16 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 125.094 1.358 . . . . 52.020000000000003 112.401 -177.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.47 -14.98 3.46 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 120.744 -1.223 . . . . 74.099999999999994 113.124 174.597 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 49.5 mtm180 -62.42 16.56 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 131.344 3.858 . . . . 74.340000000000003 116.113 -166.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.592 HD21 ' N ' ' A' ' 58' ' ' SER . 1.0 OUTLIER -124.61 -70.05 0.77 Allowed 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 119.719 1.145 . . . . 70.409999999999997 108.819 165.336 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.451 ' HD2' ' H ' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -60.34 -19.83 56.98 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.467 1.284 . . . . 73.319999999999993 114.467 -165.828 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.18 -19.93 66.21 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 113.039 0.755 . . . . 74.120000000000005 113.039 174.291 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 20.9 tp -72.49 -27.53 62.33 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 126.436 1.894 . . . . 73.400000000000006 110.905 171.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.25 -53.66 38.12 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 108.469 -1.852 . . . . 42.219999999999999 108.469 164.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -63.59 -7.13 6.39 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.231 1.412 . . . . 71.239999999999995 113.791 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 22.6 t90 -86.02 -79.4 0.25 Allowed 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 107.37 -1.344 . . . . 72.329999999999998 107.37 165.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.37 -21.86 62.62 Favored 'General case' 0 C--O 1.225 -0.193 0 C-N-CA 124.804 1.242 . . . . 74.420000000000002 114.099 -167.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -54.09 -53.49 52.51 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.861 1.209 . . . . 74.5 109.866 176.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -54.74 -48.78 64.44 Favored Glycine 0 CA--C 1.524 0.644 0 C-N-CA 124.254 0.931 . . . . 63.340000000000003 111.771 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.0 mp -52.9 -39.56 62.85 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.523 1.529 . . . . 71.209999999999994 111.78 175.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 67.8 mt -86.8 1.44 52.3 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.704 1.602 . . . . 75.129999999999995 112.881 -177.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.79 29.64 25.81 Favored Glycine 0 CA--C 1.526 0.771 0 C-N-CA 124.391 0.996 . . . . 53.130000000000003 112.864 177.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.9 mttt -128.76 122.0 29.62 Favored 'General case' 0 CA--C 1.523 -0.092 0 C-N-CA 125.642 1.577 . . . . 64.340000000000003 108.566 -168.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.4 p -138.26 179.59 6.36 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 124.077 0.951 . . . . 64.540000000000006 109.387 175.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 52.46 -131.0 38.77 Favored Glycine 0 CA--C 1.523 0.579 0 C-N-CA 124.613 1.102 . . . . 42.009999999999998 111.414 178.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -61.8 -28.77 69.69 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 113.258 0.836 . . . . 61.530000000000001 113.258 -176.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -68.63 -47.56 66.31 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 122.61 1.195 . . . . 60.539999999999999 110.424 179.254 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.72 -36.54 81.25 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 114.721 -1.127 . . . . 61.140000000000001 111.079 172.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.5 ttm-85 -53.34 -52.28 59.72 Favored 'General case' 0 N--CA 1.444 -0.755 0 C-N-CA 123.712 0.805 . . . . 73.140000000000001 111.43 175.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.74 -45.04 94.55 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.413 0.551 . . . . 50.210000000000001 111.042 -177.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -54.23 -45.89 72.4 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.054 0.941 . . . . 74.310000000000002 110.051 175.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.97 -13.09 30.6 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 114.106 1.15 . . . . 52.200000000000003 114.106 179.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 18.3 mt -94.14 -14.58 25.52 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 120.905 -1.122 . . . . 73.5 110.773 179.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 12.5 t -110.24 29.06 8.02 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.067 1.747 . . . . 73.510000000000005 109.721 172.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 58.5 t -134.07 75.76 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 N-CA-C 107.337 -1.357 . . . . 44.030000000000001 107.337 170.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.481 HG12 ' H ' ' A' ' 57' ' ' THR . 1.6 t -137.36 168.19 21.63 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 C-N-CA 125.047 1.339 . . . . 73.400000000000006 107.744 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.481 ' H ' HG12 ' A' ' 56' ' ' VAL . 1.0 OUTLIER 67.2 -36.13 0.27 Allowed 'General case' 0 CA--C 1.553 1.078 1 C-N-CA 135.327 5.451 . . . . 61.530000000000001 116.186 -175.767 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.592 ' N ' HD21 ' A' ' 30' ' ' ASN . 95.0 p . . . . . 0 C--N 1.345 0.383 0 C-N-CA 129.038 2.935 . . . . 73.129999999999995 111.985 -168.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.464 0.231 0 N-CA-C 109.904 -0.406 . . . . 72.530000000000001 109.904 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.3 p -67.0 -44.1 88.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 118.393 0.542 . . . . 70.5 110.648 -177.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -61.72 -33.34 73.87 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 121.493 -0.754 . . . . 74.329999999999998 111.231 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 17.5 tpp180 -51.82 -50.76 60.2 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 124.804 1.242 . . . . 72.400000000000006 111.341 -171.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.91 -26.8 22.53 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 119.455 -0.307 . . . . 70.340000000000003 111.073 -177.751 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -52.44 -61.41 2.29 Favored 'General case' 0 CA--C 1.52 -0.197 0 C-N-CA 123.974 0.91 . . . . 70.310000000000002 108.839 177.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.72 -36.45 80.97 Favored 'General case' 0 N--CA 1.456 -0.165 0 O-C-N 123.889 0.743 . . . . 54.340000000000003 111.931 -171.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.39 -45.13 85.24 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.03 0.443 . . . . 71.400000000000006 110.534 178.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -65.81 -48.13 72.73 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 122.131 0.967 . . . . 71.219999999999999 109.65 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 11.8 tp -87.2 10.34 17.24 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 127.35 2.26 . . . . 72.230000000000004 113.26 -169.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -47.54 111.13 0.38 Allowed 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 127.313 2.245 . . . . 60.009999999999998 110.446 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 106.1 -2.26 38.0 Favored Glycine 0 CA--C 1.524 0.629 0 C-N-CA 125.768 1.652 . . . . 74.400000000000006 113.599 177.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.35 -0.13 5.68 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 119.722 1.761 . . . . 61.439999999999998 112.475 -179.329 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -147.89 176.35 10.22 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 125.065 1.346 . . . . 54.399999999999999 108.88 176.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -141.57 170.8 15.05 Favored 'General case' 0 CA--C 1.511 -0.521 0 C-N-CA 125.464 1.506 . . . . 65.299999999999997 107.88 174.584 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -65.47 -52.76 50.71 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 125.59 1.556 . . . . 70.030000000000001 108.63 -177.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -67.38 -29.95 69.61 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.463 0.705 . . . . 74.540000000000006 110.34 178.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 5.0 m -65.46 -57.8 7.39 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.419 0.688 . . . . 73.209999999999994 110.271 173.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 21.1 mt -60.29 -53.05 54.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 CA-C-N 120.511 1.505 . . . . 72.519999999999996 109.269 -171.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -55.1 -37.58 67.02 Favored 'General case' 0 C--N 1.342 0.265 0 O-C-N 123.999 0.812 . . . . 71.219999999999999 110.858 -178.626 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -71.19 -47.91 54.75 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-O 118.375 -0.821 . . . . 61.299999999999997 109.285 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -50.51 -60.97 2.48 Favored 'General case' 0 CA--C 1.516 -0.345 0 C-N-CA 125.051 1.34 . . . . 73.219999999999999 109.295 -177.517 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . 0.282 0.0 OUTLIER -59.16 -38.35 79.53 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 120.271 -0.572 . . . . 61.329999999999998 111.928 -165.747 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 32.0 t -70.29 -53.16 24.32 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 125.249 1.42 . . . . 64.140000000000001 110.558 174.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -63.69 -26.15 68.53 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 120.178 -1.576 . . . . 65.239999999999995 111.769 -168.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 44.9 mt -64.6 8.95 0.09 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.856 1.662 . . . . 71.5 113.753 177.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -45.0 -64.11 0.78 Allowed 'General case' 0 C--N 1.34 0.195 0 C-N-CA 127.588 2.355 . . . . 73.209999999999994 113.13 -177.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.25 -20.2 28.81 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 118.966 0.803 . . . . 62.439999999999998 111.41 178.245 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.2 m -57.56 -30.04 64.91 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 120.858 -1.151 . . . . 74.519999999999996 110.242 174.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -54.18 -36.39 63.35 Favored 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 124.929 1.292 . . . . 52.240000000000002 114.253 170.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 18.5 ptt180 -90.78 -24.41 20.34 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 117.606 -1.188 . . . . 70.400000000000006 111.671 179.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -56.4 -59.28 5.2 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 119.044 0.838 . . . . 65.420000000000002 109.108 169.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -58.07 -20.63 40.94 Favored 'General case' 0 C--O 1.223 -0.315 0 N-CA-C 114.636 1.347 . . . . 74.5 114.636 -168.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 8.4 mm -89.19 -35.36 7.58 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 O-C-N 120.696 -1.253 . . . . 64.530000000000001 110.016 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 97.0 mt -66.96 -30.32 49.22 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 N-CA-C 108.579 -0.897 . . . . 73.109999999999999 108.579 168.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 2.2 t -71.69 -43.0 66.75 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.067 1.347 . . . . 74.319999999999993 109.413 178.175 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -129.49 70.2 1.42 Allowed 'General case' 0 C--O 1.234 0.288 0 C-N-CA 125.778 1.631 . . . . 73.340000000000003 107.508 -169.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 76.7 mt . . . . . 0 C--O 1.248 0.975 0 C-N-CA 126.533 1.933 . . . . 54.43 110.76 -176.007 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.464 0.259 0 N-CA-C 115.432 1.641 . . . . 64.409999999999997 115.432 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -53.78 121.37 7.75 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.647 1.112 . . . . 75.319999999999993 109.12 174.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 48.51 -0.23 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 129.577 3.151 . . . . 63.399999999999999 117.248 -176.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.3 mmtt -76.59 -6.77 53.36 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 125.58 1.552 . . . . 73.409999999999997 112.808 -173.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -58.85 -36.0 73.87 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 119.449 1.022 . . . . 72.319999999999993 111.809 177.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.79 16.75 0.08 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.59 1.956 . . . . 64.430000000000007 113.399 178.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 44.8 t-80 -152.15 -73.49 0.14 Allowed 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 123.508 0.723 . . . . 75.510000000000005 109.94 -163.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -83.73 145.39 28.76 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 123.811 0.844 . . . . 72.530000000000001 108.841 -170.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.41 -50.57 9.29 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-O 117.945 -1.026 . . . . 75.329999999999998 109.771 175.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -44.94 -42.85 8.51 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 126.489 1.915 . . . . 75.329999999999998 113.392 -178.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 82.8 mt -76.38 -28.9 56.93 Favored 'General case' 0 C--N 1.33 -0.274 0 O-C-N 120.908 -1.12 . . . . 64.420000000000002 111.004 -174.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -80.03 -28.81 39.28 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.716 2.006 . . . . 73.439999999999998 111.212 171.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -56.63 -48.67 77.01 Favored 'General case' 0 C--O 1.226 -0.142 0 C-N-CA 126.929 2.092 . . . . 74.439999999999998 109.696 -171.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.45 -41.71 63.53 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 118.526 -0.75 . . . . 60.509999999999998 112.537 175.481 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.15 -54.27 43.56 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 124.515 1.126 . . . . 44.439999999999998 111.153 178.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -66.19 -11.26 48.51 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 112.647 0.61 . . . . 72.340000000000003 112.647 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -121.3 32.59 5.86 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.42 1.488 . . . . 60.329999999999998 111.335 -177.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -120.01 17.5 12.5 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.057 1.343 . . . . 72.140000000000001 112.86 178.304 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 71.7 mtm-85 -71.23 -48.82 48.94 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 120.296 -1.503 . . . . 74.109999999999999 111.825 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 30.3 m120 -62.19 -27.63 69.11 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 114.642 1.349 . . . . 74.120000000000005 114.642 -163.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.485 ' HD3' HD13 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -56.11 -34.61 66.2 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 119.322 0.964 . . . . 71.420000000000002 113.29 172.672 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.485 HD13 ' HD3' ' A' ' 31' ' ' ARG . 1.1 mm? -75.14 -33.23 61.51 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 123.613 0.765 . . . . 55.020000000000003 108.995 -177.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.426 HD21 ' HA ' ' A' ' 89' ' ' MET . 3.9 mm? -62.64 -33.44 75.02 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 108.625 -0.879 . . . . 54.409999999999997 108.625 169.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -67.81 -14.36 65.23 Favored Glycine 0 CA--C 1.538 1.524 0 CA-C-O 117.709 -1.606 . . . . 63.119999999999997 113.685 170.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -91.52 -18.69 23.73 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 121.291 2.545 . . . . 74.450000000000003 111.255 169.026 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 10.6 t90 -76.62 -79.23 0.11 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.148 1.379 . . . . 64.349999999999994 110.518 -176.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -50.69 -29.84 12.24 Favored 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 127.472 2.309 . . . . 73.209999999999994 112.722 -171.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -44.57 -52.87 7.65 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 126.64 1.976 . . . . 74.150000000000006 110.616 173.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -53.45 -48.73 59.47 Favored Glycine 0 C--N 1.337 0.625 0 N-CA-C 110.479 -1.048 . . . . 71.230000000000004 110.479 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.41 ' H ' ' CD1' ' A' ' 40' ' ' LEU . 2.2 mp -61.79 -46.48 89.36 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 126.728 2.011 . . . . 73.129999999999995 108.621 -177.37 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.0 mp -62.97 -18.28 63.04 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.083 1.353 . . . . 63.32 112.899 175.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 106.08 -1.91 38.07 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 127.065 2.269 . . . . 52.109999999999999 112.8 177.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 44.4 mttm -75.1 143.53 43.32 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 118.466 1.133 . . . . 71.319999999999993 108.65 178.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.1 p -142.16 178.53 7.48 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 124.043 0.937 . . . . 73.319999999999993 109.326 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 55.08 -119.89 15.23 Favored Glycine 0 N--CA 1.442 -0.922 0 C-N-CA 124.63 1.109 . . . . 64.319999999999993 110.544 168.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -82.86 -22.52 34.03 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 123.568 0.747 . . . . 64.340000000000003 112.768 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -72.43 -41.51 66.11 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.003 -1.06 . . . . 60.210000000000001 110.372 -176.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.8 -46.71 88.36 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.647 -0.872 . . . . 73.329999999999998 108.647 168.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -59.17 -33.63 71.15 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 118.419 -0.801 . . . . 74.25 112.895 179.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.56 -51.23 29.9 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 124.704 1.202 . . . . 72.150000000000006 109.849 175.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -56.77 -30.28 63.47 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.5 1.12 . . . . 75.239999999999995 111.857 176.432 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.45 1.09 2.48 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 120.468 -1.395 . . . . 75.239999999999995 114.32 175.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.0 mt -108.81 1.49 20.99 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 125.263 1.425 . . . . 64.109999999999999 110.147 179.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 77.4 p -129.9 18.79 5.58 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.165 0.893 . . . . 72.530000000000001 112.163 -168.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 5.4 t -132.97 102.68 5.23 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 C-N-CA 125.06 1.344 . . . . 63.240000000000002 109.08 177.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 4.2 p -146.78 128.15 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 O-C-N 120.884 -1.135 . . . . 71.319999999999993 110.058 175.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 5.5 t -170.55 87.13 0.12 Allowed 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 106.663 -1.606 . . . . 62.32 106.663 178.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.1 t . . . . . 0 CA--C 1.54 0.573 0 C-N-CA 126.76 2.024 . . . . 72.299999999999997 108.173 -172.994 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.473 0.696 0 N-CA-C 111.459 0.17 . . . . 74.310000000000002 111.459 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 48.2 t -84.38 -48.88 16.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 C-N-CA 124.17 0.988 . . . . 62.229999999999997 109.939 -177.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.43 -22.11 60.98 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 118.868 0.758 . . . . 74.099999999999994 112.889 -179.001 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.0 ttt180 -44.6 -43.14 7.94 Favored 'General case' 0 CA--C 1.516 -0.352 0 C-N-CA 128.429 2.692 . . . . 73.420000000000002 112.021 172.114 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -74.0 -15.79 61.09 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 118.403 -0.808 . . . . 74.219999999999999 111.98 -171.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 70.0 mt -96.32 -53.93 3.45 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.55 -0.907 . . . . 64.439999999999998 108.55 167.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -52.62 -40.47 62.78 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.753 1.621 . . . . 53.049999999999997 113.109 -169.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.35 -48.18 62.11 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.847 0.459 . . . . 74.140000000000001 111.159 177.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -67.24 -28.77 68.33 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 120.852 -1.155 . . . . 55.420000000000002 111.262 -176.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 14.2 tp -103.78 13.43 33.02 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 128.063 2.545 . . . . 54.420000000000002 111.824 -172.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -59.34 111.84 1.52 Allowed 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 126.268 1.827 . . . . 64.549999999999997 109.462 -177.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 105.49 -3.61 39.9 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 126.084 1.802 . . . . 71.239999999999995 113.077 -174.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 14.3 mtmm -134.16 -0.4 3.03 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 118.959 1.38 . . . . 72.030000000000001 112.474 -177.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -144.93 172.15 13.44 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 119.028 0.831 . . . . 75.239999999999995 110.506 168.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -132.83 161.45 34.12 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 125.845 1.658 . . . . 63.219999999999999 107.478 -178.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -64.73 -49.74 69.67 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.117 -0.947 . . . . 75.239999999999995 110.066 -164.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -71.64 -34.94 70.21 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 122.695 0.398 . . . . 75.519999999999996 110.042 177.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 52.3 m -57.24 -45.71 83.69 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.004 0.922 . . . . 61.140000000000001 111.062 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 79.8 mt -58.5 -48.58 85.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 CA-C-N 119.589 1.086 . . . . 60.340000000000003 110.404 179.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.64 -44.75 93.39 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 118.943 0.792 . . . . 71.129999999999995 110.667 -175.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.7 -38.08 89.76 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.198 0.599 . . . . 75.239999999999995 111.567 179.046 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.36 -47.04 76.36 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.319 0.648 . . . . 75.019999999999996 110.744 -177.078 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . 0.426 ' HA ' HD21 ' A' ' 33' ' ' LEU . 10.5 mtt -61.84 -30.59 70.94 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 120.992 0.425 . . . . 62.119999999999997 111.853 -178.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 92.1 t -86.6 -25.44 6.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 124.915 1.286 . . . . 52.210000000000001 110.207 -171.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 90.2 mt-10 -56.99 -45.02 83.26 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.459 1.104 . . . . 55.509999999999998 110.459 175.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 4.2 pp -101.28 18.69 19.32 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 127.592 2.357 . . . . 74.040000000000006 112.688 -174.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.71 -31.08 72.14 Favored 'General case' 0 N--CA 1.469 0.493 0 O-C-N 119.92 -1.738 . . . . 75.400000000000006 113.945 -173.757 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -78.09 -37.2 46.99 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 119.665 1.12 . . . . 53.530000000000001 111.313 173.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 6.1 m -45.38 -47.56 13.51 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.435 1.894 . . . . 74.439999999999998 110.902 -172.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -64.75 -40.47 95.36 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 113.945 1.091 . . . . 63.530000000000001 113.945 -177.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 11.6 ptt180 -73.87 -33.13 63.93 Favored 'General case' 0 C--N 1.342 0.247 0 CA-C-O 117.436 -1.268 . . . . 62.520000000000003 110.59 -175.489 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -49.47 -55.69 12.36 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 118.314 -0.85 . . . . 55.399999999999999 109.034 171.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -53.12 -39.84 63.74 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-O 118.475 -0.774 . . . . 63.299999999999997 112.987 -173.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 8.5 mm -63.23 -46.41 95.85 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 120.04 1.291 . . . . 75.120000000000005 109.961 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 56.0 mt -67.03 -24.52 32.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 124.821 1.248 . . . . 73.109999999999999 109.095 179.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.13 -12.57 59.65 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.527 1.931 . . . . 74.329999999999998 111.53 176.23 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -121.36 24.07 10.12 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 125.587 1.555 . . . . 73.25 109.873 -163.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 33.0 mm . . . . . 0 C--O 1.255 1.346 0 N-CA-C 107.371 -1.344 . . . . 41.240000000000002 107.371 176.443 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 . . . . . 0 CA--C 1.547 0.845 0 N-CA-C 116.607 2.077 . . . . 71.439999999999998 116.607 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -77.37 117.53 18.95 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 119.481 -2.012 . . . . 72.140000000000001 109.369 -171.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.29 -15.94 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 128.335 2.654 . . . . 71.310000000000002 116.069 -164.123 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 30.4 mttm -74.27 2.91 8.12 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.873 2.069 . . . . 74.120000000000005 115.802 -173.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.601 ' CZ ' ' HB2' ' A' ' 25' ' ' ALA . 0.1 OUTLIER -80.71 1.56 29.68 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 119.513 -1.992 . . . . 71.010000000000005 112.307 175.388 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -120.86 -154.75 0.6 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.922 2.089 . . . . 64.230000000000004 105.568 159.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 65.92 -54.61 0.37 Allowed 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 129.167 2.987 . . . . 73.099999999999994 115.711 168.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -96.0 -175.44 3.4 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 127.747 2.419 . . . . 75.200000000000003 107.604 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -113.72 -39.98 3.9 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 117.747 -1.12 . . . . 73.420000000000002 110.515 166.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 77.8 mt-10 -45.55 -54.02 8.17 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.066 1.346 . . . . 61.210000000000001 112.521 -175.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -72.34 -33.93 67.67 Favored 'General case' 0 N--CA 1.436 -1.137 0 O-C-N 121.01 -1.056 . . . . 63.229999999999997 111.931 -177.262 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -72.34 -30.01 64.35 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 123.37 0.668 . . . . 63.399999999999999 110.697 177.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.22 -45.84 90.04 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.674 1.189 . . . . 75.140000000000001 109.644 177.38 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 13.3 mttp -53.06 -39.63 63.4 Favored 'General case' 0 N--CA 1.463 0.182 0 O-C-N 121.599 -0.688 . . . . 72.439999999999998 110.927 172.231 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.601 ' HB2' ' CZ ' ' A' ' 15' ' ' PHE . . . -78.98 -28.64 43.53 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 114.098 1.147 . . . . 60.130000000000003 114.098 179.322 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -67.6 -40.61 84.75 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 108.436 -0.95 . . . . 74.0 108.436 178.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -109.06 54.99 0.64 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 122.004 0.907 . . . . 64.439999999999998 110.221 -156.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.5 ppt_? -151.71 -15.45 0.19 Allowed 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 114.215 1.191 . . . . 62.219999999999999 114.215 -177.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.13 -22.25 16.07 Favored 'General case' 0 C--O 1.231 0.088 0 O-C-N 120.69 -1.256 . . . . 73.200000000000003 114.031 -178.169 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -105.12 -25.32 12.55 Favored 'General case' 0 CA--C 1.518 -0.25 0 N-CA-C 113.99 1.107 . . . . 73.319999999999993 113.99 176.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.92 -22.4 64.33 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 118.919 0.782 . . . . 75.140000000000001 112.317 -169.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.4 -11.87 47.93 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 124.589 1.155 . . . . 64.109999999999999 113.678 -178.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 16.9 tp -72.88 -21.75 60.88 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.814 1.246 . . . . 75.0 112.243 -175.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -66.19 -37.59 93.1 Favored Glycine 0 CA--C 1.521 0.434 0 N-CA-C 110.898 -0.881 . . . . 75.129999999999995 110.898 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -54.73 -34.97 63.19 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 126.377 1.871 . . . . 73.340000000000003 111.568 178.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 28.3 t90 -70.26 -81.53 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.673 -0.862 . . . . 73.239999999999995 108.673 174.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -57.92 -24.7 58.99 Favored 'General case' 0 C--N 1.34 0.178 0 N-CA-C 114.311 1.226 . . . . 75.209999999999994 114.311 -167.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.01 -56.41 14.46 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 119.725 1.148 . . . . 73.299999999999997 109.954 176.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -53.45 -49.05 58.59 Favored Glycine 0 CA--C 1.527 0.79 0 CA-C-O 119.282 -0.732 . . . . 71.329999999999998 111.889 177.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 8.4 mp -52.41 -45.88 66.09 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.609 1.163 . . . . 74.329999999999998 110.892 179.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 84.8 mt -79.02 0.28 28.35 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 127.0 2.12 . . . . 74.310000000000002 112.862 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 71.41 3.07 52.33 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 124.691 1.138 . . . . 62.229999999999997 113.113 -175.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -63.48 127.72 32.6 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 106.178 -1.786 . . . . 74.140000000000001 106.178 175.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 37.7 p -136.37 171.79 13.97 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 107.98 -1.119 . . . . 52.229999999999997 107.98 175.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 51.14 -125.69 25.2 Favored Glycine 0 CA--C 1.524 0.634 0 C-N-CA 124.024 0.821 . . . . 31.350000000000001 112.632 172.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -61.89 -37.27 83.94 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.804 1.242 . . . . 73.219999999999999 111.704 -176.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.49 -43.03 73.97 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.686 0.795 . . . . 72.019999999999996 110.944 -177.399 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.77 -41.84 87.07 Favored 'General case' 0 C--O 1.227 -0.102 0 C-N-CA 123.577 0.751 . . . . 73.129999999999995 109.799 173.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 23.0 mtm180 -54.45 -57.3 11.84 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 118.87 -0.586 . . . . 75.319999999999993 109.531 176.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.58 -33.47 75.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 119.081 0.855 . . . . 74.310000000000002 111.49 -170.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 61.4 t80 -60.29 -55.24 36.11 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.284 1.034 . . . . 64.329999999999998 109.269 169.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.75 -36.7 81.77 Favored 'General case' 0 N--CA 1.462 0.128 0 C-N-CA 125.597 1.559 . . . . 42.530000000000001 113.604 -175.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.2 mt -59.69 -23.28 62.99 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 124.981 1.312 . . . . 73.040000000000006 111.149 -174.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.45 -82.22 0.62 Allowed 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 126.083 1.753 . . . . 74.340000000000003 107.585 178.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . 0.353 8.9 p 44.38 25.77 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 C-N-CA 128.315 2.646 . . . . 63.020000000000003 114.023 -171.308 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 3.6 m -100.79 125.68 54.62 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.855 0 O-C-N 119.042 -2.286 . . . . 64.239999999999995 110.688 178.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.8 t -153.57 -171.68 3.98 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 128.289 2.636 . . . . 55.240000000000002 105.379 170.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.8 m . . . . . 0 CA--C 1.536 0.419 0 C-N-CA 124.686 1.194 . . . . 73.140000000000001 108.724 -165.871 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.7 t0 . . . . . 0 CA--C 1.541 0.602 0 N-CA-C 111.633 0.234 . . . . 73.319999999999993 111.633 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 87.2 t -56.9 -49.02 80.41 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 O-C-N 119.901 -1.75 . . . . 60.229999999999997 110.579 169.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -65.88 -38.73 89.55 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 118.701 -0.666 . . . . 64.099999999999994 110.285 176.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.5 tpt180 -52.41 -56.51 14.55 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 118.349 0.522 . . . . 61.340000000000003 110.026 177.248 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? -63.28 -50.58 69.57 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 124.101 0.96 . . . . 64.209999999999994 109.459 -178.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 9.1 mt -56.15 -50.59 70.71 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-O 118.342 -0.837 . . . . 72.299999999999997 110.329 -176.303 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.07 -39.12 92.77 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 119.623 1.101 . . . . 75.040000000000006 112.419 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.36 -25.6 66.06 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 118.756 0.707 . . . . 71.010000000000005 111.498 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.05 -38.03 16.91 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 124.004 0.921 . . . . 71.230000000000004 111.035 174.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 94.3 mt -86.03 37.93 0.74 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.158 1.783 . . . . 71.420000000000002 109.84 175.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -61.65 102.33 0.25 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.472 1.909 . . . . 71.140000000000001 108.386 176.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 89.97 9.85 65.34 Favored Glycine 0 CA--C 1.523 0.569 0 C-N-CA 124.665 1.126 . . . . 72.230000000000004 112.876 -177.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -129.11 -10.95 4.74 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 119.475 1.637 . . . . 73.0 113.019 -173.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -149.27 171.37 16.61 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 119.207 0.912 . . . . 63.310000000000002 111.286 172.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -120.87 165.34 15.33 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 125.01 1.324 . . . . 62.210000000000001 109.973 -171.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -57.03 -26.69 60.73 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 126.842 2.057 . . . . 55.299999999999997 113.576 179.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -109.46 -22.47 12.0 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.885 0.874 . . . . 72.230000000000004 113.056 174.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.8 m -65.6 -37.88 87.87 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 120.562 -1.337 . . . . 43.240000000000002 113.132 -175.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 10.4 mt -69.69 -56.45 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 N-CA-C 107.627 -1.249 . . . . 64.430000000000007 107.627 179.326 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.51 -36.43 66.68 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 123.172 0.589 . . . . 73.319999999999993 110.979 -174.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.24 -38.89 78.7 Favored 'General case' 0 N--CA 1.443 -0.807 0 O-C-N 123.658 0.599 . . . . 73.310000000000002 110.858 179.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 6.3 tppt? -64.0 -49.66 71.56 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 119.448 1.022 . . . . 62.409999999999997 109.08 -161.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -43.88 97.16 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 113.119 0.785 . . . . 73.030000000000001 113.119 -177.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 58.6 t -65.04 -37.02 79.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 C-N-CA 123.985 0.914 . . . . 72.430000000000007 110.772 177.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -66.37 -26.49 67.29 Favored 'General case' 0 C--O 1.237 0.436 0 O-C-N 120.584 -1.322 . . . . 75.230000000000004 112.053 -175.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 45.3 mt -87.48 9.65 20.2 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.081 0.952 . . . . 75.209999999999994 112.322 -167.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 76.2 mtt85 -52.81 -46.62 67.78 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 120.88 1.673 . . . . 73.230000000000004 111.155 175.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -54.56 -66.23 0.44 Allowed 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 125.728 1.611 . . . . 73.010000000000005 109.12 177.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.6 m -48.01 -52.01 21.7 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 126.096 1.758 . . . . 62.329999999999998 110.766 -178.653 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.7 -36.14 73.75 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.874 1.27 . . . . 55.200000000000003 111.711 -177.445 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 14.8 ttp180 -59.4 -57.9 10.98 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 119.947 1.249 . . . . 63.43 108.45 173.126 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -65.82 -30.56 71.21 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-O 116.574 -1.679 . . . . 74.209999999999994 112.065 -169.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -48.85 -54.53 14.86 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-N 119.898 1.226 . . . . 73.319999999999993 110.237 174.199 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 18.8 mm -55.97 -47.1 80.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-N 119.684 1.129 . . . . 35.25 111.56 179.227 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 50.6 mt -66.66 -18.17 23.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 124.329 1.051 . . . . 64.340000000000003 109.569 -178.226 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 1.4 t -115.72 19.42 15.25 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.708 2.003 . . . . 73.420000000000002 110.058 -174.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -130.65 19.72 5.14 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.695 1.998 . . . . 72.329999999999998 110.341 177.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 33.3 mm . . . . . 0 C--O 1.247 0.943 0 CA-C-O 116.788 -1.577 . . . . 51.43 109.369 177.195 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.547 0.84 0 N-CA-C 114.125 1.157 . . . . 74.299999999999997 114.125 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.44 ' HG3' ' H ' ' A' ' 13' ' ' ALA . 6.1 pt-20 -70.08 -85.54 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.64 1.109 . . . . 63.310000000000002 111.444 -176.151 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.44 ' H ' ' HG3' ' A' ' 12' ' ' GLU . . . -72.1 -11.88 60.95 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.736 -1.228 . . . . 42.439999999999998 112.112 177.176 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 51.2 mmtt -57.68 -22.9 48.66 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 125.026 1.33 . . . . 74.540000000000006 113.528 -178.255 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -60.41 -18.79 53.09 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.561 0.744 . . . . 74.400000000000006 112.796 177.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -125.97 55.29 1.47 Allowed 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.258 1.023 . . . . 65.430000000000007 108.41 168.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -156.05 -55.62 0.09 Allowed 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 118.413 -0.803 . . . . 72.099999999999994 111.206 -179.027 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -117.19 122.6 44.5 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 119.093 0.86 . . . . 71.530000000000001 110.357 -165.018 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.41 -32.51 66.93 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 125.952 1.701 . . . . 64.129999999999995 112.893 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -63.28 -52.8 60.54 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 123.447 0.699 . . . . 61.420000000000002 111.439 -179.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 44.2 mt -71.97 -39.99 68.95 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 108.463 -0.939 . . . . 34.109999999999999 108.463 -176.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -47.11 -48.31 23.01 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 117.36 -1.305 . . . . 65.200000000000003 111.475 166.325 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -64.79 -48.39 74.63 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 120.419 1.463 . . . . 64.209999999999994 110.803 177.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -50.42 -42.37 53.75 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 121.514 -0.741 . . . . 70.230000000000004 110.798 175.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -90.65 -9.58 46.35 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 125.343 1.457 . . . . 62.100000000000001 114.615 -177.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.07 -41.37 82.02 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 119.723 1.147 . . . . 71.400000000000006 110.552 -174.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -117.48 -85.26 0.64 Allowed 'General case' 0 N--CA 1.442 -0.84 0 N-CA-C 106.266 -1.753 . . . . 52.229999999999997 106.266 -160.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.346 0.0 OUTLIER 48.56 -1.41 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 117.652 2.464 . . . . 72.030000000000001 117.652 171.099 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 -80.13 4.96 15.66 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 121.358 1.89 . . . . 73.299999999999997 112.111 -177.267 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -130.65 -26.98 2.18 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-O 117.31 -1.329 . . . . 44.210000000000001 111.044 178.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.83 -55.01 7.16 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 120.686 1.585 . . . . 71.109999999999999 108.894 175.368 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.452 ' HA ' ' HG3' ' A' ' 35' ' ' GLU . 0.2 OUTLIER -61.01 -13.71 18.23 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 126.41 1.884 . . . . 71.219999999999999 115.266 -175.974 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 29.6 tp -71.38 -32.59 68.65 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 120.782 -1.199 . . . . 62.420000000000002 110.262 -172.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.01 -34.82 90.94 Favored Glycine 0 CA--C 1.529 0.948 0 N-CA-C 110.949 -0.861 . . . . 74.340000000000003 110.949 173.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.452 ' HG3' ' HA ' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -65.32 -19.14 65.82 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.754 1.277 . . . . 64.420000000000002 111.406 -173.425 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 19.9 t90 -74.4 -75.71 0.15 Allowed 'General case' 0 C--N 1.341 0.227 0 N-CA-C 107.946 -1.131 . . . . 70.349999999999994 107.946 169.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -54.7 -29.3 52.69 Favored 'General case' 0 C--O 1.222 -0.356 0 C-N-CA 125.139 1.375 . . . . 34.299999999999997 112.722 -171.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -45.08 -53.75 7.55 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.903 1.229 . . . . 65.239999999999995 111.222 169.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.4 -33.52 87.46 Favored Glycine 0 CA--C 1.532 1.109 0 O-C-N 121.95 -0.469 . . . . 74.450000000000003 112.01 -177.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.429 HD22 HD11 ' A' ' 76' ' ' LEU . 7.4 mp -66.12 -50.93 62.31 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.608 1.563 . . . . 65.140000000000001 109.588 173.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.7 mp -62.99 -28.45 70.1 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 125.498 1.519 . . . . 73.409999999999997 113.072 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 108.92 20.82 7.78 Favored Glycine 0 CA--C 1.527 0.802 0 C-N-CA 124.892 1.234 . . . . 72.120000000000005 112.878 -179.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.0 mttt -106.83 135.66 47.99 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 125.794 1.638 . . . . 73.409999999999997 107.944 178.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 17.5 p -138.29 154.22 49.03 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 124.458 1.103 . . . . 71.219999999999999 108.789 -176.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 49.94 -118.06 5.38 Favored Glycine 0 CA--C 1.523 0.555 0 N-CA-C 111.214 -0.754 . . . . 72.340000000000003 111.214 173.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -57.71 -36.86 72.58 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.765 1.626 . . . . 72.140000000000001 113.313 -177.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -68.01 -45.85 72.88 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 122.024 0.916 . . . . 75.239999999999995 109.851 177.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.92 -32.53 74.08 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.695 0.798 . . . . 70.040000000000006 110.475 177.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.7 ttm180 -54.88 -52.12 63.82 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 124.332 1.053 . . . . 73.120000000000005 111.266 178.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.47 -41.22 96.9 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-O 121.671 0.748 . . . . 74.230000000000004 110.988 -179.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -65.14 -37.65 88.09 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 121.252 0.549 . . . . 72.420000000000002 111.396 178.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.09 -1.47 5.99 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.169 1.387 . . . . 34.420000000000002 112.596 177.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 35.7 mt -106.83 7.96 30.49 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.895 1.678 . . . . 64.040000000000006 111.106 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.0 t -141.21 19.94 2.26 Favored 'General case' 0 CA--C 1.543 0.673 0 O-C-N 121.409 -0.807 . . . . 74.430000000000007 112.963 -174.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 25.8 t -130.84 73.49 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 O-C-N 120.445 -1.409 . . . . 73.430000000000007 107.884 178.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 79.9 t -142.15 124.72 14.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 C-N-CA 124.155 0.982 . . . . 74.010000000000005 108.959 175.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.7 t -155.2 -55.66 0.09 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 106.033 -1.839 . . . . 61.399999999999999 106.033 169.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.446 -0.64 0 CA-C-O 122.385 1.088 . . . . 72.420000000000002 109.871 -166.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 39.3 t0 . . . . . 0 CA--C 1.522 -0.12 0 N-CA-C 110.349 -0.241 . . . . 62.140000000000001 110.349 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 85.6 t -84.74 -39.66 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 O-C-N 121.528 -0.733 . . . . 73.040000000000006 111.199 -175.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.437 ' CE2' ' HG2' ' A' ' 82' ' ' GLU . 2.3 t80 -74.4 -25.15 59.29 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.503 -0.748 . . . . 63.420000000000002 111.553 179.173 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.7 ttm180 -44.88 -67.77 0.26 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.065 1.746 . . . . 74.049999999999997 112.848 -174.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.576 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -55.13 -46.75 75.66 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 126.087 1.755 . . . . 72.340000000000003 110.115 -177.01 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.65 -57.44 11.94 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 125.267 1.427 . . . . 62.219999999999999 110.189 -177.392 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.423 ' HB2' ' CE2' ' A' ' 69' ' ' PHE . . . -65.59 -36.64 84.33 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.998 0.519 . . . . 74.430000000000007 110.906 -175.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.82 -47.07 85.02 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.828 0.451 . . . . 54.509999999999998 111.148 176.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.06 -48.85 78.39 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 124.906 1.283 . . . . 75.430000000000007 109.873 179.332 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.429 HD11 HD22 ' A' ' 40' ' ' LEU . 11.8 tp -100.84 14.65 31.05 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 125.819 1.647 . . . . 74.340000000000003 112.959 -159.175 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -47.01 119.81 2.74 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 127.315 2.246 . . . . 62.329999999999998 110.987 -174.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 86.53 -1.74 87.27 Favored Glycine 0 CA--C 1.524 0.614 0 C-N-CA 124.657 1.122 . . . . 72.329999999999998 113.571 175.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -124.73 0.47 8.09 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 118.675 1.237 . . . . 70.219999999999999 110.512 -174.579 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -148.98 176.14 10.69 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 125.86 1.664 . . . . 50.530000000000001 109.794 171.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -135.69 162.02 33.91 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 126.45 1.9 . . . . 74.239999999999995 107.14 -177.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.437 ' HG2' ' CE2' ' A' ' 69' ' ' PHE . 0.3 OUTLIER -54.43 -55.29 30.29 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 124.926 1.29 . . . . 70.209999999999994 111.409 178.499 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -68.7 -31.45 70.56 Favored 'General case' 0 C--O 1.225 -0.201 0 O-C-N 121.529 -0.732 . . . . 74.239999999999995 111.008 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 77.0 m -66.23 -39.48 89.59 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 118.751 -0.643 . . . . 73.409999999999997 109.286 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 75.0 mt -65.62 -48.32 83.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-N 119.795 1.18 . . . . 71.329999999999998 108.89 175.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.6 ppt_? -63.43 -36.81 84.97 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 118.771 -0.633 . . . . 73.329999999999998 110.818 -175.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.49 -54.62 21.88 Favored 'General case' 0 N--CA 1.445 -0.72 0 C-N-CA 124.244 1.018 . . . . 70.409999999999997 109.312 174.442 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.404 ' O ' HD22 ' A' ' 92' ' ' LEU . 10.7 tptt -50.07 -51.88 39.01 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 118.828 0.74 . . . . 74.099999999999994 110.62 -171.027 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 12.6 ptp -64.19 -29.56 70.66 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 120.049 -0.66 . . . . 72.319999999999993 112.27 -175.312 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 89.2 t -79.58 -28.34 12.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 124.159 0.984 . . . . 74.430000000000007 111.072 174.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -54.0 -51.58 63.48 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 121.217 1.826 . . . . 64.010000000000005 110.432 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.404 HD22 ' O ' ' A' ' 88' ' ' LYS . 0.2 OUTLIER -75.31 6.12 4.84 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.828 0.677 . . . . 65.299999999999997 112.828 -174.167 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 36.2 ttm180 -47.64 -41.12 21.48 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.306 1.442 . . . . 73.329999999999998 112.516 -174.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -96.96 -27.39 14.66 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 113.268 0.84 . . . . 53.5 113.268 173.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 44.5 m -59.33 -35.61 74.14 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 120.467 -1.395 . . . . 54.329999999999998 110.962 177.593 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -51.44 -45.01 62.5 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.189 0.996 . . . . 73.120000000000005 112.246 -177.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.47 -27.21 67.63 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-O 119.167 -0.444 . . . . 72.0 112.09 -178.065 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -80.11 -38.55 31.37 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 109.105 -0.702 . . . . 74.109999999999999 109.105 -178.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -55.94 -44.57 78.54 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-O 117.636 -1.173 . . . . 72.409999999999997 112.84 -176.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 20.0 mm -56.1 -49.27 76.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 120.234 1.379 . . . . 73.439999999999998 108.729 178.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 53.7 mt -69.93 -7.04 7.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 C-N-CA 125.245 1.418 . . . . 72.109999999999999 111.453 178.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 9.5 t -117.45 21.38 13.09 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.853 2.061 . . . . 74.340000000000003 110.767 178.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 -119.53 13.39 12.56 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.926 2.091 . . . . 72.439999999999998 108.604 176.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.255 1.363 0 N-CA-C 108.273 -1.01 . . . . 74.109999999999999 108.273 177.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 2.1 p80 . . . . . 0 CA--C 1.531 0.231 0 N-CA-C 107.942 -1.133 . . . . 75.099999999999994 107.942 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . 0.256 12.9 pt-20 49.69 81.72 0.06 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.911 1.685 . . . . 73.209999999999994 111.461 -176.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.42 39.64 14.9 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 126.288 1.835 . . . . 63.210000000000001 112.756 -177.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.3 mmtt -107.38 -9.46 16.01 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 125.166 1.386 . . . . 75.200000000000003 112.487 -178.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -51.15 -31.22 19.08 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.006 1.322 . . . . 75.120000000000005 113.817 176.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.33 -8.11 29.86 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.438 1.095 . . . . 61.009999999999998 113.169 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 18.0 t-80 -117.88 161.2 20.14 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 126.648 1.979 . . . . 71.340000000000003 107.63 -175.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 58.18 -158.07 0.29 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.405 1.082 . . . . 75.129999999999995 109.133 177.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -136.33 -34.11 0.79 Allowed 'General case' 0 C--O 1.223 -0.312 0 C-N-CA 124.277 1.031 . . . . 74.200000000000003 109.222 159.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -45.92 -40.36 10.07 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 125.074 1.35 . . . . 74.299999999999997 111.939 177.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 18.7 mt -66.16 -39.45 89.8 Favored 'General case' 0 C--N 1.331 -0.201 0 O-C-N 120.936 -1.102 . . . . 64.409999999999997 110.918 -175.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -76.76 -26.64 54.76 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.365 1.466 . . . . 62.219999999999999 110.611 174.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -55.36 -39.88 70.61 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.811 1.244 . . . . 72.310000000000002 111.229 -169.697 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.496 ' HE2' HD12 ' A' ' 100' ' ' ILE . 16.1 ptmt -54.38 -46.5 73.07 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 120.692 -1.255 . . . . 72.5 111.259 175.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.609 ' HB1' ' HA ' ' A' ' 97' ' ' ARG . . . -65.38 -58.71 5.22 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 125.693 1.597 . . . . 74.0 110.847 179.423 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -67.82 -3.45 9.6 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.06 0.763 . . . . 54.240000000000002 113.06 -176.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -116.38 11.41 14.97 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.675 1.99 . . . . 64.310000000000002 112.888 171.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.6 mmt-85 -74.84 -14.42 60.68 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 119.626 -1.921 . . . . 64.430000000000007 112.543 175.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -47.17 -72.41 0.05 Allowed 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 127.37 2.268 . . . . 72.329999999999998 112.819 -163.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -74.13 -5.91 44.55 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 120.76 1.618 . . . . 60.119999999999997 112.993 -177.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.14 -34.98 66.4 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 121.143 1.792 . . . . 74.439999999999998 111.624 -177.027 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.25 -11.76 58.47 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 112.464 0.542 . . . . 55.32 112.464 -175.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -66.93 -22.26 65.95 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 126.103 1.761 . . . . 73.340000000000003 114.239 -171.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -70.08 -31.75 69.38 Favored Glycine 0 C--O 1.224 -0.487 0 C-N-CA 120.608 -0.806 . . . . 74.0 111.301 -179.397 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 75.4 mt-10 -64.65 -33.58 76.26 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 124.035 0.934 . . . . 74.310000000000002 111.517 -172.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 9.0 t90 -58.07 -77.74 0.03 OUTLIER 'General case' 0 C--O 1.233 0.194 0 C-N-CA 124.518 1.127 . . . . 75.230000000000004 108.08 168.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.426 ' HB1' HD13 ' A' ' 76' ' ' LEU . . . -57.28 -29.18 63.64 Favored 'General case' 0 C--O 1.218 -0.565 0 C-N-CA 125.886 1.674 . . . . 74.439999999999998 112.745 -168.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -46.16 -54.56 8.45 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 120.321 1.419 . . . . 54.420000000000002 112.038 176.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -57.86 -40.42 93.05 Favored Glycine 0 CA--C 1.531 1.033 0 CA-C-N 118.707 0.685 . . . . 74.129999999999995 111.443 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.4 mp -63.06 -42.58 99.74 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.364 1.466 . . . . 70.349999999999994 110.362 178.085 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.5 mp -70.08 -0.58 7.93 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 127.899 2.479 . . . . 72.129999999999995 113.198 172.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 71.96 25.54 74.54 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 124.862 1.22 . . . . 71.140000000000001 112.523 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 45.1 mttt -107.98 148.51 29.6 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 125.329 1.452 . . . . 74.530000000000001 108.629 174.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.0 p -142.95 166.78 23.7 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-O 121.283 0.563 . . . . 71.239999999999995 110.767 171.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 67.13 -113.69 5.79 Favored Glycine 0 N--CA 1.444 -0.793 0 C-N-CA 124.881 1.229 . . . . 74.109999999999999 110.965 168.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -73.44 -41.85 62.71 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.207 -0.497 . . . . 71.340000000000003 111.304 -171.236 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.22 -36.37 82.87 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 110.158 -0.312 . . . . 74.209999999999994 110.158 178.19 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.54 -43.81 93.41 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 122.91 0.484 . . . . 64.340000000000003 110.86 173.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.7 ttt180 -65.27 -47.77 75.51 Favored 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 124.221 1.008 . . . . 73.010000000000005 108.959 179.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.83 -48.13 78.04 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 118.888 -0.577 . . . . 51.130000000000003 110.354 -176.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 45.4 t80 -50.6 -52.6 37.73 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 124.157 0.983 . . . . 74.310000000000002 110.03 172.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.56 -26.55 55.4 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 113.219 0.822 . . . . 64.209999999999994 113.219 178.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 16.3 mt -76.35 -16.95 59.63 Favored 'General case' 0 C--N 1.333 -0.148 0 O-C-N 120.63 -1.294 . . . . 64.299999999999997 111.486 -175.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.6 t -121.26 -8.09 9.25 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 119.965 1.257 . . . . 73.540000000000006 112.664 -172.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 4.7 p -73.19 3.04 1.02 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.095 0 N-CA-C 115.53 1.678 . . . . 63.299999999999997 115.53 -173.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 70.4 t -78.14 110.49 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 O-C-N 119.261 -2.149 . . . . 73.109999999999999 109.315 -168.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.7 p -79.82 -85.98 0.08 Allowed 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.611 1.165 . . . . 54.299999999999997 110.823 177.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.4 t . . . . . 0 CA--C 1.537 0.474 0 N-CA-C 107.053 -1.462 . . . . 72.430000000000007 107.053 -176.412 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . 0.299 44.0 m-20 . . . . . 0 CA--C 1.536 0.414 0 CA-C-O 118.004 -0.998 . . . . 55.039999999999999 112.277 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.4 t -48.96 -61.61 0.54 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 C-N-CA 125.628 1.571 . . . . 75.510000000000005 111.13 177.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.445 ' CE2' HD12 ' A' ' 85' ' ' ILE . 17.7 t80 -71.08 -42.35 69.48 Favored 'General case' 0 CA--C 1.527 0.061 0 C-N-CA 123.611 0.764 . . . . 64.230000000000004 110.647 177.248 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -51.84 -50.25 61.26 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.365 1.066 . . . . 63.210000000000001 110.334 -173.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -67.95 -37.8 82.02 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 118.874 -0.584 . . . . 64.519999999999996 110.672 -175.404 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.511 HD22 HD22 ' A' ' 76' ' ' LEU . 0.7 OUTLIER -64.89 -52.46 56.4 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-N 119.062 0.846 . . . . 55.299999999999997 110.276 174.853 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.24 -21.06 65.99 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.629 1.104 . . . . 54.229999999999997 112.365 -177.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.99 -63.7 1.01 Allowed 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.892 0.877 . . . . 75.230000000000004 110.606 166.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.61 -21.71 66.6 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.859 0.863 . . . . 71.409999999999997 112.698 -174.049 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.897 HD23 ' HB2' ' A' ' 80' ' ' ALA . 10.3 tp -113.1 19.29 17.3 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.918 2.487 . . . . 74.549999999999997 110.79 -171.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -51.23 110.24 0.42 Allowed 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.586 1.954 . . . . 62.210000000000001 108.821 171.082 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 94.62 0.14 64.85 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 125.187 1.375 . . . . 62.350000000000001 114.319 178.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.6 7.45 5.28 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.956 1.702 . . . . 64.150000000000006 111.5 178.803 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.897 ' HB2' HD23 ' A' ' 76' ' ' LEU . . . -135.21 176.98 8.17 Favored 'General case' 0 C--O 1.233 0.234 0 O-C-N 120.87 -1.144 . . . . 52.409999999999997 111.116 177.072 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -138.24 168.62 19.36 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 114.168 -1.378 . . . . 73.420000000000002 107.659 158.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 87.5 mt-10 -66.09 -19.19 65.77 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 112.195 -2.275 . . . . 72.400000000000006 111.442 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -110.15 -8.93 14.72 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.022 0.828 . . . . 75.109999999999999 111.403 177.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.1 m -84.2 -41.36 17.06 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.641 -0.662 . . . . 72.239999999999995 110.678 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.445 HD12 ' CE2' ' A' ' 69' ' ' PHE . 79.5 mt -60.2 -44.63 95.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-N 119.727 1.149 . . . . 55.210000000000001 109.504 -179.018 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -58.71 -24.94 62.36 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 118.34 0.518 . . . . 62.420000000000002 112.218 178.208 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -94.12 -5.52 47.05 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 118.548 -0.739 . . . . 34.119999999999997 111.943 -178.721 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -93.23 -64.52 1.08 Allowed 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 120.046 1.293 . . . . 64.200000000000003 110.154 173.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 2.0 mtm -64.71 -29.09 70.07 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 119.597 -0.841 . . . . 75.540000000000006 111.62 -161.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 27.4 t -63.51 -47.53 91.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 125.106 1.362 . . . . 52.100000000000001 110.795 176.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -59.65 -45.99 90.35 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 119.301 0.955 . . . . 54.420000000000002 111.23 -170.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.3 mt -72.38 -0.74 13.21 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 125.126 1.37 . . . . 63.219999999999999 110.704 -167.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 45.3 ttt180 -51.17 -38.6 53.1 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 124.254 1.022 . . . . 74.329999999999998 110.764 164.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.01 -53.31 40.25 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.974 0.807 . . . . 43.219999999999999 110.711 176.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.0 m -54.7 -31.27 57.74 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.027 1.731 . . . . 52.219999999999999 111.283 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.7 -53.37 59.12 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.431 1.092 . . . . 74.299999999999997 112.313 -178.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.609 ' HA ' ' HB1' ' A' ' 25' ' ' ALA . 14.6 ptm180 -70.43 -37.55 74.41 Favored 'General case' 0 CA--C 1.519 -0.229 0 C-N-CA 120.053 -0.659 . . . . 64.329999999999998 110.991 179.232 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -59.0 -46.29 88.55 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-O 118.072 -0.966 . . . . 63.109999999999999 111.488 -174.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -59.62 -31.98 69.99 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 119.029 0.831 . . . . 62.030000000000001 112.791 -174.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.496 HD12 ' HE2' ' A' ' 24' ' ' LYS . 27.2 mm -73.39 -38.2 52.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 O-C-N 121.224 -0.922 . . . . 73.329999999999998 110.374 177.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 82.3 mt -74.76 -13.63 15.54 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 C-N-CA 124.187 0.995 . . . . 74.099999999999994 109.191 177.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 16.1 t -85.62 -40.82 15.81 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.213 1.405 . . . . 40.310000000000002 108.154 174.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -128.71 65.61 1.42 Allowed 'General case' 0 C--O 1.239 0.541 0 C-N-CA 124.745 1.218 . . . . 71.200000000000003 107.781 -169.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.414 HD12 ' H ' ' A' ' 104' ' ' ILE . 5.1 mp . . . . . 0 C--O 1.253 1.286 0 N-CA-C 107.403 -1.332 . . . . 72.030000000000001 107.403 176.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.539 0.533 0 N-CA-C 114.39 1.256 . . . . 65.409999999999997 114.39 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -50.94 98.38 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 127.232 2.213 . . . . 72.510000000000005 110.676 179.469 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 53.05 11.85 0.25 Allowed 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 115.846 1.795 . . . . 54.200000000000003 115.846 -171.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 54.3 mttt -84.71 -4.04 58.84 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 124.691 1.197 . . . . 65.519999999999996 113.192 177.153 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -55.18 -30.36 59.74 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 120.927 1.694 . . . . 73.209999999999994 112.445 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -77.76 5.51 9.28 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.749 1.018 . . . . 70.5 113.749 179.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 10.2 t-80 -143.47 176.61 9.05 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.607 1.563 . . . . 64.219999999999999 109.472 -176.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 62.76 -171.8 0.16 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.87 1.668 . . . . 73.239999999999995 111.992 165.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -118.3 -35.82 3.71 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 124.713 1.205 . . . . 72.099999999999994 110.001 171.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.3 mp0 -45.08 -50.25 11.12 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 127.409 2.284 . . . . 74.439999999999998 112.327 -172.612 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.78 ' H ' HD22 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -75.23 -44.18 47.63 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 124.255 1.022 . . . . 74.420000000000002 111.568 -176.882 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -57.51 -44.97 85.44 Favored 'General case' 0 C--O 1.219 -0.527 0 C-N-CA 125.017 1.327 . . . . 73.209999999999994 109.988 178.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.72 -48.22 66.81 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.006 1.322 . . . . 73.239999999999995 110.249 -177.868 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 42.3 mttp -61.48 -57.65 11.32 Favored 'General case' 0 C--O 1.232 0.175 0 O-C-N 121.584 -0.697 . . . . 50.420000000000002 110.352 171.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -71.98 -16.16 62.07 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 114.248 1.203 . . . . 65.030000000000001 114.248 -165.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -62.48 -50.82 69.92 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 127.561 2.344 . . . . 74.030000000000001 108.783 167.027 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.57 16.95 17.4 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 114.333 1.234 . . . . 54.399999999999999 114.333 -145.393 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -109.86 -6.97 15.07 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 116.301 1.963 . . . . 71.200000000000003 116.301 -154.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.9 ptt180 -62.64 -16.62 57.71 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 121.375 1.898 . . . . 65.120000000000005 115.319 -170.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -116.95 -13.4 10.64 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 126.346 1.859 . . . . 70.109999999999999 112.636 173.248 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.1 -8.32 11.64 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 121.575 1.989 . . . . 70.430000000000007 113.625 -175.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.468 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.4 pt? -104.68 -3.2 23.98 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 126.457 1.903 . . . . 63.219999999999999 114.697 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 35.6 tp -68.71 -35.3 76.99 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 123.759 0.824 . . . . 74.120000000000005 111.043 -176.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -57.09 -42.87 93.36 Favored Glycine 0 C--O 1.221 -0.715 0 CA-C-O 118.78 -1.011 . . . . 53.219999999999999 110.72 166.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -64.77 -16.74 63.42 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 118.924 1.362 . . . . 74.329999999999998 112.369 -176.041 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 14.2 t90 -80.64 -63.7 1.35 Allowed 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.955 0.902 . . . . 74.040000000000006 109.137 164.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.7 -29.67 27.94 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.577 1.551 . . . . 54.219999999999999 114.189 -174.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.02 -61.51 2.22 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 125.927 1.691 . . . . 65.200000000000003 111.385 -177.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.85 -15.53 58.09 Favored Glycine 0 CA--C 1.531 1.082 0 CA-C-N 118.709 0.686 . . . . 71.040000000000006 113.153 -177.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 19.8 mt -76.69 -43.91 35.81 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.789 1.236 . . . . 72.200000000000003 109.215 173.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.451 HD23 ' HE3' ' A' ' 79' ' ' LYS . 24.2 mt -71.33 1.66 5.89 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.955 2.102 . . . . 64.340000000000003 112.001 165.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.05 0.5 44.02 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.763 1.649 . . . . 61.200000000000003 114.278 -177.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -65.51 127.52 32.17 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 125.386 1.474 . . . . 72.340000000000003 107.431 173.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.6 p -140.69 147.52 39.38 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.408 -0.59 . . . . 73.040000000000006 109.408 -179.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 82.27 -129.89 9.35 Favored Glycine 0 C--N 1.33 0.23 0 N-CA-C 111.17 -0.772 . . . . 74.319999999999993 111.17 172.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -70.04 -28.31 65.36 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.353 -0.61 . . . . 71.040000000000006 109.353 179.305 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -62.49 -41.29 98.7 Favored 'General case' 0 CA--C 1.514 -0.424 0 C-N-CA 125.181 1.392 . . . . 71.230000000000004 111.131 177.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.85 -57.26 7.35 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 107.385 -1.339 . . . . 54.140000000000001 107.385 172.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.07 -51.85 29.06 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 118.62 0.645 . . . . 74.200000000000003 112.116 -175.449 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.47 -38.65 90.64 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.009 1.323 . . . . 74.420000000000002 111.799 -179.177 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -62.73 -44.1 97.08 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.923 0.889 . . . . 71.239999999999995 110.289 174.392 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.4 -27.11 68.78 Favored 'General case' 0 CA--C 1.53 0.182 0 O-C-N 121.299 -0.875 . . . . 71.329999999999998 112.992 -176.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 9.2 mt -60.28 -49.02 79.27 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 119.031 0.832 . . . . 71.319999999999993 108.861 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.5 t -76.25 6.19 5.85 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 125.155 1.382 . . . . 74.329999999999998 112.04 179.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 98.6 t -119.48 94.04 2.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 C-N-CA 125.355 1.462 . . . . 63.020000000000003 108.41 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.5 p -140.93 157.46 22.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 106.533 -1.654 . . . . 73.010000000000005 106.533 155.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 13.4 t -171.49 -170.77 0.84 Allowed 'General case' 0 C--O 1.239 0.547 0 C-N-CA 126.233 1.813 . . . . 51.43 106.562 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 49.1 m . . . . . 0 CA--C 1.536 0.42 0 C-N-CA 125.224 1.41 . . . . 73.0 110.07 -177.674 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 41.0 t0 . . . . . 0 CA--C 1.537 0.471 0 N-CA-C 113.749 1.018 . . . . 45.43 113.749 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 67.5 t -106.33 -41.57 6.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 O-C-N 120.331 -1.481 . . . . 73.400000000000006 109.684 168.266 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -49.6 -37.59 28.36 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.282 1.033 . . . . 74.120000000000005 111.438 176.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.0 -28.25 16.3 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.647 1.579 . . . . 72.140000000000001 113.932 175.329 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -86.25 -41.6 14.48 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 108.529 -0.915 . . . . 62.039999999999999 108.529 -176.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.21 -52.82 11.26 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.407 0.683 . . . . 74.340000000000003 110.728 -178.722 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.34 -21.92 66.75 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 125.17 1.388 . . . . 74.010000000000005 111.356 -175.362 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.25 -41.84 96.77 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 118.461 0.573 . . . . 73.219999999999999 111.001 169.254 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.02 -53.33 15.15 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 107.954 -1.128 . . . . 70.239999999999995 107.954 177.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.522 ' HA ' ' HE2' ' A' ' 79' ' ' LYS . 65.5 mt -83.91 33.12 0.48 Allowed 'General case' 0 C--O 1.233 0.218 0 C-N-CA 125.551 1.54 . . . . 74.319999999999993 111.794 -179.393 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -67.64 121.06 15.08 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 106.429 -1.693 . . . . 74.329999999999998 106.429 175.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 85.44 -0.27 88.4 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 124.977 1.275 . . . . 74.120000000000005 113.756 -173.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.522 ' HE2' ' HA ' ' A' ' 76' ' ' LEU . 36.3 mtmm -135.6 -5.28 2.25 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 118.744 1.272 . . . . 72.019999999999996 113.224 -161.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -164.07 122.4 1.85 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-N 119.99 1.268 . . . . 41.130000000000003 110.531 179.024 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.85 161.27 29.13 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.334 1.054 . . . . 64.0 108.896 175.196 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -49.08 -52.66 24.41 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 126.01 1.724 . . . . 73.329999999999998 108.664 165.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -66.78 -8.39 28.05 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.177 1.391 . . . . 72.120000000000005 112.225 -171.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 17.9 m -111.88 -44.18 3.5 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 126.512 1.925 . . . . 73.439999999999998 110.319 -179.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 74.5 mt -52.46 -56.46 6.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-N 119.654 1.115 . . . . 44.140000000000001 108.276 172.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -56.5 -29.95 62.43 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 123.515 0.726 . . . . 74.310000000000002 112.015 -175.125 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -84.16 -50.18 8.16 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 124.435 1.094 . . . . 65.239999999999995 109.242 -174.334 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.8 tppt? -60.17 -36.36 77.4 Favored 'General case' 0 N--CA 1.463 0.19 0 O-C-N 121.749 -0.594 . . . . 72.329999999999998 111.313 -173.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 28.7 mtt -54.26 -52.81 60.2 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.864 0.466 . . . . 63.130000000000003 109.775 173.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 79.3 t -61.78 -30.65 48.88 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 125.376 1.47 . . . . 70.099999999999994 110.854 -177.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 62.1 tt0 -69.5 -52.4 26.87 Favored 'General case' 0 CA--C 1.53 0.186 0 O-C-N 121.062 -1.024 . . . . 71.129999999999995 110.274 174.083 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 38.9 mt -67.52 -24.86 65.61 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.309 1.044 . . . . 73.420000000000002 110.44 -176.284 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 42.0 ttp180 -56.93 -33.39 66.93 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 124.955 1.302 . . . . 54.100000000000001 110.605 174.336 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -68.26 -47.88 66.53 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 118.533 -0.746 . . . . 63.130000000000003 111.11 177.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 31.0 m -56.0 -81.87 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 126.582 1.953 . . . . 71.310000000000002 110.098 -178.305 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 43.55 -75.03 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.306 1 C-N-CA 132.874 4.47 . . . . 72.310000000000002 113.983 165.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 20.0 ptt-85 -66.6 -40.24 88.77 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.235 -0.893 . . . . 74.230000000000004 109.727 -177.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -59.78 -36.16 76.13 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-O 117.973 -1.013 . . . . 71.140000000000001 110.589 -177.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -57.98 -42.18 84.56 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 118.981 0.81 . . . . 65.030000000000001 111.291 -177.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 24.1 mm -56.81 -45.49 83.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-N 119.775 1.171 . . . . 65.400000000000006 109.6 176.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 27.8 mt -74.15 -17.53 16.99 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 C-N-CA 124.379 1.072 . . . . 74.530000000000001 110.075 -177.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 21.0 t -87.38 -0.9 57.46 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.142 1.777 . . . . 74.120000000000005 110.578 172.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 78.8 mt-10 -132.12 42.61 3.12 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 126.325 1.85 . . . . 74.329999999999998 107.536 -166.143 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.0 mt . . . . . 0 C--O 1.251 1.18 0 N-CA-C 105.328 -2.101 . . . . 74.430000000000007 105.328 169.647 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.533 0.289 0 N-CA-C 112.809 0.67 . . . . 73.099999999999994 112.809 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . 0.285 5.1 pt-20 44.65 -84.98 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 128.998 2.919 . . . . 73.310000000000002 114.318 -178.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.91 -22.1 64.02 Favored 'General case' 0 N--CA 1.462 0.163 0 O-C-N 121.243 -0.911 . . . . 74.329999999999998 113.214 176.263 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.529 ' HB3' HD13 ' A' ' 21' ' ' LEU . 3.4 mptt -64.96 -19.52 66.0 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-O 117.034 -1.46 . . . . 75.129999999999995 113.798 171.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -54.29 -39.83 67.3 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 121.699 2.045 . . . . 62.43 112.278 -177.662 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.65 -11.47 45.1 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.451 1.1 . . . . 54.039999999999999 113.467 177.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 -104.24 164.05 11.99 Favored 'General case' 0 N--CA 1.445 -0.705 0 C-N-CA 126.732 2.013 . . . . 74.420000000000002 108.422 177.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 51.34 -154.93 0.15 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.402 1.081 . . . . 74.129999999999995 108.571 -176.02 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -133.99 -19.83 1.99 Allowed 'General case' 0 C--O 1.222 -0.363 0 C-N-CA 125.038 1.335 . . . . 71.129999999999995 109.086 148.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -44.21 -43.37 7.15 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 127.437 2.295 . . . . 54.229999999999997 111.959 177.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.529 HD13 ' HB3' ' A' ' 14' ' ' LYS . 11.9 mt -67.83 -44.15 77.91 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 125.649 1.58 . . . . 61.140000000000001 111.56 -176.442 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -83.88 -20.72 32.58 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 123.6 0.76 . . . . 74.420000000000002 111.813 -178.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.29 -55.13 19.9 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 124.257 1.023 . . . . 61.530000000000001 109.081 -169.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.7 pttp -45.01 -53.44 7.75 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 124.793 1.237 . . . . 72.420000000000002 113.36 176.369 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.592 ' HB1' ' HA ' ' A' ' 97' ' ' ARG . . . -52.83 -57.1 11.31 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.11 0.964 . . . . 72.519999999999996 110.335 -179.615 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -78.16 13.42 1.48 Allowed 'General case' 0 C--O 1.242 0.684 0 C-N-CA 124.568 1.147 . . . . 74.420000000000002 112.76 -176.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.1 3.21 2.63 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 124.823 1.249 . . . . 75.400000000000006 112.656 -173.351 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.94 7.48 13.22 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.655 1.116 . . . . 74.230000000000004 113.994 -173.185 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 20.3 ptt-85 -60.19 -33.69 72.57 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 121.025 1.738 . . . . 72.230000000000004 109.874 177.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.448 ' HB3' HG13 ' A' ' 56' ' ' VAL . 0.4 OUTLIER -70.63 -12.5 61.6 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 120.547 -1.346 . . . . 72.120000000000005 112.606 -179.762 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -81.71 -50.7 8.98 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 120.41 1.459 . . . . 64.219999999999999 109.516 -175.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.29 -13.37 62.35 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 115.633 -0.712 . . . . 75.439999999999998 112.452 -179.693 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 17.0 mt -58.36 -32.18 68.31 Favored 'General case' 0 N--CA 1.468 0.448 0 O-C-N 120.645 -1.284 . . . . 63.240000000000002 111.457 171.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -72.98 -6.56 68.22 Favored Glycine 0 CA--C 1.528 0.882 0 O-C-N 121.25 -0.906 . . . . 52.350000000000001 112.28 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -83.09 -20.52 34.72 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 120.94 -1.329 . . . . 73.340000000000003 111.822 171.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 36.7 t90 -74.68 -82.06 0.07 Allowed 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.336 1.054 . . . . 74.329999999999998 108.668 179.511 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.68 -17.25 21.0 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.211 1.404 . . . . 51.450000000000003 113.791 -171.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -51.66 -55.44 19.42 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.174 0.59 . . . . 71.340000000000003 110.363 172.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -62.26 -41.98 99.72 Favored Glycine 0 CA--C 1.527 0.814 0 N-CA-C 111.276 -0.73 . . . . 31.530000000000001 111.276 -175.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.0 mp -56.56 -34.11 66.8 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.57 1.548 . . . . 72.439999999999998 111.695 176.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 71.8 mt -94.54 4.37 53.94 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.766 2.027 . . . . 62.439999999999998 112.456 176.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 76.41 42.58 22.39 Favored Glycine 0 CA--C 1.527 0.833 0 O-C-N 120.849 -1.157 . . . . 52.439999999999998 113.109 176.314 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 30.5 mttm -127.34 132.66 50.18 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 126.358 1.863 . . . . 74.530000000000001 108.038 176.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 45.3 p -134.45 -179.1 5.37 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 124.797 1.239 . . . . 71.430000000000007 108.094 164.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 46.49 -123.08 6.92 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 125.398 1.475 . . . . 73.519999999999996 113.318 173.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -63.49 -31.42 72.58 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 117.405 0.602 . . . . 72.239999999999995 112.372 -174.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -77.07 -40.26 46.79 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.677 0.751 . . . . 64.409999999999997 110.846 -177.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.12 -33.3 74.2 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.846 -0.616 . . . . 74.510000000000005 110.272 168.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 7.0 ttm-85 -58.24 -55.95 28.4 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.417 -0.957 . . . . 75.450000000000003 108.417 173.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.68 -43.01 80.05 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.852 1.261 . . . . 74.310000000000002 111.103 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -60.67 -41.92 96.05 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.347 1.059 . . . . 54.420000000000002 111.344 175.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.97 -0.49 18.92 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 120.476 -1.39 . . . . 72.540000000000006 113.345 -178.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.4 mt -79.42 5.31 13.02 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 120.782 1.628 . . . . 74.409999999999997 112.331 177.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.31 -22.46 1.75 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.534 1.133 . . . . 64.319999999999993 112.466 -174.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 35.6 m -64.43 -12.08 11.66 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 N-CA-C 115.526 1.676 . . . . 74.439999999999998 115.526 -171.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.448 HG13 ' HB3' ' A' ' 30' ' ' ASN . 9.9 t -88.23 115.85 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 N-CA-C 107.935 -1.135 . . . . 72.209999999999994 107.935 -170.678 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.2 t -139.8 -53.69 0.54 Allowed 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 126.304 1.841 . . . . 73.25 106.359 -178.21 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.7 t . . . . . 0 CA--C 1.531 0.221 0 C-N-CA 125.264 1.426 . . . . 74.109999999999999 110.432 176.864 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 . . . . . 0 C--O 1.224 -0.258 0 CA-C-O 119.033 -0.508 . . . . 75.140000000000001 111.298 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.439 ' HA ' ' HE3' ' A' ' 71' ' ' LYS . 57.3 t -63.16 -36.74 77.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-N 119.255 0.934 . . . . 54.009999999999998 110.305 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -89.74 -19.1 25.17 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 123.797 0.839 . . . . 40.229999999999997 110.189 -179.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.5 -36.17 79.74 Favored 'General case' 0 CA--C 1.522 -0.133 0 N-CA-C 115.154 1.539 . . . . 74.540000000000006 115.154 -167.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.686 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -68.74 -53.44 21.93 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 106.635 -1.617 . . . . 61.240000000000002 106.635 -175.508 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -47.6 -61.39 1.96 Allowed 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 126.102 1.761 . . . . 71.150000000000006 109.064 172.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.89 -42.98 76.77 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 124.154 0.909 . . . . 35.210000000000001 111.405 -171.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -75.53 -35.64 60.68 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.776 1.028 . . . . 75.209999999999994 113.776 -179.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -73.75 -44.07 57.28 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 120.904 -1.123 . . . . 63.520000000000003 109.419 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 12.6 tp -86.04 13.76 7.21 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 128.332 2.653 . . . . 71.549999999999997 110.681 -179.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -55.73 123.08 12.94 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 125.407 1.483 . . . . 74.25 108.43 -178.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 98.75 -11.43 62.72 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 124.787 1.184 . . . . 63.549999999999997 113.728 -174.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.5 mtmm -128.71 6.6 5.62 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 119.058 1.429 . . . . 74.140000000000001 112.534 -171.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -146.92 174.32 11.61 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.997 0.919 . . . . 64.120000000000005 109.735 170.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -130.35 156.8 44.1 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 125.329 1.452 . . . . 73.310000000000002 107.595 -178.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 68.3 mm-40 -66.26 -20.76 66.2 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 125.207 1.403 . . . . 74.140000000000001 112.425 -177.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 21.8 pt-20 -94.78 -22.77 17.86 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 120.929 -1.107 . . . . 54.210000000000001 112.371 170.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.5 m -79.38 -40.71 29.45 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.028 0.931 . . . . 63.210000000000001 110.583 -172.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 77.6 mt -56.65 -57.34 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 CA-C-N 119.524 1.056 . . . . 75.340000000000003 108.507 -177.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.87 -41.11 90.81 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-N 118.15 0.432 . . . . 73.540000000000006 112.123 -179.646 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.51 -44.78 85.31 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 122.967 0.507 . . . . 71.430000000000007 110.385 -179.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.73 -26.17 61.43 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.861 0.864 . . . . 75.510000000000005 112.465 -179.482 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 21.9 mtt -73.1 -41.2 64.3 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 119.014 0.825 . . . . 64.099999999999994 110.803 177.607 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 11.9 t -73.11 -31.19 33.99 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.137 0.975 . . . . 63.310000000000002 110.129 178.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -48.61 -57.71 5.8 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 126.074 1.75 . . . . 61.520000000000003 111.769 -174.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.93 25.3 0.12 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.767 1.627 . . . . 61.109999999999999 114.138 -179.41 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 3.4 mtt-85 -50.54 -48.28 57.35 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 125.61 1.564 . . . . 74.299999999999997 113.539 -177.408 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.17 -38.88 21.75 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 123.924 0.89 . . . . 63.299999999999997 109.939 177.374 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.8 m -50.8 -39.09 51.98 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.561 1.544 . . . . 75.310000000000002 110.817 -179.122 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.3 -38.63 77.43 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.14 -0.975 . . . . 73.540000000000006 113.591 178.352 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . 0.592 ' HA ' ' HB1' ' A' ' 25' ' ' ALA . 5.0 ptm180 -86.24 -27.02 24.71 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.313 0.96 . . . . 53.100000000000001 112.156 175.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -66.84 -48.91 67.42 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.99 0.916 . . . . 75.530000000000001 111.78 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -59.59 -29.25 67.83 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 118.297 0.498 . . . . 64.239999999999995 111.918 -169.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 42.3 mm -67.39 -32.42 57.22 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 124.488 1.115 . . . . 74.5 112.351 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 51.3 mt -88.95 -21.85 6.76 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 N-CA-C 108.529 -0.915 . . . . 75.420000000000002 108.529 176.294 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 4.3 t -71.34 -37.31 71.71 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.973 -0.454 . . . . 62.140000000000001 109.804 172.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -135.53 76.04 1.59 Allowed 'General case' 0 C--O 1.236 0.367 0 C-N-CA 127.012 2.125 . . . . 74.439999999999998 105.549 -165.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 9.1 mt . . . . . 0 C--O 1.247 0.951 0 C-N-CA 127.602 2.361 . . . . 74.510000000000005 107.896 -177.416 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 1.9 p80 . . . . . 0 CA--C 1.539 0.539 0 CA-C-O 119.795 -0.145 . . . . 75.540000000000006 110.719 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -67.72 108.4 2.92 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 107.972 -1.121 . . . . 75.439999999999998 107.972 -174.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.15 14.33 5.41 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.242 1.417 . . . . 51.140000000000001 114.101 -179.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 13.3 mttt -85.15 -3.81 58.94 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.132 1.773 . . . . 72.519999999999996 113.44 176.478 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.435 ' CE1' HG21 ' A' ' 100' ' ' ILE . 0.1 OUTLIER -68.46 -32.65 72.82 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 120.732 -1.23 . . . . 53.439999999999998 110.321 -165.955 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -79.91 14.24 1.87 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.043 1.737 . . . . 71.519999999999996 113.309 171.223 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -127.47 -21.41 3.83 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.983 1.265 . . . . 71.299999999999997 114.123 -164.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -152.58 168.13 26.58 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.745 1.157 . . . . 74.540000000000006 110.361 176.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -69.88 -46.0 66.43 Favored 'General case' 0 C--O 1.224 -0.281 0 O-C-N 121.608 -0.682 . . . . 73.129999999999995 111.295 171.169 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -45.61 -54.55 7.52 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.349 1.46 . . . . 64.120000000000005 112.119 -166.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.83 ' H ' HD22 ' A' ' 21' ' ' LEU . 0.1 OUTLIER -63.77 -39.48 94.37 Favored 'General case' 0 N--CA 1.436 -1.134 0 O-C-N 120.869 -1.144 . . . . 74.540000000000006 111.441 -175.542 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -61.65 -42.94 99.6 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.859 0.863 . . . . 73.200000000000003 110.872 174.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -55.24 -39.76 70.11 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.705 0.802 . . . . 64.200000000000003 109.95 172.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.07 -40.21 73.22 Favored 'General case' 0 C--N 1.342 0.247 0 O-C-N 120.625 -1.297 . . . . 73.109999999999999 112.351 173.351 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.26 -47.76 72.66 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 119.465 1.029 . . . . 72.120000000000005 111.716 174.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -58.23 -30.4 66.48 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 121.41 0.624 . . . . 75.5 110.578 177.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -99.09 25.2 6.98 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 126.677 1.991 . . . . 73.430000000000007 110.856 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.666 ' HG3' HD11 ' A' ' 100' ' ' ILE . 6.9 mmt-85 -114.4 -6.75 12.91 Favored 'General case' 0 N--CA 1.463 0.223 0 O-C-N 120.852 -1.155 . . . . 75.310000000000002 111.303 165.014 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 30.9 ptt-85 -60.6 -29.92 69.5 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 119.632 1.105 . . . . 75.340000000000003 112.197 -176.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.547 ' HA ' HD12 ' A' ' 33' ' ' LEU . 16.4 m120 -94.92 -13.32 25.51 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 123.864 0.865 . . . . 72.120000000000005 112.401 177.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.407 ' HD2' HD12 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -57.66 -59.84 4.58 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 120.451 1.478 . . . . 74.530000000000001 110.032 178.889 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.407 HD12 ' HD2' ' A' ' 31' ' ' ARG . 3.5 mp -69.26 -25.53 64.32 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.51 -0.768 . . . . 74.450000000000003 109.91 -166.779 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.547 HD12 ' HA ' ' A' ' 30' ' ' ASN . 60.6 mt -51.96 -33.13 36.37 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.176 0.99 . . . . 71.140000000000001 112.69 173.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -75.24 -36.12 46.36 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 110.124 -1.191 . . . . 72.310000000000002 110.124 -179.113 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -69.17 -23.2 63.91 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.468 1.507 . . . . 64.420000000000002 111.486 -179.29 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 19.0 t90 -67.79 -78.52 0.06 Allowed 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.406 1.082 . . . . 61.049999999999997 108.477 166.276 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.5 -26.06 53.23 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 124.481 1.113 . . . . 61.020000000000003 113.242 -168.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -45.84 -54.22 8.46 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.309 0.958 . . . . 51.509999999999998 111.186 170.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.82 -44.12 97.33 Favored Glycine 0 CA--C 1.53 0.97 0 N-CA-C 111.558 -0.617 . . . . 54.109999999999999 111.558 -176.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.5 mp -58.47 -51.64 69.0 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 126.695 1.998 . . . . 73.329999999999998 110.61 176.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.4 mp -54.93 -42.19 71.97 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.678 1.191 . . . . 75.319999999999993 111.304 174.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 112.21 24.83 4.96 Favored Glycine 0 CA--C 1.519 0.307 0 C-N-CA 124.519 1.057 . . . . 64.109999999999999 112.225 -175.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 33.0 mttm -97.31 137.89 35.62 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 126.89 2.076 . . . . 75.450000000000003 107.249 172.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 36.4 p -139.42 167.91 21.03 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 123.806 0.842 . . . . 63.020000000000003 109.011 -178.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 54.04 -130.72 44.23 Favored Glycine 0 CA--C 1.521 0.469 0 C-N-CA 124.747 1.165 . . . . 35.119999999999997 110.81 173.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -71.39 -22.3 61.89 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 118.335 -0.84 . . . . 74.129999999999995 112.878 -179.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -64.16 -47.05 81.36 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.99 1.268 . . . . 74.409999999999997 110.599 175.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.54 -46.61 88.37 Favored 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 125.052 1.341 . . . . 52.340000000000003 109.76 173.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 6.3 ttm-85 -57.22 -50.5 72.68 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.624 0.77 . . . . 73.109999999999999 111.008 177.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.44 -29.51 70.19 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 126.535 1.934 . . . . 75.430000000000007 111.807 -178.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 82.5 t80 -73.31 -40.97 64.09 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.105 0.962 . . . . 73.209999999999994 109.516 171.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.16 7.18 0.61 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.55 1.14 . . . . 74.439999999999998 113.536 177.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 42.2 mt -88.28 -15.36 36.0 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.183 0.993 . . . . 72.219999999999999 111.863 172.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.9 t -125.01 3.65 8.0 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 119.211 0.914 . . . . 61.32 111.654 -169.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 5.9 p -62.7 -26.87 41.78 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 O-C-N 120.362 -1.461 . . . . 63.210000000000001 112.648 169.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 4.9 m -72.33 117.76 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.569 0 C-N-CA 127.017 2.127 . . . . 72.510000000000005 110.829 -173.482 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.45 HG23 ' H ' ' A' ' 58' ' ' SER . 0.7 OUTLIER -144.34 -85.69 0.13 Allowed 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 127.339 2.256 . . . . 72.430000000000007 107.106 175.217 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.45 ' H ' HG23 ' A' ' 57' ' ' THR . 10.0 m . . . . . 0 N--CA 1.452 -0.373 1 C-N-CA 131.726 4.01 . . . . 75.219999999999999 105.059 174.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 . . . . . 0 CA--C 1.542 0.635 0 N-CA-C 112.381 0.511 . . . . 54.25 112.381 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.402 HG13 ' H ' ' A' ' 69' ' ' PHE . 4.8 p -93.78 -61.76 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 C-N-CA 124.663 1.185 . . . . 73.450000000000003 109.14 175.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . 0.402 ' H ' HG13 ' A' ' 68' ' ' VAL . 0.3 OUTLIER -54.02 -30.82 49.09 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.435 1.494 . . . . 71.310000000000002 110.384 175.619 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.07 -32.87 16.72 Favored 'General case' 0 C--N 1.341 0.23 0 C-N-CA 126.57 1.948 . . . . 71.420000000000002 113.255 -171.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.8 mmtt -108.29 -32.97 7.25 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 118.327 -0.844 . . . . 54.25 110.946 175.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.36 -47.35 66.18 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.189 0.596 . . . . 64.420000000000002 110.7 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -57.01 -37.16 71.3 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 119.095 -0.478 . . . . 43.409999999999997 112.13 -178.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -80.23 -43.31 21.64 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.258 1.023 . . . . 74.140000000000001 111.532 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.15 -38.84 80.66 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 122.36 1.076 . . . . 72.439999999999998 109.194 178.319 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.534 HD23 ' HB2' ' A' ' 80' ' ' ALA . 9.2 tp -102.55 21.16 15.75 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 128.109 2.564 . . . . 61.119999999999997 111.071 -175.582 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 47.2 tt0 -52.48 114.95 1.54 Allowed 'General case' 0 C--O 1.233 0.234 0 C-N-CA 125.734 1.613 . . . . 63.130000000000003 109.919 -177.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.94 -3.66 81.03 Favored Glycine 0 CA--C 1.532 1.111 0 CA-C-O 118.432 -1.205 . . . . 71.340000000000003 113.112 175.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -118.59 3.74 11.73 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 126.701 2.001 . . . . 60.219999999999999 111.893 -172.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.534 ' HB2' HD23 ' A' ' 76' ' ' LEU . . . -142.68 173.18 11.77 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 126.765 2.026 . . . . 72.230000000000004 106.868 173.317 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -120.47 161.13 21.78 Favored 'General case' 0 C--O 1.24 0.554 0 N-CA-C 105.764 -1.939 . . . . 64.430000000000007 105.764 163.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -55.28 -53.65 53.45 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 123.589 0.756 . . . . 63.039999999999999 110.052 174.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -67.43 -19.25 65.35 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.41 -0.359 . . . . 75.209999999999994 110.655 -174.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 19.6 m -87.5 -39.7 14.94 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 124.788 1.235 . . . . 75.310000000000002 111.504 178.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 89.2 mt -56.79 -55.41 20.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-N 121.636 2.016 . . . . 75.439999999999998 108.377 171.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.65 -7.91 8.65 Favored 'General case' 0 N--CA 1.462 0.166 0 N-CA-C 112.553 0.575 . . . . 73.209999999999994 112.553 -179.107 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -122.5 42.26 3.21 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 125.567 1.547 . . . . 54.310000000000002 107.958 176.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -118.53 -41.27 2.83 Favored 'General case' 0 C--N 1.341 0.207 0 O-C-N 121.648 -0.658 . . . . 55.149999999999999 111.578 166.115 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -63.7 -44.51 93.45 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.28 0.632 . . . . 71.230000000000004 111.421 -175.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 42.2 t -67.76 -31.28 51.64 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 C-N-CA 125.332 1.453 . . . . 64.129999999999995 111.839 179.16 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.69 -60.36 3.78 Favored 'General case' 0 C--O 1.231 0.126 0 O-C-N 120.561 -1.337 . . . . 72.420000000000002 109.821 -169.266 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.88 16.9 1.68 Allowed 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 124.383 1.073 . . . . 75.530000000000001 112.103 -178.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 14.6 ttm180 -49.08 -44.78 42.29 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.451 1.101 . . . . 61.509999999999998 111.006 171.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.32 -58.62 7.52 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 118.713 -0.661 . . . . 31.219999999999999 109.961 175.095 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 5.8 m -52.57 -51.3 60.42 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.483 1.113 . . . . 74.5 110.538 -175.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -63.04 -23.68 67.56 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 113.682 0.994 . . . . 71.409999999999997 113.682 -176.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.2 -68.89 0.54 Allowed 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 106.064 -1.828 . . . . 71.530000000000001 106.064 165.679 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -44.97 -49.15 11.34 Favored 'General case' 0 CA--C 1.518 -0.278 0 C-N-CA 128.124 2.57 . . . . 71.519999999999996 113.197 -167.465 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -52.18 -35.72 49.71 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-O 117.919 -1.039 . . . . 75.530000000000001 112.27 -174.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.666 HD11 ' HG3' ' A' ' 28' ' ' ARG . 14.5 mm -57.94 -54.35 33.17 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 120.071 1.305 . . . . 75.519999999999996 111.056 -178.581 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 80.8 mt -62.63 -19.46 22.91 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 C-N-CA 123.67 0.788 . . . . 74.230000000000004 109.422 178.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.28 5.39 39.96 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 126.867 2.067 . . . . 52.240000000000002 113.153 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -121.26 11.82 10.87 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.94 1.696 . . . . 73.540000000000006 110.589 -175.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 35.2 mt . . . . . 0 C--O 1.248 1.007 0 C-N-CA 127.822 2.449 . . . . 71.219999999999999 110.733 -172.999 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . 0.456 ' HA ' HD13 ' A' ' 21' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.466 0.368 0 N-CA-C 115.069 1.507 . . . . 60.210000000000001 115.069 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -59.56 108.15 0.69 Allowed 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 127.666 2.386 . . . . 54.32 109.444 -173.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 55.8 -8.23 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 128.609 2.763 . . . . 64.430000000000007 115.806 -168.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 34.7 mttt -62.78 -23.29 67.15 Favored 'General case' 0 C--O 1.224 -0.254 0 C-N-CA 125.673 1.589 . . . . 73.150000000000006 113.137 -174.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -53.29 -29.36 32.92 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 119.651 1.114 . . . . 70.340000000000003 113.965 -176.01 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -97.83 2.62 49.53 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.715 0.806 . . . . 73.120000000000005 113.096 -178.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.4 m170 -125.45 -62.19 1.22 Allowed 'General case' 0 C--O 1.237 0.428 0 C-N-CA 125.929 1.692 . . . . 43.25 109.077 -170.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -85.93 112.14 20.89 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 106.793 -1.558 . . . . 74.010000000000005 106.793 174.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.53 -36.55 78.99 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-O 118.104 -0.951 . . . . 74.329999999999998 110.987 -175.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.494 ' H ' ' CD ' ' A' ' 20' ' ' GLU . 3.4 mp0 -54.5 -41.51 69.69 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.737 1.153 . . . . 65.129999999999995 111.368 -172.417 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.456 HD13 ' HA ' ' A' ' 11' ' ' HIS . 32.8 mt -64.01 -31.93 73.29 Favored 'General case' 0 C--O 1.233 0.234 0 O-C-N 121.599 -0.688 . . . . 72.349999999999994 111.989 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -84.83 -32.99 22.99 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 125.908 1.683 . . . . 74.040000000000006 110.861 176.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -55.14 -50.52 69.05 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 125.799 1.64 . . . . 70.040000000000006 109.183 -170.118 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.446 ' HE3' ' HA ' ' A' ' 21' ' ' LEU . 13.7 ptpt -52.05 -46.02 64.93 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.58 0.752 . . . . 74.439999999999998 111.992 175.247 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.21 -36.93 80.29 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 124.285 1.034 . . . . 43.509999999999998 111.016 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -71.49 -17.32 62.35 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.673 1.589 . . . . 64.129999999999995 111.201 176.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -123.97 25.58 7.89 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.573 1.949 . . . . 54.210000000000001 113.683 -169.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.321 0.0 OUTLIER -137.03 11.98 3.08 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 115.087 1.514 . . . . 74.010000000000005 115.087 177.421 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.8 ptt-85 -60.87 -18.71 57.77 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.955 1.465 . . . . 73.200000000000003 114.955 176.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -94.81 -24.02 17.24 Favored 'General case' 0 C--O 1.225 -0.217 0 CA-C-N 120.476 1.489 . . . . 72.140000000000001 110.671 172.157 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.39 -55.4 21.98 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 119.879 1.218 . . . . 73.209999999999994 111.132 -177.18 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.513 HD13 HE22 ' A' ' 99' ' ' GLN . 1.5 pt? -63.7 -20.7 65.93 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.07 -0.968 . . . . 72.120000000000005 113.307 -174.266 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.4 -38.33 90.65 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.37 1.468 . . . . 70.010000000000005 110.085 -176.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.48 -33.79 88.18 Favored Glycine 0 CA--C 1.527 0.82 0 CA-C-O 119.561 -0.577 . . . . 74.420000000000002 111.774 178.16 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -65.3 -38.33 89.87 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 117.866 0.833 . . . . 72.329999999999998 110.679 -177.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.482 ' CD1' ' HE2' ' A' ' 88' ' ' LYS . 28.8 t90 -60.51 -60.65 3.48 Favored 'General case' 0 C--O 1.228 -0.071 0 N-CA-C 108.291 -1.003 . . . . 74.030000000000001 108.291 177.366 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.05 -45.97 64.91 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 118.816 -0.611 . . . . 63.109999999999999 111.297 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -45.73 -57.5 4.21 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.209 1.004 . . . . 51.420000000000002 112.387 179.51 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.97 -32.08 80.84 Favored Glycine 0 CA--C 1.529 0.944 0 N-CA-C 112.069 -0.412 . . . . 75.299999999999997 112.069 -176.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 80.7 mt -71.07 -48.05 54.81 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 124.139 0.975 . . . . 74.409999999999997 110.66 178.212 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.6 mp -52.83 -31.66 40.23 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 124.859 1.263 . . . . 74.0 111.386 168.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 101.22 8.75 46.51 Favored Glycine 0 CA--C 1.526 0.781 0 C-N-CA 125.748 1.642 . . . . 55.240000000000002 112.394 -177.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.427 ' HE3' ' CD1' ' A' ' 51' ' ' TYR . 48.5 mttm -72.39 127.69 33.35 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 106.554 -1.647 . . . . 74.109999999999999 106.554 167.758 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 17.7 p -144.5 170.02 16.84 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.707 -0.849 . . . . 73.140000000000001 108.707 177.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.53 -131.84 15.19 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 109.205 -1.558 . . . . 73.049999999999997 109.205 -177.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -76.47 -30.8 57.45 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 118.843 -0.598 . . . . 64.120000000000005 111.003 177.347 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -57.6 -41.31 80.98 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 119.576 1.08 . . . . 72.329999999999998 111.585 -176.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.1 -46.52 90.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.645 -1.161 . . . . 64.310000000000002 111.387 174.405 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.8 ttt85 -57.48 -55.09 39.3 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 124.904 1.282 . . . . 71.409999999999997 109.165 178.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.65 -43.7 97.28 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 126.653 1.981 . . . . 52.43 111.376 -178.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.427 ' CD1' ' HE3' ' A' ' 43' ' ' LYS . 43.5 t80 -61.71 -44.39 97.02 Favored 'General case' 0 C--N 1.333 -0.13 0 O-C-N 121.709 -0.619 . . . . 74.409999999999997 109.995 174.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.53 -25.27 62.28 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 121.243 -0.91 . . . . 43.399999999999999 112.766 -175.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 37.7 mt -64.47 -21.04 66.54 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.766 1.227 . . . . 73.230000000000004 114.045 -173.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.9 t -100.71 -5.85 25.9 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.305 0.957 . . . . 74.299999999999997 111.009 -173.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 6.3 t -93.45 82.87 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 O-C-N 120.403 -1.436 . . . . 74.200000000000003 109.535 -164.112 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 3.7 m -132.93 87.8 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.96 0 C-N-CA 127.57 2.348 . . . . 64.5 110.156 -177.173 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.0 t -155.57 133.01 11.01 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 106.022 -1.844 . . . . 70.310000000000002 106.022 -169.369 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.2 t . . . . . 0 C--O 1.232 0.138 0 CA-C-N 120.327 1.421 . . . . 41.140000000000001 108.473 -172.743 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.0 t0 . . . . . 0 C--O 1.236 0.343 0 N-CA-C 113.01 0.744 . . . . 62.299999999999997 113.01 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.0 t -71.2 -62.33 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.219 0 C-N-CA 124.064 0.945 . . . . 70.319999999999993 108.662 177.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -60.12 -32.92 71.46 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-O 118.695 -0.669 . . . . 73.219999999999999 110.808 -165.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 25.7 ttp180 -48.42 -58.14 5.07 Favored 'General case' 0 CA--C 1.517 -0.311 0 C-N-CA 123.489 0.716 . . . . 74.230000000000004 110.955 172.254 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.5 mmtp -74.1 -43.6 57.02 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.884 -0.413 . . . . 62.299999999999997 109.884 -177.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.12 -58.72 7.4 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 124.071 0.948 . . . . 71.030000000000001 110.252 -171.266 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.19 -34.43 70.35 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 118.489 -0.767 . . . . 62.409999999999997 111.486 -175.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.62 -33.6 62.62 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 119.412 1.005 . . . . 64.120000000000005 112.299 176.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.49 -27.67 67.2 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.95 -1.094 . . . . 65.439999999999998 109.488 172.594 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.6 tp -120.48 22.85 11.12 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 127.013 2.125 . . . . 65.120000000000005 111.782 -165.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -48.45 114.18 0.91 Allowed 'General case' 0 C--O 1.233 0.199 0 C-N-CA 127.584 2.354 . . . . 72.040000000000006 108.829 173.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 77.54 6.22 86.56 Favored Glycine 0 CA--C 1.538 1.503 0 N-CA-C 114.636 0.614 . . . . 62.340000000000003 114.636 174.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 5.4 pttm -129.28 3.94 5.19 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 119.032 1.416 . . . . 71.310000000000002 113.556 -174.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -139.8 -162.44 1.34 Allowed 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.752 1.221 . . . . 74.230000000000004 108.426 164.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -136.17 147.19 47.58 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 125.595 1.558 . . . . 72.129999999999995 107.772 -176.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -69.16 -15.67 63.46 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.792 0.837 . . . . 65.409999999999997 113.239 -176.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -104.95 -2.08 25.01 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.57 1.148 . . . . 72.040000000000006 112.723 171.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.1 m -101.37 -35.9 9.06 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 121.059 -1.025 . . . . 74.420000000000002 112.982 -175.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 22.7 mt -55.09 -53.99 28.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 119.192 0.905 . . . . 45.509999999999998 109.342 -178.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -50.14 -51.36 43.93 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 124.026 0.931 . . . . 65.209999999999994 109.507 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -73.37 -9.13 58.38 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 124.404 1.082 . . . . 53.310000000000002 112.6 -172.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.482 ' HE2' ' CD1' ' A' ' 36' ' ' TRP . 57.6 tptt -84.79 -65.21 1.03 Allowed 'General case' 0 CA--C 1.519 -0.243 0 O-C-N 120.184 -1.573 . . . . 75.010000000000005 107.977 178.799 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 3.2 ptt? -61.74 -33.78 74.65 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 113.178 0.807 . . . . 73.439999999999998 113.178 -170.006 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 96.3 t -65.18 -49.19 80.41 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.223 0 C-N-CA 123.917 0.887 . . . . 74.329999999999998 109.497 176.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -62.06 -36.57 82.04 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 121.034 -1.041 . . . . 71.209999999999994 110.932 -173.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 83.2 mt -65.93 -6.11 11.43 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 125.424 1.489 . . . . 63.310000000000002 112.113 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -53.56 -51.82 61.69 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 120.191 1.359 . . . . 74.200000000000003 111.866 -178.009 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -78.95 -9.15 59.43 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.204 0.602 . . . . 70.299999999999997 112.563 -175.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 31.7 m -64.57 -38.21 90.22 Favored 'General case' 0 C--O 1.226 -0.165 0 O-C-N 120.827 -1.171 . . . . 62.439999999999998 110.108 -179.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.613 ' HA ' HE21 ' A' ' 99' ' ' GLN . . . -64.32 -27.06 68.77 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 120.834 -1.166 . . . . 62.039999999999999 113.276 -170.169 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 12.7 tpt85 -65.02 -53.96 37.87 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.53 1.132 . . . . 73.430000000000007 108.713 173.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -63.07 -56.18 19.17 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 124.385 1.074 . . . . 63.350000000000001 110.893 -177.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . 0.613 HE21 ' HA ' ' A' ' 96' ' ' ALA . 11.1 pt20 -63.67 -18.5 64.03 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.541 1.136 . . . . 70.129999999999995 113.27 -164.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 11.6 mm -87.09 -38.53 12.27 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.156 0 C-N-CA 125.767 1.627 . . . . 73.450000000000003 110.076 177.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 76.6 mt -71.84 -28.3 30.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 O-C-N 121.027 -1.046 . . . . 74.109999999999999 108.325 172.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 2.9 t -73.12 -43.72 61.28 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.57 0.748 . . . . 73.319999999999993 109.434 177.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -132.81 82.85 2.02 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 106.015 -1.846 . . . . 61.450000000000003 106.015 -174.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.757 HD12 ' H ' ' A' ' 104' ' ' ILE . 2.0 mp . . . . . 0 C--O 1.253 1.244 0 N-CA-C 106.626 -1.62 . . . . 71.010000000000005 106.626 173.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.206 -1.233 0 CA-C-O 117.748 -1.12 . . . . 73.129999999999995 113.362 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . 0.263 11.0 pt-20 43.99 58.36 3.69 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-N 121.088 1.767 . . . . 64.150000000000006 111.911 -177.422 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 55.84 12.21 0.83 Allowed 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 127.667 2.387 . . . . 70.120000000000005 116.219 -172.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 11.7 mmtt -70.61 -7.26 42.8 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 119.908 -1.745 . . . . 70.150000000000006 113.867 174.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.3 m-30 -59.71 -32.5 70.59 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 121.197 1.817 . . . . 65.540000000000006 111.122 176.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -73.95 15.6 0.29 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.642 1.177 . . . . 64.219999999999999 113.54 176.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -153.31 178.04 10.21 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 125.268 1.427 . . . . 70.329999999999998 109.774 -164.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 51.07 -162.46 0.07 Allowed 'General case' 0 C--O 1.236 0.362 0 C-N-CA 128.077 2.551 . . . . 70.239999999999995 111.974 168.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -145.46 8.98 1.19 Allowed 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 125.945 1.698 . . . . 73.030000000000001 110.971 169.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -72.14 -52.37 16.96 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-N 119.288 0.949 . . . . 64.409999999999997 109.725 169.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.903 ' H ' HD22 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -69.69 -46.02 66.99 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 124.658 1.183 . . . . 70.349999999999994 112.288 -169.578 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 39.4 t-20 -58.43 -41.43 85.01 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 124.218 1.007 . . . . 64.239999999999995 110.942 -175.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -47.98 -51.84 22.18 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.832 2.053 . . . . 71.340000000000003 111.748 177.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 3.7 mttp -55.51 -57.65 11.03 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 108.917 -0.772 . . . . 65.319999999999993 108.917 172.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.98 2.96 0.92 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.441 1.496 . . . . 72.129999999999995 113.983 -176.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -98.41 -28.47 13.62 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 120.504 -1.372 . . . . 72.25 110.388 171.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -128.87 34.7 4.43 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 120.714 -1.241 . . . . 62.109999999999999 113.451 -159.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.452 ' CD ' ' HB1' ' A' ' 96' ' ' ALA . 0.0 OUTLIER -125.12 -6.29 7.22 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 115.262 1.578 . . . . 73.140000000000001 115.262 -172.356 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 76.5 mtt85 -53.89 -22.93 11.06 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 120.109 1.322 . . . . 70.209999999999994 113.535 176.529 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -95.17 -17.6 21.64 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 113.151 0.797 . . . . 71.510000000000005 113.151 177.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.6 ttt180 -56.03 -56.37 21.6 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.548 1.067 . . . . 64.430000000000007 110.784 -179.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -70.67 -16.28 62.79 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 114.085 1.142 . . . . 74.329999999999998 114.085 -176.156 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 12.4 mt -61.9 -25.9 67.84 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.564 1.074 . . . . 74.450000000000003 110.521 167.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.13 -37.42 92.83 Favored Glycine 0 N--CA 1.442 -0.947 0 CA-C-O 119.268 -0.74 . . . . 43.109999999999999 111.963 173.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -65.84 -27.64 68.39 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 118.544 1.172 . . . . 73.239999999999995 110.694 179.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 28.9 t90 -71.77 -62.14 1.53 Allowed 'General case' 0 CA--C 1.534 0.354 0 O-C-N 121.213 -0.929 . . . . 70.439999999999998 109.25 171.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -54.85 -48.95 72.23 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 113.692 0.997 . . . . 63.240000000000002 113.692 -176.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -47.58 -50.38 24.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 119.252 0.933 . . . . 72.340000000000003 111.731 175.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -65.34 -7.13 31.08 Favored Glycine 0 CA--C 1.534 1.265 0 C-N-CA 125.337 1.446 . . . . 71.409999999999997 114.611 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 18.3 mt -102.93 -45.85 4.84 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 126.316 1.846 . . . . 63.520000000000003 109.731 172.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.407 HD22 ' CZ ' ' A' ' 51' ' ' TYR . 1.8 mp -62.33 -10.59 11.6 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 127.099 2.16 . . . . 63.119999999999997 114.805 -176.05 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 89.03 34.41 8.88 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 110.875 -0.89 . . . . 71.310000000000002 110.875 -179.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 16.2 mttm -117.45 143.98 45.48 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 106.755 -1.572 . . . . 63.509999999999998 106.755 172.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 10.2 p -141.92 172.18 13.04 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 107.128 -1.434 . . . . 64.439999999999998 107.128 167.13 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 60.73 -142.98 48.3 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 111.742 -0.543 . . . . 73.099999999999994 111.742 175.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -60.98 -32.02 71.59 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.05 0.389 . . . . 64.400000000000006 112.05 -177.105 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -59.92 -47.19 86.8 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 124.514 1.126 . . . . 73.5 111.199 177.404 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.59 -45.42 94.17 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.29 -0.868 . . . . 71.120000000000005 110.69 172.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.9 ttt180 -58.59 -50.29 74.34 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 123.995 0.918 . . . . 74.409999999999997 111.083 -176.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.19 -48.74 80.44 Favored 'General case' 0 C--O 1.233 0.184 0 C-N-CA 126.984 2.113 . . . . 73.430000000000007 111.412 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.407 ' CZ ' HD22 ' A' ' 41' ' ' LEU . 72.3 t80 -63.67 -37.95 89.28 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.474 -0.766 . . . . 73.519999999999996 110.656 176.688 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.2 -14.25 61.59 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 120.858 -1.151 . . . . 75.439999999999998 112.741 177.259 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 22.8 mt -70.08 -31.98 69.82 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 120.169 1.35 . . . . 63.32 110.405 172.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 17.0 p -90.35 -20.06 23.3 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 120.929 -1.107 . . . . 43.310000000000002 111.247 -171.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 57.5 t -68.85 88.35 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 125.787 1.635 . . . . 71.329999999999998 108.615 168.184 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 20.1 t -134.83 138.97 48.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 106.773 -1.565 . . . . 65.230000000000004 106.773 148.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 66.3 p -154.47 167.99 28.19 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 128.437 2.695 . . . . 74.420000000000002 107.362 175.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 CA--C 1.531 0.243 0 C-N-CA 125.997 1.719 . . . . 71.049999999999997 106.726 169.625 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.453 -0.311 0 CA-C-O 118.316 -0.85 . . . . 42.130000000000003 110.907 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.5 p -79.13 -53.62 13.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 C-N-CA 123.559 0.744 . . . . 64.430000000000007 110.536 176.483 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -56.62 -35.42 68.28 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-O 118.745 -0.645 . . . . 73.319999999999993 109.855 -175.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -48.05 -59.27 3.5 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.078 0.951 . . . . 64.319999999999993 111.578 174.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -72.44 -37.93 68.44 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 118.819 -0.61 . . . . 73.340000000000003 110.058 -175.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.58 -47.27 70.27 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 119.152 0.887 . . . . 73.140000000000001 110.544 -176.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.69 -16.76 63.92 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.473 1.109 . . . . 72.319999999999993 111.121 179.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -77.28 -47.42 20.13 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.013 0.824 . . . . 60.109999999999999 110.843 168.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.95 -24.08 67.71 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.473 1.109 . . . . 73.219999999999999 111.203 177.467 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 79.3 mt -117.17 31.43 6.75 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 126.345 1.858 . . . . 74.450000000000003 111.478 177.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -55.78 117.92 4.09 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 107.211 -1.403 . . . . 72.120000000000005 107.211 168.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 95.63 -10.54 68.76 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 126.317 1.913 . . . . 55.219999999999999 113.713 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.2 mtpp -126.7 1.52 6.78 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 119.696 1.748 . . . . 63.450000000000003 113.756 -165.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -151.0 174.31 13.29 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 119.043 0.838 . . . . 73.239999999999995 110.356 172.27 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -140.47 168.82 18.89 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 127.26 2.224 . . . . 52.420000000000002 105.798 174.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -57.98 -46.16 85.62 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.007 0.923 . . . . 61.109999999999999 111.64 -171.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -76.35 -16.47 59.74 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-O 119.485 -0.293 . . . . 73.420000000000002 110.903 -174.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 95.1 m -70.14 -56.81 5.91 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 107.947 -1.131 . . . . 74.549999999999997 107.947 165.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 47.8 mt -60.38 -55.96 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 C-N-CA 124.482 1.113 . . . . 74.340000000000003 109.938 -171.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.69 -28.08 63.47 Favored 'General case' 0 N--CA 1.456 -0.126 0 O-C-N 122.076 -0.39 . . . . 73.439999999999998 111.524 -175.01 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.62 -46.88 13.76 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.794 0.837 . . . . 74.420000000000002 110.285 -179.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.52 -40.52 75.18 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 122.939 0.495 . . . . 73.140000000000001 110.329 -165.292 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 9.5 mtt -61.26 -43.86 98.18 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 119.143 -0.456 . . . . 61.310000000000002 110.845 -179.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 49.8 t -65.41 -34.89 73.53 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 125.18 1.392 . . . . 71.230000000000004 110.656 -176.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 -55.82 -54.65 41.9 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 108.748 -0.834 . . . . 74.519999999999996 108.748 178.072 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 42.6 mt -71.89 -1.97 16.24 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 126.563 1.945 . . . . 62.119999999999997 112.601 -172.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 27.5 ttp180 -57.13 -52.15 66.46 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 123.912 0.885 . . . . 74.25 110.625 -175.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.85 -49.79 73.51 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.355 1.062 . . . . 71.530000000000001 110.028 177.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.8 m -52.63 -49.99 64.05 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 129.563 3.145 . . . . 61.439999999999998 109.927 -174.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.452 ' HB1' ' CD ' ' A' ' 28' ' ' ARG . . . -53.3 -34.88 59.15 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.577 0.751 . . . . 65.540000000000006 111.637 -179.025 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 9.1 mtm180 -79.01 -45.58 19.93 Favored 'General case' 0 C--O 1.233 0.233 0 O-C-N 121.107 -0.995 . . . . 72.150000000000006 109.032 -177.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -60.35 -39.24 86.46 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 125.0 1.32 . . . . 72.150000000000006 111.164 178.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -56.54 -42.49 78.61 Favored 'General case' 0 C--O 1.221 -0.43 0 C-N-CA 124.577 1.151 . . . . 64.239999999999995 112.715 -177.033 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.5 mm -58.62 -44.9 90.6 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-N 119.996 1.271 . . . . 74.109999999999999 108.979 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 86.9 mt -73.46 -9.72 13.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 124.809 1.244 . . . . 72.430000000000007 110.056 -179.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -109.38 16.77 22.1 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.918 1.687 . . . . 45.049999999999997 109.705 177.105 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -122.63 18.11 10.37 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.51 1.924 . . . . 72.450000000000003 108.491 177.03 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 61.8 mt . . . . . 0 C--O 1.251 1.16 0 CA-C-O 115.859 -2.02 . . . . 70.430000000000007 106.593 173.951 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.3 ttm . . . . . 0 N--CA 1.473 0.709 0 CA-C-O 118.636 -0.697 . . . . 72.409999999999997 112.14 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 67.0 p -78.56 148.85 33.19 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 120.548 1.522 . . . . 62.439999999999998 111.887 -167.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -83.03 78.57 9.56 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 124.498 1.119 . . . . 65.239999999999995 108.354 170.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -160.8 162.08 32.21 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 123.483 0.713 . . . . 75.230000000000004 109.283 159.29 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -169.55 122.47 0.74 Allowed 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 129.298 3.039 . . . . 60.340000000000003 104.087 167.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -119.46 -22.05 7.17 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 119.817 1.19 . . . . 75.319999999999993 113.144 -175.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 2.0 ttt-85 59.65 -164.58 0.21 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.109 1.363 . . . . 64.349999999999994 114.679 160.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.5 164.51 4.41 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.155 0.982 . . . . 72.129999999999995 109.903 168.033 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.4 163.49 14.17 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.136 -0.977 . . . . 72.420000000000002 109.776 166.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -153.35 75.44 1.06 Allowed 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.202 1.401 . . . . 75.25 110.186 -178.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -75.9 14.64 0.64 Allowed 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 116.792 2.145 . . . . 72.230000000000004 116.792 -175.013 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -45.93 106.6 0.08 Allowed 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.017 1.727 . . . . 71.450000000000003 112.714 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 54.57 -5.32 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 128.525 2.73 . . . . 73.510000000000005 116.392 -171.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 48.7 mttt -58.0 -26.97 63.07 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 127.071 2.148 . . . . 62.149999999999999 113.952 -168.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -63.73 -9.42 14.21 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 114.106 1.15 . . . . 74.530000000000001 114.106 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -132.92 39.09 3.34 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 119.336 0.971 . . . . 24.440000000000001 110.143 173.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -146.44 -65.1 0.29 Allowed 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 107.057 -1.46 . . . . 64.420000000000002 107.057 169.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -67.04 158.05 31.99 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 127.052 2.141 . . . . 61.219999999999999 111.004 -172.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -89.04 -57.75 2.79 Favored 'General case' 0 C--O 1.223 -0.311 0 N-CA-C 108.811 -0.811 . . . . 73.540000000000006 108.811 163.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -49.58 -50.96 40.38 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.701 1.0 . . . . 40.210000000000001 113.701 -162.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 15.0 mt -76.43 -26.56 55.6 Favored 'General case' 0 C--O 1.237 0.427 0 N-CA-C 113.509 0.929 . . . . 75.129999999999995 113.509 -178.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -65.69 -51.35 60.11 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.975 1.31 . . . . 72.510000000000005 107.591 175.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -44.4 -49.24 9.76 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 128.936 2.895 . . . . 73.450000000000003 111.359 -171.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.1 pttp -53.7 -51.61 62.72 Favored 'General case' 0 C--O 1.233 0.234 0 O-C-N 121.258 -0.901 . . . . 62.539999999999999 111.984 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.85 -30.4 50.97 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 113.283 0.845 . . . . 61.450000000000003 113.283 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -53.56 -41.25 66.3 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.704 1.602 . . . . 60.119999999999997 108.692 176.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.18 -86.03 0.32 Allowed 'General case' 0 C--N 1.345 0.389 0 CA-C-O 118.674 -0.679 . . . . 54.229999999999997 109.273 178.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.455 ' HB3' ' HB1' ' A' ' 96' ' ' ALA . 0.1 OUTLIER 48.61 -24.98 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.201 1 C-N-CA 132.121 4.168 . . . . 74.439999999999998 118.559 179.02 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.99 -36.81 13.37 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 128.516 2.726 . . . . 75.409999999999997 114.202 -167.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -107.67 -19.65 13.48 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.159 0.984 . . . . 72.530000000000001 110.155 -174.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.73 -32.16 71.44 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.973 1.309 . . . . 73.129999999999995 110.969 -176.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.503 ' CD1' HD23 ' A' ' 92' ' ' LEU . 0.2 OUTLIER -90.17 -5.71 56.14 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.912 0.885 . . . . 75.239999999999995 112.76 -175.288 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.432 HD11 ' HB2' ' A' ' 89' ' ' MET . 13.1 mt -81.19 -28.44 34.93 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 119.383 0.992 . . . . 60.340000000000003 113.464 -170.527 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -69.92 -34.32 71.18 Favored Glycine 0 C--O 1.223 -0.572 0 N-CA-C 109.089 -1.604 . . . . 51.25 109.089 169.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -65.2 -19.29 65.9 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 118.628 1.214 . . . . 62.43 112.295 176.391 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 32.1 t90 -77.13 -66.21 0.85 Allowed 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 125.594 1.558 . . . . 61.240000000000002 109.363 167.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.41 -31.18 61.65 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 118.407 -0.806 . . . . 61.119999999999997 112.805 -174.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -46.76 -63.29 1.06 Allowed 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 125.656 1.582 . . . . 34.299999999999997 110.567 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -55.63 -44.86 86.18 Favored Glycine 0 C--N 1.336 0.535 0 N-CA-C 111.235 -0.746 . . . . 55.030000000000001 111.235 -178.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 28.4 mt -62.85 -36.03 81.91 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.491 0.716 . . . . 73.439999999999998 111.814 -177.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 77.8 mt -82.7 1.17 39.96 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.114 1.766 . . . . 62.109999999999999 112.495 176.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 84.24 12.18 76.74 Favored Glycine 0 CA--C 1.527 0.797 0 C-N-CA 125.202 1.382 . . . . 74.450000000000003 113.915 177.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -87.78 133.07 33.94 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.852 1.261 . . . . 75.209999999999994 107.969 -177.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 33.0 p -140.84 167.84 21.22 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 125.966 1.706 . . . . 51.539999999999999 107.883 -179.025 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 56.19 -134.69 50.43 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 111.476 -0.65 . . . . 55.210000000000001 111.476 175.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -68.3 -26.96 65.9 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 117.59 0.695 . . . . 74.25 111.542 178.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.24 -35.56 77.57 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 123.606 0.762 . . . . 72.219999999999999 110.474 176.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -75.61 -48.02 24.05 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.178 -0.675 . . . . 54.149999999999999 109.178 173.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -62.49 -47.57 83.37 Favored 'General case' 0 C--O 1.226 -0.141 0 N-CA-C 109.846 -0.427 . . . . 71.310000000000002 109.846 -168.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.87 -42.83 84.96 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.454 1.102 . . . . 73.450000000000003 110.511 -177.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 31.6 t80 -58.32 -46.33 86.4 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 122.669 0.387 . . . . 72.109999999999999 110.274 175.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.17 -36.44 68.33 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 121.465 -0.772 . . . . 45.409999999999997 111.75 178.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 44.2 mt -75.17 10.14 1.68 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.292 1.437 . . . . 55.009999999999998 112.259 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.7 t -133.68 34.52 3.42 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 120.098 1.317 . . . . 72.430000000000007 111.248 169.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 81.4 t -132.18 85.33 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 O-C-N 121.081 -1.012 . . . . 72.120000000000005 108.853 177.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 16.4 t -151.1 122.54 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 124.615 1.166 . . . . 54.530000000000001 109.5 170.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 6.5 t -149.17 -38.97 0.15 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.202 1.001 . . . . 75.439999999999998 111.445 162.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.5 m 74.84 41.68 0.31 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.312 1.845 . . . . 73.239999999999995 112.958 -176.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -66.4 179.98 0.91 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.889 2.076 . . . . 64.409999999999997 112.872 179.145 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER 67.32 60.08 0.5 Allowed 'General case' 0 C--O 1.237 0.412 0 C-N-CA 126.761 2.024 . . . . 74.239999999999995 109.774 163.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -137.18 109.41 7.29 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 123.558 0.743 . . . . 61.119999999999997 109.189 165.174 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 66.86 145.39 0.1 OUTLIER Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 128.516 2.726 . . . . 73.129999999999995 110.889 -170.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -71.3 129.79 16.5 Favored 'Trans proline' 0 C--N 1.352 0.737 0 CA-C-N 121.887 1.71 . . . . 63.210000000000001 110.785 -177.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 170.05 -11.01 0.05 OUTLIER Glycine 0 CA--C 1.527 0.841 0 CA-C-O 118.02 -1.433 . . . . 72.129999999999995 114.174 172.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -132.97 -75.28 0.49 Allowed 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 119.586 1.693 . . . . 65.109999999999999 109.34 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 49.18 82.94 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.576 1.95 . . . . 72.340000000000003 113.089 173.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.514 ' OD2' ' HE2' ' A' ' 71' ' ' LYS . 0.6 OUTLIER -118.56 -41.53 2.81 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 118.777 -0.63 . . . . 74.329999999999998 110.225 170.52 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 72.4 t -57.07 -43.81 81.89 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 CA-C-N 120.304 1.411 . . . . 73.409999999999997 111.342 -173.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -56.91 -53.97 51.89 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.694 1.198 . . . . 54.049999999999997 109.185 175.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 26.8 ttm-85 -53.83 -42.18 68.19 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 125.679 1.591 . . . . 74.150000000000006 112.067 178.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.514 ' HE2' ' OD2' ' A' ' 67' ' ' ASP . 5.5 mptp? -75.25 -47.61 27.25 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 118.322 0.51 . . . . 74.329999999999998 109.749 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 16.3 mt -59.55 -44.33 93.27 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 117.689 -1.148 . . . . 74.510000000000005 110.444 -179.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.22 -18.79 64.86 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.988 1.267 . . . . 60.109999999999999 112.364 -177.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -87.4 -52.67 5.24 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.513 1.125 . . . . 62.240000000000002 110.371 170.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -60.18 -48.08 83.25 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 121.044 -1.035 . . . . 72.129999999999995 110.012 -174.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.8 tp -91.32 15.62 11.71 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 130.348 3.459 . . . . 64.340000000000003 111.577 -175.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -55.87 109.87 0.64 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.488 1.515 . . . . 72.319999999999993 109.88 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 110.05 -4.38 30.25 Favored Glycine 0 CA--C 1.528 0.847 0 C-N-CA 125.425 1.488 . . . . 52.409999999999997 112.511 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -133.05 -5.76 3.08 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.046 1.338 . . . . 73.319999999999993 113.275 -171.463 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -146.33 130.07 17.08 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.507 0.67 . . . . 52.539999999999999 110.602 169.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.39 161.13 25.88 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 126.262 1.825 . . . . 74.409999999999997 107.616 164.498 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -58.54 -45.13 89.56 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.973 0.892 . . . . 71.310000000000002 109.35 175.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -70.52 -27.89 64.53 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.689 0.796 . . . . 74.120000000000005 112.373 179.294 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 47.6 m -68.28 -36.19 79.0 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.665 0.786 . . . . 65.420000000000002 110.209 175.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 10.4 mt -69.65 -60.83 2.05 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 CA-C-N 119.937 1.244 . . . . 60.439999999999998 108.566 169.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.55 -18.5 65.4 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 114.173 1.175 . . . . 73.120000000000005 114.173 -164.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -91.91 -31.27 15.73 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 119.208 0.913 . . . . 62.240000000000002 110.419 178.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -64.34 -66.86 0.49 Allowed 'General case' 0 CA--C 1.514 -0.419 0 CA-C-N 119.21 0.914 . . . . 71.519999999999996 111.028 -173.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.432 ' HB2' HD11 ' A' ' 33' ' ' LEU . 5.3 ptt? -66.66 -14.91 63.06 Favored 'General case' 0 N--CA 1.462 0.162 0 N-CA-C 113.592 0.96 . . . . 54.149999999999999 113.592 -162.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 37.4 t -45.67 -49.2 4.29 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 C-N-CA 127.019 2.128 . . . . 72.140000000000001 111.794 166.391 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -82.0 -21.26 37.16 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 119.502 1.046 . . . . 72.510000000000005 111.838 -169.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.503 HD23 ' CD1' ' A' ' 32' ' ' LEU . 7.0 mp -66.47 -7.37 19.19 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 126.855 2.062 . . . . 73.430000000000007 111.454 -168.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 30.3 mtp180 -54.39 -42.17 70.08 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 122.95 0.5 . . . . 71.340000000000003 110.408 168.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.3 -52.59 8.93 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.617 0.767 . . . . 61.420000000000002 110.293 174.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.0 m -52.84 -29.59 28.77 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.048 0.939 . . . . 74.530000000000001 112.039 -177.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.455 ' HB1' ' HB3' ' A' ' 28' ' ' ARG . . . -55.18 -50.87 68.25 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 125.647 1.579 . . . . 44.520000000000003 114.135 177.65 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 9.3 ptt180 -75.47 -41.56 55.29 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 109.566 -0.531 . . . . 74.230000000000004 109.566 178.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -48.78 -55.87 10.28 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 126.687 1.995 . . . . 60.210000000000001 111.711 177.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -64.28 -25.39 68.03 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.792 0.724 . . . . 73.140000000000001 112.523 -174.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 10.8 mm -77.36 -44.58 30.26 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.254 0 O-C-N 120.707 -1.246 . . . . 71.340000000000003 109.452 176.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 91.8 mt -71.67 -10.46 13.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 C-N-CA 124.844 1.258 . . . . 75.510000000000005 110.501 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 10.7 t -86.72 -56.14 3.54 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.926 1.29 . . . . 60.119999999999997 108.65 170.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 66.8 mt-10 -101.61 56.87 0.83 Allowed 'General case' 0 C--O 1.236 0.385 0 N-CA-C 106.881 -1.525 . . . . 65.430000000000007 106.881 -168.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 83.6 mt . . . . . 0 C--O 1.25 1.107 0 C-N-CA 123.816 0.847 . . . . 71.430000000000007 109.038 -172.202 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.6 mtm . . . . . 0 N--CA 1.476 0.84 0 CA-C-O 117.38 -1.295 . . . . 73.430000000000007 107.513 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 14.1 t -148.89 168.23 23.59 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 120.058 1.299 . . . . 74.310000000000002 108.782 -179.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.0 p -118.23 64.66 0.76 Allowed 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 126.787 2.035 . . . . 74.450000000000003 106.475 174.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -90.26 11.07 22.31 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.867 1.267 . . . . 70.310000000000002 110.918 -179.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -73.01 174.43 7.89 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.814 0.846 . . . . 65.540000000000006 110.804 -176.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -130.47 -2.48 4.34 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.514 1.526 . . . . 73.310000000000002 112.513 179.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -151.35 -174.62 4.88 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.278 0.945 . . . . 72.549999999999997 113.196 -168.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -67.13 147.67 52.82 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 122.253 1.025 . . . . 65.510000000000005 109.868 172.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -128.9 -66.33 0.83 Allowed 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 124.804 1.242 . . . . 70.219999999999999 108.286 175.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -137.11 -2.12 2.09 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 115.737 1.755 . . . . 74.420000000000002 115.737 -155.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . 0.327 1.1 p-80 46.27 -165.53 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.017 1.327 . . . . 73.400000000000006 113.637 168.486 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 44.75 90.38 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.358 1.863 . . . . 70.439999999999998 113.988 177.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 60.69 -3.54 0.14 Allowed 'General case' 0 C--O 1.237 0.397 0 C-N-CA 128.2 2.6 . . . . 74.540000000000006 115.786 -166.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -60.56 -13.73 15.8 Favored 'General case' 0 C--O 1.218 -0.594 0 O-C-N 120.488 -1.382 . . . . 74.340000000000003 112.507 159.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -48.6 -41.05 29.61 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.868 1.213 . . . . 72.510000000000005 112.198 163.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -82.54 -41.83 19.15 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 118.401 0.546 . . . . 54.399999999999999 111.217 174.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -72.41 -44.63 62.18 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.245 1.018 . . . . 54.399999999999999 112.704 -167.507 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -120.08 105.62 11.19 Favored 'General case' 0 CA--C 1.517 -0.316 0 C-N-CA 127.088 2.155 . . . . 62.43 105.59 -175.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.36 -14.52 56.81 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 113.087 0.773 . . . . 51.200000000000003 113.087 -172.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -64.11 -35.72 81.67 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.952 0.901 . . . . 64.129999999999995 109.683 175.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.8 mt -70.85 -37.69 73.13 Favored 'General case' 0 C--O 1.234 0.265 0 O-C-N 120.881 -1.137 . . . . 74.409999999999997 111.086 174.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -60.01 -50.5 73.51 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 118.946 -0.55 . . . . 74.120000000000005 110.153 172.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -52.61 -56.91 12.08 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 126.103 1.761 . . . . 74.140000000000001 109.68 -178.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -45.12 -49.14 12.02 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 124.731 1.212 . . . . 63.439999999999998 111.407 -179.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -76.82 -40.18 48.83 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.055 0.761 . . . . 62.119999999999997 113.055 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -66.78 -19.03 65.66 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.063 -1.023 . . . . 73.5 110.256 178.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -90.15 13.88 13.93 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 127.656 2.382 . . . . 72.430000000000007 112.289 170.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.6 mmt85 -108.77 -30.37 8.2 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 120.065 1.302 . . . . 71.510000000000005 112.411 172.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.3 ptt85 -57.43 -15.95 8.13 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 115.582 1.697 . . . . 65.510000000000005 115.582 -169.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -121.3 -15.09 8.2 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 126.218 1.807 . . . . 74.140000000000001 111.168 -178.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.62 -22.56 65.33 Favored 'General case' 0 N--CA 1.471 0.591 0 O-C-N 120.698 -1.251 . . . . 74.239999999999995 111.64 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.447 HD12 ' H ' ' A' ' 32' ' ' LEU . 0.1 OUTLIER -106.17 -14.17 15.22 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.575 1.55 . . . . 71.150000000000006 114.128 -171.873 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.52 -34.35 17.01 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 125.422 1.489 . . . . 53.140000000000001 113.355 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -61.81 -24.34 64.42 Favored Glycine 0 CA--C 1.526 0.732 0 CA-C-O 118.386 -1.23 . . . . 63.140000000000001 113.379 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -65.24 -31.0 71.93 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 120.687 2.243 . . . . 63.43 112.488 -177.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.431 ' CD1' ' HE3' ' A' ' 88' ' ' LYS . 22.9 t90 -63.8 -72.37 0.14 Allowed 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 125.6 1.56 . . . . 73.239999999999995 108.492 175.02 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.47 -17.13 63.56 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 124.916 1.287 . . . . 60.140000000000001 113.917 -176.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -54.34 -57.41 11.37 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 119.352 0.978 . . . . 60.350000000000001 109.066 173.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.65 -38.25 93.49 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 111.347 -0.701 . . . . 75.109999999999999 111.347 -179.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.5 mp -61.22 -38.37 86.37 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.495 -1.003 . . . . 74.040000000000006 111.064 178.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 95.6 mt -89.14 5.84 42.76 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 127.04 2.136 . . . . 73.450000000000003 113.068 176.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 74.54 9.65 82.18 Favored Glycine 0 CA--C 1.534 1.226 0 C-N-CA 125.388 1.47 . . . . 44.240000000000002 114.424 177.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.9 mttt -85.82 137.96 32.4 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 119.341 1.57 . . . . 52.549999999999997 106.983 173.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 37.0 p -138.85 -178.0 5.13 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.664 -0.865 . . . . 75.230000000000004 108.664 168.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 47.47 -117.28 3.22 Favored Glycine 0 CA--C 1.524 0.619 0 C-N-CA 125.288 1.423 . . . . 31.239999999999998 112.941 174.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -82.65 -16.59 47.69 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.015 1.726 . . . . 75.140000000000001 112.686 -172.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -76.14 -48.8 19.27 Favored 'General case' 0 CA--C 1.512 -0.486 0 O-C-N 120.912 -1.118 . . . . 62.240000000000002 109.016 169.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -56.81 -42.99 80.51 Favored 'General case' 0 N--CA 1.445 -0.72 0 N-CA-C 108.748 -0.834 . . . . 61.119999999999997 108.748 175.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.3 ttm-85 -51.42 -47.72 62.91 Favored 'General case' 0 N--CA 1.437 -1.107 0 N-CA-C 112.96 0.726 . . . . 75.329999999999998 112.96 173.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.69 -49.25 66.69 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 118.091 0.405 . . . . 73.450000000000003 110.435 -178.037 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -52.34 -44.93 65.45 Favored 'General case' 0 N--CA 1.457 -0.093 0 C-N-CA 123.435 0.694 . . . . 72.230000000000004 110.696 175.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.46 -30.82 63.36 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 118.421 -0.8 . . . . 43.409999999999997 112.623 -174.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 18.0 mt -75.5 -3.89 36.63 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.2 1.0 . . . . 64.25 111.861 -175.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.6 t -133.3 49.27 2.31 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.589 1.156 . . . . 63.149999999999999 109.575 179.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 2.0 t -127.98 12.98 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 O-C-N 120.857 -1.152 . . . . 71.450000000000003 110.669 173.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 4.5 m -74.24 53.21 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 125.938 1.695 . . . . 64.549999999999997 112.144 176.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.1 t -79.76 60.82 3.52 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.275 1.43 . . . . 65.140000000000001 108.912 178.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.3 m 63.8 -151.87 0.31 Allowed 'General case' 0 C--O 1.238 0.497 0 N-CA-C 109.919 -0.4 . . . . 64.25 109.919 169.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -133.45 168.29 18.89 Favored 'General case' 0 CA--C 1.516 -0.35 0 O-C-N 120.743 -1.223 . . . . 74.310000000000002 108.392 161.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -67.66 -11.3 57.95 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 112.777 0.658 . . . . 70.209999999999994 112.777 168.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -81.57 54.54 2.39 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.679 1.191 . . . . 74.540000000000006 109.574 170.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -138.69 163.75 44.6 Favored Pre-proline 0 CA--C 1.541 0.618 0 C-N-CA 126.406 1.882 . . . . 63.210000000000001 109.826 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -83.49 63.2 7.44 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 123.108 2.539 . . . . 62.509999999999998 110.494 -176.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 168.68 61.81 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 N-CA-C 110.21 -1.156 . . . . 71.120000000000005 110.21 -172.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -69.98 71.72 0.39 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.727 2.011 . . . . 70.519999999999996 108.697 174.091 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -164.08 -58.92 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 128.042 2.537 . . . . 70.400000000000006 105.819 170.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.68 -28.53 69.99 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 121.471 -0.768 . . . . 64.25 112.431 -170.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 78.3 t -57.99 -43.62 85.25 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 123.823 0.849 . . . . 65.530000000000001 110.315 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -76.27 -32.51 58.85 Favored 'General case' 0 C--O 1.233 0.224 0 O-C-N 121.118 -0.989 . . . . 74.109999999999999 109.546 -179.084 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -50.56 -50.38 53.71 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 125.071 1.348 . . . . 71.219999999999999 112.089 -172.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -71.7 -23.6 61.67 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 119.301 0.955 . . . . 63.520000000000003 111.515 -171.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 9.5 mt -74.75 -61.31 1.92 Allowed 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.25 -1.019 . . . . 74.219999999999999 108.25 168.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.12 -37.6 64.5 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.293 1.037 . . . . 53.039999999999999 113.09 -173.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.18 -38.79 87.78 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 123.29 0.636 . . . . 74.209999999999994 111.491 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -74.52 -56.88 4.35 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 122.858 1.313 . . . . 72.25 108.43 175.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.4 tp -77.15 16.67 0.54 Allowed 'General case' 0 CA--C 1.534 0.329 1 C-N-CA 131.836 4.054 . . . . 64.209999999999994 113.963 -168.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 55.6 tt0 -52.4 122.33 8.6 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 127.14 2.176 . . . . 70.540000000000006 110.464 -174.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 102.27 -15.43 56.3 Favored Glycine 0 CA--C 1.53 1.01 0 C-N-CA 127.249 2.357 . . . . 31.120000000000001 113.034 178.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 35.3 mtmt -126.06 -5.46 6.75 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 119.276 1.538 . . . . 70.120000000000005 114.88 -158.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -154.74 126.43 7.52 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 120.57 1.532 . . . . 73.349999999999994 110.026 171.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.14 163.52 27.77 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 124.72 1.208 . . . . 74.319999999999993 110.573 -178.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 77.0 mt-10 -48.56 -59.22 3.68 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 124.642 1.177 . . . . 73.340000000000003 110.433 170.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -68.29 -20.73 64.78 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.813 -0.631 . . . . 64.140000000000001 112.114 -175.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 18.8 m -80.16 -40.71 26.77 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.788 1.635 . . . . 61.210000000000001 110.032 176.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 77.4 mt -59.71 -56.56 16.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 C-N-CA 124.788 1.235 . . . . 64.299999999999997 107.689 173.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.81 -47.3 80.57 Favored 'General case' 0 C--N 1.341 0.199 0 O-C-N 123.614 0.571 . . . . 64.5 110.998 -174.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.54 -43.27 89.2 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.273 0.629 . . . . 54.439999999999998 111.559 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.431 ' HE3' ' CD1' ' A' ' 36' ' ' TRP . 12.3 tptp -66.7 -39.03 87.89 Favored 'General case' 0 C--O 1.223 -0.29 0 O-C-N 121.265 -0.897 . . . . 74.019999999999996 111.216 -176.003 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 18.0 ptp -72.14 -31.4 65.94 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 119.073 -1.051 . . . . 61.509999999999998 112.369 -174.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 71.9 t -49.97 -47.15 23.69 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 123.47 0.708 . . . . 65.109999999999999 109.233 167.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -50.58 -45.41 57.2 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.136 1.374 . . . . 62.329999999999998 113.501 -163.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -75.6 11.89 1.18 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.213 1.19 . . . . 65.420000000000002 114.213 -173.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 3.3 tpt85 -49.91 -53.07 28.38 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.844 1.258 . . . . 72.400000000000006 111.3 -178.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -63.01 -50.28 71.31 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 123.823 0.849 . . . . 61.210000000000001 109.999 175.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.8 m -50.18 -45.65 53.66 Favored 'General case' 0 C--N 1.333 -0.125 0 C-N-CA 125.912 1.685 . . . . 74.319999999999993 110.147 -173.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -54.63 -40.65 69.15 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 124.305 1.042 . . . . 71.150000000000006 112.676 -177.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -81.68 -40.32 23.01 Favored 'General case' 0 C--N 1.341 0.202 0 CA-C-O 117.463 -1.256 . . . . 74.140000000000001 111.929 172.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -52.35 -41.78 63.34 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 119.391 0.996 . . . . 73.439999999999998 110.834 -179.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 -56.27 -50.14 72.21 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 118.966 0.803 . . . . 73.120000000000005 112.024 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 43.8 mm -68.07 -42.74 85.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 123.353 0.661 . . . . 73.430000000000007 110.26 -175.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 24.1 mt -66.38 -21.14 28.25 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 N-CA-C 109.036 -0.727 . . . . 74.25 109.036 177.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 33.8 t -89.54 -6.07 56.68 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.584 1.154 . . . . 62.219999999999999 111.783 177.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -122.72 35.79 4.8 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 125.818 1.647 . . . . 72.030000000000001 108.812 -171.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 21.8 mm . . . . . 0 C--O 1.252 1.19 0 N-CA-C 107.46 -1.311 . . . . 74.209999999999994 107.46 172.687 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.8 mtt . . . . . 0 N--CA 1.473 0.677 0 N-CA-C 109.473 -0.565 . . . . 50.229999999999997 109.473 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.2 t -72.68 160.34 32.38 Favored 'General case' 0 CA--C 1.551 1.017 0 N-CA-C 106.25 -1.759 . . . . 61.210000000000001 106.25 -177.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 10.9 t -160.98 148.43 15.46 Favored 'General case' 0 C--O 1.235 0.295 0 O-C-N 120.443 -1.411 . . . . 71.409999999999997 110.049 -177.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -146.65 176.9 9.49 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 125.324 1.449 . . . . 50.350000000000001 108.689 170.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -58.72 172.4 0.52 Allowed 'General case' 0 C--O 1.238 0.48 0 C-N-CA 125.202 1.401 . . . . 72.209999999999994 110.389 160.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 47.0 p30 -117.5 163.56 16.22 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 124.606 1.163 . . . . 71.030000000000001 110.758 171.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 27.2 mtp85 -140.77 110.06 6.24 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 123.856 0.863 . . . . 72.319999999999993 108.758 -167.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.4 mt-10 -67.2 -16.14 64.12 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 113.918 1.081 . . . . 72.319999999999993 113.918 -179.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -100.77 172.68 6.92 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 119.527 1.058 . . . . 70.219999999999999 110.213 -174.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 50.75 69.75 0.6 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.643 1.577 . . . . 70.25 111.394 -173.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -123.38 -165.09 1.28 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 127.102 2.161 . . . . 63.439999999999998 108.514 -179.383 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 64.6 95.17 0.05 Allowed 'General case' 0 C--O 1.235 0.341 0 C-N-CA 126.87 2.068 . . . . 72.319999999999993 111.063 174.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 57.71 0.21 0.1 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 127.729 2.412 . . . . 64.129999999999995 114.21 -166.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 18.5 mmtm -66.33 -16.73 64.29 Favored 'General case' 0 C--O 1.221 -0.433 0 O-C-N 120.194 -1.566 . . . . 73.439999999999998 112.988 -178.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -50.22 -28.33 7.4 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 125.612 1.565 . . . . 72.409999999999997 114.826 173.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.95 -15.67 63.71 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.632 0.604 . . . . 71.239999999999995 112.632 178.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 64.4 t-80 -130.28 141.57 50.6 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 126.138 1.775 . . . . 74.120000000000005 108.129 -164.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 59.51 -175.84 0.1 Allowed 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.839 1.256 . . . . 74.150000000000006 109.532 -160.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -119.37 -19.07 8.39 Favored 'General case' 0 C--O 1.225 -0.21 0 O-C-N 121.146 -0.971 . . . . 74.349999999999994 111.883 164.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.88 -41.86 83.4 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.613 0.765 . . . . 73.140000000000001 110.516 -170.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.0 mt -71.96 -46.4 57.54 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 108.672 -0.862 . . . . 71.25 108.672 -175.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -61.45 -43.84 98.16 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 124.538 1.135 . . . . 73.439999999999998 111.977 179.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -58.79 -36.9 75.19 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 124.185 0.994 . . . . 74.140000000000001 111.014 -177.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.06 -29.65 44.97 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.821 0.848 . . . . 72.129999999999995 111.498 178.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.786 ' HB1' ' HA ' ' A' ' 97' ' ' ARG . . . -74.53 -54.06 8.24 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 124.717 1.207 . . . . 61.229999999999997 112.049 178.263 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.8 tp10 -55.87 -32.97 64.15 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.588 -0.695 . . . . 72.329999999999998 109.886 174.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -75.34 8.56 2.66 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.513 1.125 . . . . 70.349999999999994 112.31 178.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.2 mmt180 -87.91 -23.71 23.84 Favored 'General case' 0 C--O 1.231 0.111 0 O-C-N 120.656 -1.278 . . . . 74.209999999999994 111.142 166.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.3 ptt180 -67.19 -23.0 65.71 Favored 'General case' 0 C--N 1.344 0.364 0 CA-C-N 120.976 1.716 . . . . 54.299999999999997 115.185 -149.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -110.45 -12.33 14.4 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-O 118.222 -0.894 . . . . 73.420000000000002 112.02 170.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.46 -55.01 31.74 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 125.057 1.343 . . . . 74.0 110.405 171.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -66.22 -9.61 33.84 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.859 1.059 . . . . 73.299999999999997 113.859 -172.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.7 tp -56.33 -31.93 64.2 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 126.946 2.098 . . . . 65.329999999999998 111.291 171.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.49 -31.71 81.68 Favored Glycine 0 CA--C 1.532 1.141 0 O-C-N 121.252 -0.905 . . . . 74.430000000000007 112.325 176.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -68.86 -26.99 65.42 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.797 1.298 . . . . 74.239999999999995 110.768 -178.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 20.6 t90 -68.6 -65.26 0.72 Allowed 'General case' 0 N--CA 1.462 0.144 0 C-N-CA 124.87 1.268 . . . . 74.340000000000003 109.152 173.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -55.18 -41.36 71.83 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 118.765 -0.636 . . . . 63.119999999999997 111.878 -174.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -44.87 -60.8 1.87 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.523 1.129 . . . . 65.010000000000005 112.92 -178.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.65 -30.4 77.52 Favored Glycine 0 CA--C 1.528 0.898 0 CA-C-N 118.577 0.626 . . . . 72.340000000000003 112.58 -175.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 56.9 mt -68.13 -41.51 81.58 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.131 0.972 . . . . 72.129999999999995 110.012 175.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.8 mp -69.96 -1.84 10.81 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 126.387 1.875 . . . . 50.329999999999998 113.72 168.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 74.5 4.22 69.08 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 125.54 1.543 . . . . 65.319999999999993 113.679 -179.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 53.1 mttm -76.12 128.75 35.61 Favored 'General case' 0 CA--C 1.524 -0.033 0 CA-C-N 119.875 1.838 . . . . 71.430000000000007 106.856 170.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 p -134.72 166.29 23.29 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 123.823 0.849 . . . . 64.310000000000002 109.066 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 55.21 -129.74 46.42 Favored Glycine 0 CA--C 1.525 0.663 0 C-N-CA 123.667 0.651 . . . . 33.130000000000003 112.057 176.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -61.1 -36.2 79.05 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 124.645 1.178 . . . . 72.430000000000007 111.005 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.42 -37.33 86.88 Favored 'General case' 0 N--CA 1.465 0.303 0 O-C-N 121.179 -0.95 . . . . 70.319999999999993 111.296 177.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.44 -43.43 63.8 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 123.112 0.565 . . . . 74.310000000000002 109.858 177.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.5 ptp180 -65.6 -46.09 80.66 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 109.279 -0.637 . . . . 64.310000000000002 109.279 -173.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.25 -36.6 84.19 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 124.681 1.192 . . . . 62.310000000000002 111.542 -178.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -65.23 -45.8 83.18 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.646 0.779 . . . . 74.409999999999997 110.588 173.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -69.36 -14.95 63.2 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 114.211 1.189 . . . . 71.019999999999996 114.211 -174.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 64.3 mt -58.44 -20.54 45.77 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 119.432 1.014 . . . . 71.140000000000001 112.759 -176.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.0 t -135.32 32.12 3.13 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.352 1.061 . . . . 71.400000000000006 110.586 -168.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 95.0 t -113.61 99.57 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 N-CA-C 106.446 -1.687 . . . . 74.310000000000002 106.446 177.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 9.6 p -156.12 135.88 3.99 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 N-CA-C 107.089 -1.449 . . . . 71.230000000000004 107.089 164.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.7 t 177.21 155.77 0.29 Allowed 'General case' 0 C--O 1.235 0.341 0 C-N-CA 128.353 2.661 . . . . 73.239999999999995 105.477 172.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.2 p -160.01 121.38 3.15 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 119.012 0.824 . . . . 73.099999999999994 108.966 167.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -133.55 167.35 20.62 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 108.714 -0.847 . . . . 34.109999999999999 108.714 162.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -161.24 -170.26 2.6 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.276 1.83 . . . . 70.239999999999995 107.384 170.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 3.9 t70 75.21 -157.93 0.05 Allowed 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 126.779 2.032 . . . . 70.030000000000001 109.289 -178.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 65.91 165.82 0.12 Allowed Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 125.926 1.691 . . . . 62.240000000000002 114.493 177.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -84.91 4.45 6.82 Favored 'Trans proline' 0 CA--C 1.546 1.117 0 C-N-CA 123.797 2.998 . . . . 72.420000000000002 113.527 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -82.92 169.02 47.93 Favored Glycine 0 CA--C 1.526 0.75 0 O-C-N 120.358 -1.464 . . . . 73.219999999999999 112.076 -178.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -86.11 -62.44 1.52 Allowed 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 124.677 1.191 . . . . 61.340000000000003 109.159 172.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -132.86 -64.8 0.73 Allowed 'General case' 0 C--O 1.222 -0.392 0 CA-C-O 118.768 -0.634 . . . . 73.209999999999994 111.867 -136.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 43.6 -85.74 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 128.466 2.706 . . . . 70.329999999999998 116.195 162.05 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 2.1 p -70.12 -57.49 7.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 C-N-CA 126.923 2.089 . . . . 52.509999999999998 109.388 174.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -63.48 -18.54 63.89 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 124.949 1.3 . . . . 74.430000000000007 112.282 -179.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -44.91 -46.81 11.14 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 119.967 1.258 . . . . 74.310000000000002 112.431 -172.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.1 mppt? -78.85 -1.4 34.82 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.163 0.985 . . . . 74.140000000000001 112.918 -174.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 72.1 mt -104.51 -54.33 2.54 Favored 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 126.265 1.826 . . . . 53.109999999999999 108.285 168.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.33 -54.15 44.21 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 126.133 1.773 . . . . 72.319999999999993 111.352 -170.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -76.18 -19.31 58.56 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 111.881 0.326 . . . . 74.299999999999997 111.881 -177.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.37 -50.79 35.21 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 108.007 -1.109 . . . . 71.030000000000001 108.007 173.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 79.9 mt -80.62 43.35 0.66 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 129.144 2.978 . . . . 70.420000000000002 110.573 175.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -52.56 104.25 0.09 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.729 1.611 . . . . 70.0 109.76 177.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 69.03 14.15 67.79 Favored Glycine 0 CA--C 1.533 1.179 0 CA-C-O 118.799 -1.001 . . . . 63.020000000000003 113.844 -177.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 25.0 mtmm -113.46 -11.19 13.13 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 119.287 1.543 . . . . 74.409999999999997 112.055 178.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -148.69 138.93 22.42 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.204 -1.035 . . . . 64.010000000000005 108.204 165.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.41 161.82 25.9 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 125.787 1.635 . . . . 62.210000000000001 109.407 176.386 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 85.0 mt-10 -59.83 -46.31 89.66 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.46 0.704 . . . . 74.439999999999998 110.091 175.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -74.01 -15.18 61.1 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 121.379 -0.826 . . . . 70.319999999999993 111.311 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.6 m -74.46 -32.88 62.74 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 117.785 -1.102 . . . . 54.43 109.975 171.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 11.7 mt -58.5 -60.31 2.47 Favored 'Isoleucine or valine' 0 C--O 1.239 0.516 0 CA-C-N 120.624 1.557 . . . . 74.310000000000002 108.874 177.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -53.37 -39.73 64.41 Favored 'General case' 0 C--N 1.343 0.314 0 O-C-N 124.679 1.237 . . . . 72.0 109.978 -178.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.25 -45.51 76.49 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 119.625 -0.226 . . . . 50.399999999999999 110.567 -176.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.36 -38.31 71.59 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.592 0.589 . . . . 74.340000000000003 112.592 -163.019 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 33.1 mtt -66.93 -0.73 3.31 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.251 -0.905 . . . . 44.409999999999997 112.684 176.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 46.6 t -120.58 -29.15 1.76 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 C-N-CA 126.482 1.913 . . . . 63.039999999999999 110.132 -178.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -55.67 -48.66 74.69 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.368 1.467 . . . . 74.430000000000007 109.007 175.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 15.3 mt -77.43 4.51 10.8 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.013 1.116 . . . . 54.310000000000002 114.013 -176.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 63.9 ttt180 -66.28 -20.64 66.16 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 120.654 -1.279 . . . . 61.240000000000002 113.543 -166.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -88.27 -46.19 9.42 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 119.658 1.117 . . . . 43.210000000000001 110.355 170.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 52.4 m -50.38 -36.19 31.51 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.261 1.024 . . . . 65.439999999999998 110.532 177.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -46.13 -49.58 16.54 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.22 1.008 . . . . 51.350000000000001 113.037 175.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.786 ' HA ' ' HB1' ' A' ' 25' ' ' ALA . 15.9 ptt-85 -79.88 -37.82 34.01 Favored 'General case' 0 C--N 1.342 0.259 0 CA-C-N 118.421 0.555 . . . . 64.450000000000003 110.911 -179.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -56.72 -38.11 71.9 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 124.572 1.149 . . . . 70.310000000000002 110.426 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -57.38 -36.73 71.63 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 119.203 0.911 . . . . 74.209999999999994 112.441 -175.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.9 mm -72.62 -48.47 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 CA-C-N 120.196 1.362 . . . . 64.230000000000004 107.885 177.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 70.1 mt -61.02 -13.63 7.9 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 C-N-CA 126.031 1.732 . . . . 71.329999999999998 110.745 -177.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -120.79 10.69 11.0 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.972 1.309 . . . . 62.439999999999998 112.106 -178.18 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 84.4 mt-10 -121.76 22.39 10.5 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.703 1.201 . . . . 73.329999999999998 110.446 174.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 35.2 mm . . . . . 0 C--O 1.256 1.407 0 C-N-CA 128.66 2.784 . . . . 73.120000000000005 110.599 -170.526 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.4 mmt . . . . . 0 N--CA 1.474 0.758 0 N-CA-C 113.77 1.026 . . . . 71.450000000000003 113.77 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.7 m -118.31 56.89 0.86 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 120.826 1.648 . . . . 63.539999999999999 111.307 -150.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . 0.3 57.6 p 53.55 -18.72 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 129.483 3.113 . . . . 72.439999999999998 116.7 -174.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -139.76 167.77 21.34 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 128.673 2.789 . . . . 75.409999999999997 108.035 177.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -126.13 -52.66 1.52 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 126.016 1.727 . . . . 63.109999999999999 108.221 -174.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 50.1 m-20 49.85 -157.62 0.08 Allowed 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 127.166 2.187 . . . . 60.539999999999999 111.142 171.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 20.9 mtp180 -86.55 33.36 0.64 Allowed 'General case' 0 C--O 1.236 0.378 0 O-C-N 119.768 -1.832 . . . . 72.430000000000007 110.156 172.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -102.74 -10.48 19.12 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.819 1.247 . . . . 42.130000000000003 111.64 -176.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.52 161.72 19.55 Favored 'General case' 0 C--O 1.232 0.146 0 O-C-N 120.424 -1.423 . . . . 43.420000000000002 111.535 163.203 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -151.87 54.86 0.83 Allowed 'General case' 0 C--O 1.236 0.35 0 CA-C-N 114.865 -1.062 . . . . 71.239999999999995 111.579 178.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -71.58 24.23 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.487 1.515 . . . . 60.240000000000002 114.84 -174.173 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -81.17 -85.6 0.1 Allowed 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.125 -0.985 . . . . 73.120000000000005 108.868 171.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.97 -14.76 61.08 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.95 0.722 . . . . 61.539999999999999 112.95 -174.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 25.2 mmtm -64.04 -12.22 36.57 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 118.227 -0.892 . . . . 74.120000000000005 113.154 -179.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -62.23 -17.26 57.84 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 120.622 1.555 . . . . 74.510000000000005 113.578 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -93.59 17.46 11.65 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.901 0.88 . . . . 75.510000000000005 111.825 173.487 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -143.37 -64.91 0.39 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.806 1.643 . . . . 75.450000000000003 110.813 -174.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -86.59 123.29 31.61 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 124.52 1.128 . . . . 75.329999999999998 111.406 -166.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.0 -33.99 75.66 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 124.386 1.074 . . . . 74.209999999999994 110.894 178.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -59.82 -24.39 64.13 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.869 0.867 . . . . 75.519999999999996 111.32 -175.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 48.7 mt -84.65 -46.07 11.86 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 124.992 1.317 . . . . 63.020000000000003 109.398 -179.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -50.6 -51.39 48.89 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.62 1.568 . . . . 62.340000000000003 108.68 176.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.79 -46.91 88.68 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 124.297 1.039 . . . . 71.409999999999997 111.606 -178.004 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -66.52 -39.26 88.54 Favored 'General case' 0 N--CA 1.44 -0.938 0 O-C-N 119.632 -1.917 . . . . 63.450000000000003 109.628 -177.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.8 -44.79 95.24 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 118.068 0.394 . . . . 74.340000000000003 111.894 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.3 tm-20 -53.61 -38.47 64.02 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.388 0.613 . . . . 75.010000000000005 110.307 173.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -78.24 1.76 20.52 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 123.945 0.898 . . . . 63.350000000000001 113.38 -175.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.4 mmt-85 -80.23 -19.08 47.74 Favored 'General case' 0 N--CA 1.464 0.245 0 O-C-N 120.268 -1.52 . . . . 72.450000000000003 110.95 164.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 45.2 mtp180 -52.95 -41.94 64.99 Favored 'General case' 0 C--N 1.342 0.279 0 N-CA-C 114.587 1.328 . . . . 72.030000000000001 114.587 -169.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -95.23 -31.02 13.69 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 123.813 0.695 . . . . 60.420000000000002 111.671 -177.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -44.6 -52.57 7.99 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.047 1.339 . . . . 74.239999999999995 111.536 -178.182 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.98 -5.08 44.59 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 114.805 1.409 . . . . 74.430000000000007 114.805 -169.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 25.7 tp -71.52 -32.52 68.29 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 127.141 2.176 . . . . 72.200000000000003 110.508 171.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -57.19 -48.59 78.78 Favored Glycine 0 C--N 1.34 0.793 0 N-CA-C 110.568 -1.013 . . . . 63.420000000000002 110.568 173.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -63.88 -30.13 71.24 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 124.807 1.243 . . . . 63.329999999999998 112.803 -170.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 9.1 t90 -63.89 -71.6 0.17 Allowed 'General case' 0 C--O 1.231 0.117 0 N-CA-C 107.446 -1.316 . . . . 72.120000000000005 107.446 171.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.1 -32.35 34.77 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 125.496 1.518 . . . . 72.040000000000006 112.394 -173.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -45.17 -52.95 8.75 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 119.383 0.992 . . . . 73.430000000000007 111.53 174.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.58 -42.22 97.64 Favored Glycine 0 CA--C 1.524 0.624 0 N-CA-C 111.63 -0.588 . . . . 73.209999999999994 111.63 -178.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.6 mp -61.68 -46.29 90.35 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 125.365 1.466 . . . . 74.319999999999993 109.988 177.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.2 mp -63.2 -28.49 70.08 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.89 0.876 . . . . 42.43 110.478 175.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 104.21 20.38 10.49 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 126.237 1.875 . . . . 63.32 112.181 176.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 39.7 mttm -89.97 133.26 34.9 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 107.461 -1.311 . . . . 74.430000000000007 107.461 169.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.6 p -132.71 162.28 31.84 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 123.577 0.751 . . . . 55.420000000000002 109.479 165.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.51 -135.75 22.51 Favored Glycine 0 N--CA 1.448 -0.508 0 N-CA-C 110.322 -1.111 . . . . 33.149999999999999 110.322 175.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -66.22 -27.22 67.81 Favored 'General case' 0 C--O 1.226 -0.175 0 O-C-N 122.297 -0.531 . . . . 60.310000000000002 112.389 -177.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -56.61 -50.08 73.04 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.997 1.319 . . . . 75.239999999999995 109.123 174.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.13 -40.14 71.6 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 125.44 1.496 . . . . 72.030000000000001 110.299 -177.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.7 ttt85 -59.84 -49.96 75.68 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 123.334 0.654 . . . . 60.340000000000003 109.596 177.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.62 -44.78 95.92 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.153 0.981 . . . . 55.240000000000002 110.684 -178.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 88.6 t80 -57.08 -39.02 74.15 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.498 1.119 . . . . 73.239999999999995 111.099 175.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.85 -4.19 30.24 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 120.59 -1.319 . . . . 61.439999999999998 113.229 178.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 12.9 mt -84.62 -0.07 52.01 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 120.547 1.522 . . . . 62.229999999999997 112.145 176.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 12.0 t -130.49 37.72 3.82 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 120.621 1.555 . . . . 52.32 112.054 -173.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 1.8 p -134.88 99.0 2.37 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 O-C-N 121.021 -1.049 . . . . 73.439999999999998 110.552 -175.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.2 p -159.59 109.36 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 124.147 0.979 . . . . 55.399999999999999 113.246 166.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.4 t -149.45 57.9 1.0 Allowed 'General case' 0 CA--C 1.554 1.098 0 O-C-N 121.202 -0.936 . . . . 44.240000000000002 111.246 177.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.4 t 61.43 -154.23 0.36 Allowed 'General case' 0 CA--C 1.542 0.641 0 O-C-N 120.218 -1.551 . . . . 61.049999999999997 110.026 -175.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -131.68 -162.87 1.26 Allowed 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 127.776 2.431 . . . . 71.340000000000003 108.263 163.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -69.06 112.02 5.42 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 118.901 0.773 . . . . 72.349999999999994 110.289 -176.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -119.68 91.15 3.48 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 127.097 2.159 . . . . 73.450000000000003 106.06 178.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 58.21 164.96 0.08 OUTLIER Pre-proline 0 CA--C 1.552 1.026 0 C-N-CA 127.717 2.407 . . . . 75.150000000000006 114.306 -172.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -84.76 64.12 6.46 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.878 2.385 . . . . 61.020000000000003 110.227 176.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -144.3 -58.24 0.02 OUTLIER Glycine 0 C--N 1.33 0.241 0 N-CA-C 110.058 -1.217 . . . . 63.030000000000001 110.058 -178.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -61.37 -63.84 1.15 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.644 0.777 . . . . 75.420000000000002 109.434 178.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . 0.257 14.6 pt-20 48.74 16.61 0.12 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 129.596 3.158 . . . . 73.239999999999995 115.883 -175.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -51.57 -44.32 62.71 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.864 1.666 . . . . 62.119999999999997 112.868 -168.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 92.2 t -55.19 -59.44 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-N 118.761 0.71 . . . . 75.439999999999998 109.499 174.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -57.59 -36.51 71.83 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.497 0.719 . . . . 75.040000000000006 110.612 -178.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.6 tpt180 -58.88 -26.58 64.41 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 124.489 1.116 . . . . 72.120000000000005 112.439 -178.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.7 mmmt -99.41 -43.84 6.41 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 118.488 0.585 . . . . 75.329999999999998 109.505 175.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -57.44 -54.8 42.7 Favored 'General case' 0 C--O 1.223 -0.341 0 C-N-CA 124.857 1.263 . . . . 75.010000000000005 110.204 -174.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.09 -4.0 15.46 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 114.006 1.113 . . . . 32.030000000000001 114.006 -178.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -87.19 -57.47 2.95 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 108.399 -0.963 . . . . 74.200000000000003 108.399 166.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.05 -43.3 70.09 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 125.068 1.347 . . . . 74.439999999999998 110.653 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.3 tp -110.88 19.85 18.13 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 126.841 2.056 . . . . 75.439999999999998 111.512 -165.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 69.5 tt0 -48.64 118.9 2.76 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 126.007 1.723 . . . . 71.219999999999999 108.284 172.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 81.11 -0.58 87.21 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 125.517 1.532 . . . . 75.120000000000005 114.78 178.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 11.3 mtpp -119.54 1.88 11.18 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 118.899 1.35 . . . . 75.239999999999995 111.785 -172.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -148.68 -163.08 1.7 Allowed 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 125.654 1.582 . . . . 75.230000000000004 107.194 168.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -145.65 158.2 43.88 Favored 'General case' 0 CA--C 1.51 -0.562 0 C-N-CA 125.898 1.679 . . . . 60.340000000000003 108.05 -175.004 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -59.85 -42.52 93.83 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 118.577 0.626 . . . . 51.329999999999998 111.596 -178.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.92 -39.41 72.72 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.021 0.373 . . . . 75.430000000000007 111.128 176.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 53.7 m -59.81 -48.18 82.71 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.197 0.999 . . . . 75.200000000000003 110.819 177.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 64.6 mt -63.34 -50.41 78.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 108.447 -0.945 . . . . 73.129999999999995 108.447 -177.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.97 -40.44 97.73 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 120.703 -0.399 . . . . 74.25 110.071 -176.479 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.8 -54.82 41.82 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 118.156 -0.926 . . . . 71.030000000000001 110.37 176.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.21 -56.58 12.1 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 118.937 0.789 . . . . 73.209999999999994 111.698 -176.737 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 8.9 ptp -66.09 -26.88 67.68 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 119.468 -0.893 . . . . 61.119999999999997 111.603 -173.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 59.7 t -78.9 -51.99 16.07 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 O-C-N 121.089 -1.007 . . . . 75.340000000000003 110.432 176.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -61.1 -31.46 71.15 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.594 1.158 . . . . 73.310000000000002 112.305 -162.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 18.1 mt -75.63 1.1 15.36 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.57 1.548 . . . . 74.140000000000001 112.894 -177.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 30.4 ttt180 -50.89 -45.81 60.3 Favored 'General case' 0 C--N 1.34 0.195 0 C-N-CA 124.433 1.093 . . . . 60.310000000000002 111.008 177.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -56.21 -61.61 2.28 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.707 0.803 . . . . 71.049999999999997 110.961 174.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 10.9 m -49.26 -37.35 23.26 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 127.265 2.226 . . . . 75.219999999999999 111.993 -175.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -51.08 -30.7 16.66 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.623 1.169 . . . . 72.329999999999998 113.469 -178.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 34.2 ttp180 -69.2 -60.3 2.44 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 108.582 -0.896 . . . . 74.310000000000002 108.582 174.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 11.8 mp0 -55.52 -35.1 65.28 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 118.002 -0.999 . . . . 63.329999999999998 110.651 -173.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -50.63 -45.77 57.89 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-O 118.409 -0.805 . . . . 72.340000000000003 112.483 -178.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 45.7 mm -63.77 -46.37 94.66 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-N 119.33 0.968 . . . . 62.149999999999999 109.72 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 32.4 mt -70.11 -12.03 15.62 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 124.614 1.166 . . . . 74.519999999999996 109.452 179.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 13.1 t -108.21 10.2 27.93 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.93 1.692 . . . . 41.030000000000001 109.154 179.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -112.81 12.53 19.54 Favored 'General case' 0 C--O 1.232 0.162 0 O-C-N 119.93 -1.732 . . . . 72.329999999999998 109.941 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 31.8 mt . . . . . 0 C--O 1.251 1.163 0 N-CA-C 107.704 -1.221 . . . . 72.450000000000003 107.704 -178.619 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ttm . . . . . 0 N--CA 1.474 0.764 0 N-CA-C 107.649 -1.241 . . . . 64.329999999999998 107.649 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -61.16 158.53 13.7 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 119.792 1.178 . . . . 74.409999999999997 108.994 158.435 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 26.1 m 72.1 158.41 0.2 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.938 1.295 . . . . 53.140000000000001 111.309 172.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.24 169.6 16.75 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.281 -0.887 . . . . 72.420000000000002 112.371 -166.13 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -70.16 97.7 1.24 Allowed 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 108.798 -0.816 . . . . 74.030000000000001 108.798 171.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -62.25 -43.76 98.1 Favored 'General case' 0 C--N 1.333 -0.152 0 C-N-CA 125.651 1.58 . . . . 62.140000000000001 111.261 177.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 19.4 mmt180 -91.54 128.77 37.5 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 125.197 1.399 . . . . 73.010000000000005 108.957 177.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -67.63 165.66 16.6 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-O 122.267 1.032 . . . . 75.450000000000003 111.054 175.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 49.9 mtm-85 -72.2 175.59 5.92 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.21 1.804 . . . . 71.310000000000002 109.845 172.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -170.71 84.06 0.1 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 126.129 1.772 . . . . 61.43 109.4 169.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . 0.504 ' CD2' ' H ' ' A' ' 11' ' ' HIS . 0.2 OUTLIER -71.14 -3.48 20.24 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 116.256 1.947 . . . . 61.310000000000002 116.256 177.38 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -61.96 119.58 9.12 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.984 0.914 . . . . 73.219999999999999 110.679 -177.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 56.06 -22.4 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 130.447 3.499 . . . . 42.539999999999999 116.883 -174.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 32.6 mmtt -50.01 -28.86 7.59 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 128.754 2.822 . . . . 63.229999999999997 113.37 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.49 -25.31 64.34 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 113.014 0.746 . . . . 72.129999999999995 113.014 -176.076 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.39 -8.13 43.82 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.152 0.797 . . . . 71.219999999999999 113.152 176.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 13.3 t-80 -145.06 -171.39 3.64 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 125.96 1.704 . . . . 74.040000000000006 108.03 -160.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 58.3 -164.19 0.19 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.228 1.411 . . . . 60.299999999999997 110.365 170.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -143.44 -39.18 0.32 Allowed 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.847 1.259 . . . . 63.020000000000003 110.756 167.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -54.67 -43.67 72.62 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 119.554 1.07 . . . . 64.239999999999995 111.586 -172.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 80.4 mt -75.1 -33.89 61.68 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 123.872 0.869 . . . . 74.439999999999998 112.444 177.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -69.93 -36.8 75.62 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.343 1.457 . . . . 72.099999999999994 110.698 -177.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -46.13 -35.96 5.47 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 128.458 2.703 . . . . 60.240000000000002 113.76 -173.06 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.09 -53.44 57.78 Favored 'General case' 0 C--O 1.225 -0.212 0 O-C-N 120.652 -1.28 . . . . 73.299999999999997 111.138 175.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.74 -39.41 84.25 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 118.985 0.811 . . . . 73.030000000000001 111.884 178.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -50.94 -37.57 45.15 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.73 1.212 . . . . 74.5 110.814 -176.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -110.08 -85.34 0.55 Allowed 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.607 -0.886 . . . . 74.540000000000006 108.607 178.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 50.37 -12.95 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 129.128 2.971 . . . . 73.239999999999995 117.414 -173.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 30.7 mtm180 -44.45 -48.59 9.99 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 126.958 2.103 . . . . 74.109999999999999 113.186 -158.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -100.25 -24.3 14.59 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 122.456 0.302 . . . . 62.119999999999997 111.257 -177.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.52 -7.89 1.06 Allowed 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 126.949 2.1 . . . . 75.150000000000006 114.225 -173.126 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.415 ' H ' HD23 ' A' ' 32' ' ' LEU . 2.4 pt? -120.72 -15.16 8.45 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 119.872 1.215 . . . . 62.399999999999999 112.919 -178.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 12.3 tp -60.56 -21.14 62.23 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 127.707 2.403 . . . . 55.219999999999999 111.891 172.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -70.22 -42.29 66.87 Favored Glycine 0 C--O 1.224 -0.499 0 N-CA-C 110.48 -1.048 . . . . 61.039999999999999 110.48 175.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -61.82 -39.35 91.47 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.548 1.174 . . . . 71.219999999999999 110.663 179.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 36.1 t90 -55.03 -63.47 1.14 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.627 0.771 . . . . 75.140000000000001 109.375 172.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.83 -29.4 69.86 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.069 0.948 . . . . 54.350000000000001 113.337 -173.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -55.59 -54.46 43.82 Favored 'General case' 0 C--O 1.232 0.17 0 C-N-CA 124.317 1.047 . . . . 60.420000000000002 110.136 -177.011 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -67.37 -5.83 37.67 Favored Glycine 0 CA--C 1.532 1.117 0 CA-C-O 119.032 -0.871 . . . . 73.239999999999995 113.687 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 35.8 mt -90.93 -37.06 13.76 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 119.339 1.57 . . . . 63.020000000000003 110.42 171.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.416 HD23 ' HE2' ' A' ' 79' ' ' LYS . 47.2 mt -91.36 8.79 34.43 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.58 1.952 . . . . 73.150000000000006 113.163 -173.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 75.65 5.25 78.13 Favored Glycine 0 CA--C 1.527 0.786 0 CA-C-O 119.274 -0.737 . . . . 41.549999999999997 113.0 -177.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.1 mttm -78.91 119.66 22.41 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 119.072 1.436 . . . . 64.040000000000006 107.125 -179.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 67.1 p -135.29 175.95 9.12 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 107.789 -1.189 . . . . 64.140000000000001 107.789 159.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 58.12 -145.25 41.26 Favored Glycine 0 CA--C 1.532 1.096 0 N-CA-C 111.571 -0.612 . . . . 60.409999999999997 111.571 -172.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -58.0 -31.32 66.84 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.312 1.045 . . . . 72.340000000000003 111.348 -172.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -63.57 -42.86 98.29 Favored 'General case' 0 C--O 1.225 -0.224 0 C-N-CA 123.8 0.84 . . . . 73.030000000000001 110.966 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.3 -41.54 69.81 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.856 -0.794 . . . . 71.439999999999998 108.856 177.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.8 ptt-85 -73.07 -41.64 63.91 Favored 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 119.368 -0.933 . . . . 73.439999999999998 108.928 -169.088 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.18 -42.33 99.36 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 123.517 0.727 . . . . 74.129999999999995 110.958 176.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -58.1 -46.09 86.1 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.3 0.5 . . . . 75.329999999999998 110.318 173.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.97 -12.93 5.15 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.541 1.136 . . . . 75.230000000000004 113.226 176.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 56.3 mt -101.6 1.44 37.82 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.759 1.624 . . . . 75.349999999999994 112.63 -177.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.8 t -125.23 -9.77 7.02 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 119.501 1.046 . . . . 75.150000000000006 112.502 176.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 12.3 m -70.71 84.39 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 C-N-CA 126.13 1.772 . . . . 64.230000000000004 111.756 175.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 2.9 p -139.99 132.98 35.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 O-C-N 121.167 -0.958 . . . . 61.32 111.804 151.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.1 t -148.47 -164.86 2.12 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 106.058 -1.83 . . . . 74.310000000000002 106.058 162.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.25 -163.66 0.39 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.435 1.494 . . . . 75.129999999999995 112.303 -178.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -138.76 173.18 11.85 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.532 1.133 . . . . 72.519999999999996 109.289 157.058 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -65.53 -85.43 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.253 1.821 . . . . 74.540000000000006 110.65 -175.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 11.9 t0 72.37 0.63 3.66 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 127.531 2.332 . . . . 64.519999999999996 113.06 -172.451 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -151.25 161.2 30.44 Favored Pre-proline 0 CA--C 1.544 0.745 0 C-N-CA 125.655 1.582 . . . . 62.530000000000001 109.929 177.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -88.62 64.77 3.0 Favored 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 123.154 2.57 . . . . 55.100000000000001 111.022 -167.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -169.47 -140.7 3.03 Favored Glycine 0 CA--C 1.522 0.48 0 N-CA-C 110.213 -1.155 . . . . 40.0 110.213 -176.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 3.0 t70 46.2 45.43 12.85 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 130.502 3.521 . . . . 53.210000000000001 115.239 173.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 81.9 mt-10 -65.56 61.74 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 125.934 1.694 . . . . 75.129999999999995 112.055 173.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -135.95 -40.32 0.68 Allowed 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 126.575 1.95 . . . . 72.319999999999993 109.665 168.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.3 p -60.22 -44.93 96.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-N 119.543 1.065 . . . . 72.439999999999998 111.198 179.178 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -62.08 -21.07 64.65 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 121.062 -1.024 . . . . 63.509999999999998 113.492 177.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -53.56 -38.85 64.25 Favored 'General case' 0 C--N 1.343 0.287 0 CA-C-N 119.124 0.875 . . . . 73.239999999999995 110.949 -174.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -66.96 -31.62 72.31 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.612 -0.514 . . . . 73.519999999999996 109.612 -171.12 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -78.2 -51.18 10.59 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-O 118.487 -0.768 . . . . 74.439999999999998 109.12 169.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.58 -40.83 72.53 Favored 'General case' 0 C--N 1.334 -0.107 0 C-N-CA 125.074 1.35 . . . . 74.25 113.214 -171.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.81 -17.07 62.18 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.355 1.062 . . . . 73.420000000000002 112.503 179.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -97.95 -55.02 2.91 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 108.782 -0.821 . . . . 74.519999999999996 108.782 -178.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.7 mt -78.71 40.4 0.38 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 127.43 2.292 . . . . 74.409999999999997 111.055 170.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -57.97 113.07 1.72 Allowed 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.836 1.254 . . . . 73.239999999999995 108.312 175.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 75.31 12.05 83.81 Favored Glycine 0 CA--C 1.528 0.884 0 C-N-CA 124.708 1.147 . . . . 52.219999999999999 112.949 -178.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.416 ' HE2' HD23 ' A' ' 41' ' ' LEU . 25.4 mtpp -133.02 -8.63 3.05 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.013 1.325 . . . . 74.239999999999995 112.153 -172.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -157.69 114.83 2.98 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.883 1.273 . . . . 73.140000000000001 108.25 163.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -67.44 170.65 7.1 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 124.72 1.208 . . . . 63.509999999999998 110.912 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -47.42 -55.74 8.36 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.123 1.769 . . . . 75.439999999999998 110.12 166.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -69.84 -30.48 67.99 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 122.967 0.507 . . . . 75.439999999999998 111.119 -176.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 30.5 m -65.09 -53.63 42.43 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 109.268 -0.642 . . . . 71.219999999999999 109.268 176.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 41.2 mt -61.74 -52.46 60.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 CA-C-N 119.575 1.079 . . . . 75.140000000000001 109.017 -178.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.04 -23.41 67.43 Favored 'General case' 0 C--N 1.34 0.157 0 N-CA-C 111.849 0.314 . . . . 75.120000000000005 111.849 -175.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.42 -54.73 5.21 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 108.717 -0.845 . . . . 35.530000000000001 108.717 174.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.9 tppm? -54.56 -57.1 12.73 Favored 'General case' 0 CA--C 1.512 -0.518 0 C-N-CA 125.948 1.699 . . . . 44.100000000000001 112.136 -171.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 5.2 ptm -59.56 -26.93 65.79 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 120.067 -0.653 . . . . 64.5 111.237 -175.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 59.7 t -88.25 -27.08 5.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 125.625 1.57 . . . . 64.530000000000001 111.832 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -55.52 -57.82 10.34 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 126.342 1.857 . . . . 73.099999999999994 108.053 172.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.2 pp -80.8 11.58 3.81 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.912 1.685 . . . . 73.219999999999999 113.275 -172.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 8.0 tpt180 -53.37 -50.99 63.91 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 120.945 -1.097 . . . . 74.219999999999999 110.971 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -64.99 -45.41 85.73 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.232 0.539 . . . . 75.439999999999998 110.694 175.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 21.9 m -50.92 -35.92 35.72 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.625 1.57 . . . . 51.130000000000003 111.517 -178.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -47.79 -45.57 29.61 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.26 1.424 . . . . 74.019999999999996 113.547 177.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -78.86 -43.44 25.08 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.807 1.185 . . . . 60.299999999999997 111.038 174.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.14 -31.91 67.65 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 124.434 1.094 . . . . 54.5 112.538 -175.131 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -61.73 -24.48 66.83 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.338 0.972 . . . . 71.319999999999993 112.448 177.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 26.7 mm -81.77 -38.38 15.92 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 C-N-CA 124.106 0.962 . . . . 43.119999999999997 110.03 175.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 23.0 mm -59.41 -27.17 36.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 123.733 0.813 . . . . 61.299999999999997 109.648 174.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.63 -17.41 61.67 Favored 'General case' 0 N--CA 1.44 -0.928 0 C-N-CA 125.889 1.675 . . . . 51.229999999999997 112.021 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -139.37 62.23 1.53 Allowed 'General case' 0 C--O 1.237 0.422 0 N-CA-C 106.403 -1.702 . . . . 60.0 106.403 -175.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 95.8 mt . . . . . 0 C--O 1.255 1.383 0 N-CA-C 107.089 -1.448 . . . . 71.010000000000005 107.089 162.582 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.483 1.203 0 CA-C-O 121.735 0.779 . . . . 75.409999999999997 110.021 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.5 p -155.36 -57.67 0.1 Allowed 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 125.246 1.418 . . . . 72.430000000000007 108.395 -149.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 64.06 15.92 9.59 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.334 1.454 . . . . 64.129999999999995 114.069 171.14 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -84.98 80.01 9.44 Favored 'General case' 0 C--O 1.237 0.407 0 O-C-N 120.501 -1.374 . . . . 53.43 108.891 168.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 50.71 -168.15 0.03 OUTLIER 'General case' 0 C--O 1.236 0.386 0 C-N-CA 128.11 2.564 . . . . 75.230000000000004 112.042 -175.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -176.49 -164.93 0.12 Allowed 'General case' 0 C--O 1.238 0.482 0 C-N-CA 129.232 3.013 . . . . 60.299999999999997 107.228 159.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 43.9 mtm180 -110.19 -172.28 2.0 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 127.023 2.129 . . . . 72.340000000000003 110.788 -166.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -137.78 -66.67 0.5 Allowed 'General case' 0 CA--C 1.523 -0.079 0 O-C-N 120.933 -1.104 . . . . 73.530000000000001 110.865 178.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 35.5 mtp180 -83.63 -27.69 28.97 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.858 0.361 . . . . 64.409999999999997 111.398 -160.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.99 34.67 0.36 Allowed 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 125.379 1.472 . . . . 74.140000000000001 112.372 -169.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . 0.466 ' HA ' HD13 ' A' ' 21' ' ' LEU . 0.4 OUTLIER -69.82 10.14 0.43 Allowed 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.882 1.068 . . . . 74.099999999999994 113.882 173.461 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -50.1 109.26 0.28 Allowed 'General case' 0 C--O 1.238 0.451 0 C-N-CA 126.635 1.974 . . . . 74.200000000000003 109.708 175.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 48.43 33.58 4.06 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 126.969 2.108 . . . . 75.319999999999993 113.759 -175.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 26.2 mttt -114.4 -10.3 12.65 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.346 1.059 . . . . 71.230000000000004 113.175 174.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -66.15 -21.51 66.34 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 119.311 0.959 . . . . 75.530000000000001 112.863 -171.222 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -122.67 72.55 1.08 Allowed 'General case' 0 C--O 1.232 0.155 0 N-CA-C 107.261 -1.385 . . . . 63.310000000000002 107.261 162.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -164.44 -46.98 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.031 0.932 . . . . 74.219999999999999 110.48 173.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.58 161.27 13.71 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 121.52 -0.737 . . . . 64.530000000000001 111.488 -167.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -93.8 -38.67 11.14 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.199 0.999 . . . . 73.239999999999995 109.576 162.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -44.76 -62.14 1.32 Allowed 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.295 1.438 . . . . 73.540000000000006 111.041 -175.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.466 HD13 ' HA ' ' A' ' 11' ' ' HIS . 13.4 mt -84.31 -29.5 26.32 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 125.38 1.472 . . . . 51.109999999999999 110.735 -172.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 51.4 t30 -69.55 -21.45 63.63 Favored 'General case' 0 C--O 1.216 -0.689 0 CA-C-O 117.88 -1.057 . . . . 73.540000000000006 111.837 176.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -48.2 -55.24 10.94 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 120.214 1.37 . . . . 74.519999999999996 111.174 -170.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.5 pttm -56.44 -53.3 59.04 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 121.131 -0.981 . . . . 74.129999999999995 111.242 173.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.84 -11.51 27.92 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.306 1.042 . . . . 74.420000000000002 113.684 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -87.84 -14.45 39.47 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 120.545 -1.347 . . . . 75.120000000000005 110.469 176.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -153.81 92.12 1.53 Allowed 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.355 1.062 . . . . 72.400000000000006 110.416 178.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.743 ' HD3' ' HB1' ' A' ' 96' ' ' ALA . 0.0 OUTLIER -118.62 -17.51 9.26 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-O 118.389 -0.815 . . . . 64.310000000000002 111.903 169.16 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.74 -35.79 33.27 Favored 'General case' 0 C--N 1.342 0.257 0 CA-C-N 119.974 1.261 . . . . 75.140000000000001 113.344 -173.495 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -83.53 -22.02 32.54 Favored 'General case' 0 C--O 1.223 -0.309 0 CA-C-O 118.028 -0.987 . . . . 75.540000000000006 113.629 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.561 ' HD3' HD12 ' A' ' 32' ' ' LEU . 0.1 OUTLIER -64.02 -54.76 29.28 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 120.541 1.518 . . . . 73.239999999999995 109.778 166.94 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.561 HD12 ' HD3' ' A' ' 31' ' ' ARG . 3.0 mp -68.73 -24.77 64.51 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.596 0.758 . . . . 73.510000000000005 110.443 -167.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 mt -46.14 -38.51 8.28 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.664 1.185 . . . . 72.5 111.569 167.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -69.54 -40.17 78.46 Favored Glycine 0 C--N 1.34 0.774 0 O-C-N 121.419 -0.8 . . . . 73.129999999999995 112.465 177.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -64.2 -30.02 71.1 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 118.537 1.168 . . . . 74.420000000000002 111.667 -177.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 20.5 t90 -61.51 -77.24 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 108.421 -0.955 . . . . 75.099999999999994 108.421 166.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.72 -30.76 63.84 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.015 1.326 . . . . 71.129999999999995 113.867 -166.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.39 -54.99 24.77 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 123.943 0.897 . . . . 71.409999999999997 109.743 171.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -55.1 -45.45 81.94 Favored Glycine 0 CA--C 1.522 0.476 0 C-N-CA 124.195 0.902 . . . . 52.119999999999997 111.746 -178.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 9.0 mp -54.68 -41.89 70.75 Favored 'General case' 0 C--O 1.233 0.218 0 C-N-CA 125.695 1.598 . . . . 63.299999999999997 110.937 177.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.456 HD23 ' HE3' ' A' ' 79' ' ' LYS . 51.5 mt -87.87 6.03 37.49 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 126.303 1.841 . . . . 75.540000000000006 112.177 -178.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 73.51 15.47 79.14 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-O 119.108 -0.829 . . . . 50.009999999999998 112.83 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 52.2 mttt -89.07 127.3 35.69 Favored 'General case' 0 CA--C 1.519 -0.231 0 N-CA-C 106.443 -1.688 . . . . 72.239999999999995 106.443 174.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.3 p -141.28 169.72 17.08 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.684 -0.858 . . . . 73.420000000000002 108.684 177.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 55.94 -130.2 48.53 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 110.23 -1.148 . . . . 75.530000000000001 110.23 179.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.88 -29.16 66.3 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 112.174 0.435 . . . . 74.319999999999993 112.174 -174.355 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.62 -33.38 75.79 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 121.234 -0.916 . . . . 74.329999999999998 110.031 177.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.36 -40.44 62.13 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.488 0.715 . . . . 75.540000000000006 109.718 177.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.0 ptp180 -67.23 -44.24 79.98 Favored 'General case' 0 C--O 1.227 -0.124 0 N-CA-C 109.765 -0.458 . . . . 63.399999999999999 109.765 -178.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.59 -43.79 84.89 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 125.983 1.713 . . . . 75.510000000000005 110.131 176.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -60.85 -47.95 84.04 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 122.78 0.432 . . . . 64.200000000000003 111.299 173.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.46 -16.14 44.22 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.352 -0.842 . . . . 75.430000000000007 112.932 -176.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 50.1 mt -61.87 -11.37 12.55 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 119.462 1.028 . . . . 75.519999999999996 113.732 178.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 8.9 t -132.52 -3.17 3.37 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 120.351 1.432 . . . . 75.329999999999998 112.831 -172.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 6.0 p -80.05 11.45 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.932 0 O-C-N 120.668 -1.27 . . . . 64.420000000000002 113.107 -171.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 2.1 p -115.8 120.7 65.56 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.173 0 O-C-N 120.666 -1.271 . . . . 74.400000000000006 110.605 -164.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.405 HG23 HG22 ' A' ' 68' ' ' VAL . 5.9 t -161.98 -178.35 6.38 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 130.372 3.469 . . . . 63.140000000000001 105.615 -176.003 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.5 m -161.67 112.06 1.63 Allowed 'General case' 0 CA--C 1.532 0.278 0 O-C-N 120.244 -1.535 . . . . 72.530000000000001 110.384 170.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.467 ' H ' HG21 ' A' ' 68' ' ' VAL . 0.2 OUTLIER -155.8 126.35 6.8 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 104.318 -2.475 . . . . 75.239999999999995 104.318 168.366 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -164.61 -171.92 2.49 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 119.972 1.26 . . . . 75.239999999999995 108.346 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 4.3 t70 75.85 32.77 0.64 Allowed 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 127.272 2.229 . . . . 75.519999999999996 110.23 -178.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . 0.279 17.3 pt-20 46.19 71.7 1.48 Allowed Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 129.623 3.169 . . . . 71.409999999999997 111.353 -171.381 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -90.74 -2.3 5.02 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 124.068 3.179 . . . . 75.120000000000005 113.878 -171.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -178.01 -93.92 0.09 OUTLIER Glycine 0 C--N 1.335 0.498 0 CA-C-N 119.641 1.11 . . . . 55.219999999999999 110.483 -178.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -128.95 -78.24 0.56 Allowed 'General case' 0 N--CA 1.457 -0.122 0 N-CA-C 105.996 -1.853 . . . . 61.310000000000002 105.996 -166.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.4 pt-20 -156.68 144.6 19.4 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 127.802 2.441 . . . . 64.340000000000003 107.508 170.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -148.67 -71.39 0.2 Allowed 'General case' 0 C--O 1.233 0.192 0 O-C-N 121.156 -0.965 . . . . 62.409999999999997 110.848 -173.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.467 HG21 ' H ' ' A' ' 59' ' ' ASP . 54.9 t -83.51 -35.82 11.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 109.05 -0.722 . . . . 64.310000000000002 109.05 177.029 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -58.85 -44.62 91.02 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-O 117.958 -1.02 . . . . 74.540000000000006 109.308 169.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.405 ' CZ ' ' HE3' ' A' ' 71' ' ' LYS . 34.2 ttp85 -45.68 -58.47 3.42 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.684 0.794 . . . . 75.519999999999996 111.57 -177.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.405 ' HE3' ' CZ ' ' A' ' 70' ' ' ARG . 1.0 OUTLIER -69.83 -40.1 76.07 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 118.38 -0.819 . . . . 75.239999999999995 111.44 -175.831 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 38.6 mt -64.88 -48.06 75.62 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-N 119.2 0.909 . . . . 61.509999999999998 110.695 -179.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.73 -28.71 67.06 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 124.961 1.304 . . . . 74.5 111.816 -179.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.99 -47.88 67.31 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 118.899 0.772 . . . . 62.210000000000001 110.659 172.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.55 -55.26 18.74 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 107.738 -1.208 . . . . 71.299999999999997 107.738 -178.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 87.0 mt -87.18 34.57 0.69 Allowed 'General case' 0 C--O 1.233 0.222 0 C-N-CA 127.416 2.286 . . . . 74.239999999999995 111.907 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -53.24 115.37 1.86 Allowed 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 107.251 -1.388 . . . . 75.319999999999993 107.251 171.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 87.37 4.24 80.87 Favored Glycine 0 CA--C 1.532 1.102 0 C-N-CA 124.929 1.252 . . . . 35.210000000000001 114.163 176.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.456 ' HE3' HD23 ' A' ' 41' ' ' LEU . 28.9 mtmm -133.64 5.34 3.68 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 125.134 1.374 . . . . 73.519999999999996 112.416 -174.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -144.62 177.73 8.48 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.052 1.341 . . . . 74.230000000000004 108.91 170.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -143.51 164.74 29.5 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 126.754 2.022 . . . . 75.400000000000006 107.319 177.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -58.93 -54.81 42.95 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 124.085 0.954 . . . . 71.540000000000006 110.666 176.264 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -71.96 -11.77 60.93 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 122.978 0.511 . . . . 74.140000000000001 111.943 -178.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 54.3 m -84.09 -52.07 6.58 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 108.498 -0.927 . . . . 41.299999999999997 108.498 174.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 71.8 mt -55.77 -46.65 79.86 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 120.23 1.377 . . . . 74.530000000000001 109.068 178.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.46 -28.92 60.95 Favored 'General case' 0 C--N 1.344 0.347 0 N-CA-C 112.55 0.574 . . . . 63.399999999999999 112.55 -177.527 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.3 -44.47 12.83 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 124.121 0.969 . . . . 73.310000000000002 109.952 176.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 6.3 tptt -66.59 -48.82 68.36 Favored 'General case' 0 CA--C 1.521 -0.149 0 C-N-CA 125.98 1.712 . . . . 72.319999999999993 111.738 -166.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.44 -29.02 69.66 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 119.13 0.877 . . . . 72.430000000000007 111.183 -178.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 57.1 t -72.92 -31.12 34.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 123.805 0.842 . . . . 54.100000000000001 110.562 174.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.06 -53.75 54.08 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 126.981 2.112 . . . . 72.109999999999999 112.946 -162.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -67.24 22.82 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 127.988 2.515 . . . . 63.509999999999998 113.88 -171.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 6.7 ppt_? -65.3 -25.68 67.73 Favored 'General case' 0 N--CA 1.466 0.368 0 O-C-N 120.139 -1.601 . . . . 74.400000000000006 113.58 -169.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.85 -47.19 9.25 Favored 'General case' 0 C--N 1.332 -0.172 0 O-C-N 121.026 -1.047 . . . . 74.109999999999999 109.044 178.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.8 m -55.14 -29.66 58.22 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.79 1.236 . . . . 65.400000000000006 110.891 175.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.743 ' HB1' ' HD3' ' A' ' 28' ' ' ARG . . . -56.59 -45.54 81.34 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.826 1.25 . . . . 32.219999999999999 112.49 173.169 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 26.1 ttt-85 -63.36 -51.83 64.29 Favored 'General case' 0 CA--C 1.517 -0.292 0 O-C-N 120.828 -1.17 . . . . 73.519999999999996 108.663 175.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.62 -55.41 32.38 Favored 'General case' 0 N--CA 1.444 -0.754 0 O-C-N 125.022 1.451 . . . . 74.319999999999993 110.669 -168.478 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -57.51 -42.28 82.5 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-O 118.732 -0.652 . . . . 74.420000000000002 112.427 -174.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 39.4 mm -64.25 -39.75 86.62 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-N 119.903 1.229 . . . . 53.039999999999999 110.541 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 61.8 mt -71.37 -11.74 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 O-C-N 121.5 -0.75 . . . . 71.400000000000006 109.355 178.173 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.16 4.91 34.57 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.26 1.424 . . . . 74.200000000000003 111.579 176.009 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 80.5 mt-10 -124.52 29.18 6.37 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 125.198 1.399 . . . . 75.430000000000007 108.791 -174.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.6 mm . . . . . 0 C--O 1.251 1.163 0 N-CA-C 105.54 -2.022 . . . . 74.239999999999995 105.54 169.532 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.4 ptt? . . . . . 0 N--CA 1.476 0.872 0 CA-C-O 118.894 -0.574 . . . . 73.319999999999993 109.727 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.6 m 60.97 68.02 0.77 Allowed 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.151 1.38 . . . . 65.219999999999999 109.442 174.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 12.5 t -144.68 144.57 31.29 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 106.313 -1.736 . . . . 72.450000000000003 106.313 173.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 18.6 p90 -80.3 176.08 10.08 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.101 -1.074 . . . . 62.229999999999997 108.101 152.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.9 t0 174.67 -55.21 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 129.237 3.015 . . . . 74.340000000000003 104.743 171.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -60.28 -51.99 67.19 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 128.599 2.759 . . . . 70.540000000000006 112.588 173.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.9 ptp180 -83.73 126.99 33.46 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.035 -1.098 . . . . 74.340000000000003 108.035 -171.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -89.03 178.78 6.31 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 124.667 1.187 . . . . 71.150000000000006 108.939 175.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 23.2 mtm105 -61.9 169.35 2.63 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 122.446 1.117 . . . . 74.239999999999995 111.023 171.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -91.51 18.15 7.71 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.904 -1.044 . . . . 71.209999999999994 113.393 -166.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . 0.32 0.1 OUTLIER 43.82 16.61 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 130.846 3.659 . . . . 73.510000000000005 113.467 -168.005 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -75.9 114.1 14.14 Favored 'General case' 0 N--CA 1.444 -0.759 0 O-C-N 119.751 -1.843 . . . . 73.129999999999995 108.061 -171.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 60.81 31.67 20.07 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.896 2.078 . . . . 65.420000000000002 114.862 -174.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -100.11 -25.33 14.32 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 115.429 1.64 . . . . 74.129999999999995 115.429 -177.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -74.99 0.32 16.25 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 114.705 1.372 . . . . 73.530000000000001 114.705 -166.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -113.11 25.47 11.34 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.577 1.081 . . . . 65.510000000000005 110.085 173.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -151.38 174.65 13.09 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 124.925 1.29 . . . . 64.409999999999997 108.656 -179.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 60.85 -160.11 0.31 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.635 1.174 . . . . 74.319999999999993 108.852 171.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -137.11 -35.81 0.68 Allowed 'General case' 0 C--N 1.332 -0.173 0 O-C-N 120.375 -1.453 . . . . 73.109999999999999 111.237 161.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -47.83 -54.44 12.45 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.245 1.018 . . . . 74.430000000000007 112.712 -170.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.4 mt -77.74 -29.91 51.33 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.852 -0.53 . . . . 61.329999999999998 111.739 -172.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -63.52 -49.48 73.34 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 108.974 -0.75 . . . . 74.340000000000003 108.974 174.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -55.7 -39.5 71.12 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.949 0.899 . . . . 70.519999999999996 110.934 -178.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -44.8 -48.36 10.95 Favored 'General case' 0 C--N 1.344 0.336 0 C-N-CA 124.281 1.032 . . . . 61.100000000000001 111.777 173.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.433 ' HB1' ' HA ' ' A' ' 97' ' ' ARG . . . -64.72 -49.15 71.99 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.565 1.146 . . . . 74.129999999999995 111.441 -178.266 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -71.0 -18.09 62.61 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 121.975 -0.453 . . . . 71.510000000000005 110.982 -176.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -113.37 55.06 0.72 Allowed 'General case' 0 C--O 1.237 0.41 0 C-N-CA 125.265 1.426 . . . . 74.200000000000003 109.025 -176.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.4 mmt-85 -121.97 -7.66 8.91 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 126.048 1.739 . . . . 53.009999999999998 112.261 172.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 36.8 mtm-85 -53.38 -53.85 45.24 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 119.599 1.091 . . . . 71.430000000000007 112.192 -168.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -82.34 -15.23 53.6 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.501 -0.75 . . . . 74.430000000000007 112.604 -167.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.83 -14.21 59.65 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 119.033 0.833 . . . . 61.420000000000002 112.808 -169.013 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -127.83 3.65 6.02 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.973 2.109 . . . . 54.399999999999999 112.027 -171.334 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 56.7 tp -56.41 -30.13 62.41 Favored 'General case' 0 N--CA 1.461 0.1 0 C-N-CA 128.607 2.763 . . . . 72.310000000000002 111.807 174.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.403 ' HA3' ' HA ' ' A' ' 52' ' ' ALA . . . -45.8 -46.81 13.81 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 124.791 1.186 . . . . 71.430000000000007 113.016 170.154 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -63.0 -22.49 66.89 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.768 1.227 . . . . 71.230000000000004 111.938 -172.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.438 ' CD2' ' HG2' ' A' ' 88' ' ' LYS . 5.8 t90 -64.07 -72.66 0.14 Allowed 'General case' 0 C--N 1.343 0.307 0 N-CA-C 107.913 -1.143 . . . . 71.239999999999995 107.913 168.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.93 -29.2 62.89 Favored 'General case' 0 C--O 1.221 -0.441 0 C-N-CA 126.314 1.846 . . . . 52.240000000000002 112.193 -171.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -47.36 -49.27 24.86 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.987 0.812 . . . . 23.510000000000002 111.52 -179.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.46 -35.9 91.75 Favored Glycine 0 CA--C 1.534 1.242 0 CA-C-N 118.352 0.523 . . . . 62.219999999999999 112.869 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.413 HD12 ' N ' ' A' ' 40' ' ' LEU . 3.2 mp -64.98 -39.29 93.26 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.649 1.58 . . . . 71.430000000000007 109.339 178.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.9 mp -73.04 -9.68 58.98 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 127.324 2.25 . . . . 50.0 112.977 172.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 71.44 29.7 67.76 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 125.806 1.67 . . . . 75.209999999999994 112.188 -176.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -111.22 139.06 46.91 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 119.551 1.676 . . . . 62.299999999999997 107.228 170.746 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.1 p -135.73 175.87 9.2 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 107.254 -1.387 . . . . 75.319999999999993 107.254 168.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 60.48 -126.74 41.99 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.487 -1.045 . . . . 72.430000000000007 110.487 173.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -78.29 -34.69 48.65 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 123.974 0.91 . . . . 75.409999999999997 110.512 -170.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.79 -35.2 79.82 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.773 0.829 . . . . 55.399999999999999 109.621 173.309 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.32 -42.06 69.08 Favored 'General case' 0 C--N 1.339 0.109 0 O-C-N 121.961 -0.462 . . . . 64.510000000000005 111.15 170.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.0 ttm180 -55.79 -47.43 77.12 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.436 0.694 . . . . 62.329999999999998 111.603 -176.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.76 -50.6 73.19 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.357 0.526 . . . . 73.129999999999995 110.203 -178.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -53.31 -42.78 67.0 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.693 1.197 . . . . 70.430000000000007 111.477 173.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.403 ' HA ' ' HA3' ' A' ' 34' ' ' GLY . . . -60.25 -24.62 65.03 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 124.071 0.948 . . . . 72.319999999999993 113.519 -178.438 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 43.9 mt -84.68 -14.8 47.42 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 118.05 -0.976 . . . . 73.329999999999998 111.977 -171.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 11.7 t -102.77 -28.14 12.27 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 119.989 1.268 . . . . 63.5 112.273 -173.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 1.6 p -72.43 96.57 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.325 0 C-N-CA 127.31 2.244 . . . . 64.120000000000005 109.892 172.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 11.0 p -148.97 152.42 12.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 C-N-CA 125.421 1.488 . . . . 73.510000000000005 108.701 152.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.449 HG23 HG23 ' A' ' 68' ' ' VAL . 0.1 OUTLIER -149.24 -85.91 0.09 Allowed 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 118.219 -0.896 . . . . 73.340000000000003 108.826 155.836 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.9 t -153.26 -86.42 0.06 Allowed 'General case' 0 C--O 1.226 -0.133 0 CA-C-N 120.012 1.278 . . . . 64.530000000000001 108.367 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -179.81 176.45 0.76 Allowed 'General case' 0 C--O 1.238 0.469 0 N-CA-C 107.405 -1.332 . . . . 70.209999999999994 107.405 -166.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.46 ' CZ ' ' HA ' ' A' ' 86' ' ' ARG . 0.1 OUTLIER -103.23 77.46 1.53 Allowed 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 127.09 2.156 . . . . 71.140000000000001 109.102 176.816 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.78 -32.27 70.66 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 119.267 -0.973 . . . . 65.200000000000003 109.995 -179.355 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -148.91 165.1 18.61 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 125.566 1.546 . . . . 65.219999999999999 109.102 173.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_endo -71.23 173.01 12.9 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.778 2.985 . . . . 70.230000000000004 112.1 176.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -168.69 -109.62 0.22 Allowed Glycine 0 CA--C 1.524 0.616 0 CA-C-O 119.216 -0.769 . . . . 70.0 111.694 -178.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -164.87 88.73 0.47 Allowed 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 126.863 2.065 . . . . 63.329999999999998 105.766 175.186 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 54.23 86.69 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.799 2.04 . . . . 73.099999999999994 112.462 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -121.09 -86.31 0.65 Allowed 'General case' 0 N--CA 1.48 1.051 0 CA-C-O 117.886 -1.054 . . . . 64.209999999999994 111.125 179.239 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.449 HG23 HG23 ' A' ' 57' ' ' THR . 14.1 p -63.06 -32.46 56.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 121.115 1.779 . . . . 73.540000000000006 110.646 178.666 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -78.1 -18.12 56.08 Favored 'General case' 0 C--O 1.221 -0.408 0 N-CA-C 116.084 1.883 . . . . 65.099999999999994 116.084 176.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 22.1 ttt180 -55.36 -57.37 12.14 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 122.375 2.352 . . . . 70.200000000000003 114.286 -169.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -74.57 3.33 7.9 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 122.989 0.516 . . . . 65.540000000000006 111.559 -174.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 18.1 tp -112.78 -63.94 1.37 Allowed 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 127.872 2.469 . . . . 65.519999999999996 108.465 -174.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -51.29 -40.37 58.81 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 127.02 2.128 . . . . 73.129999999999995 111.418 177.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -76.27 -27.01 56.5 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 112.87 0.692 . . . . 74.400000000000006 112.87 -179.203 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.55 -9.22 59.5 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 123.693 0.797 . . . . 65.409999999999997 110.492 172.252 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 69.0 mt -116.48 34.99 4.75 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 128.723 2.809 . . . . 73.109999999999999 110.916 177.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -54.55 110.93 0.7 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.157 1.383 . . . . 53.109999999999999 108.618 176.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 86.2 2.64 85.51 Favored Glycine 0 CA--C 1.529 0.956 0 C-N-CA 125.439 1.495 . . . . 41.030000000000001 114.957 -179.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -127.24 1.25 6.41 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 118.871 1.336 . . . . 74.310000000000002 112.193 -165.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -147.64 -172.85 4.13 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.733 1.213 . . . . 63.43 109.498 172.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.519 ' H ' ' HB ' ' A' ' 84' ' ' THR . 33.0 m-20 -146.84 170.38 17.16 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 126.976 2.11 . . . . 73.109999999999999 105.799 165.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -55.13 -47.55 74.89 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.227 1.011 . . . . 61.140000000000001 110.356 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -82.88 -24.21 33.28 Favored 'General case' 0 CA--C 1.534 0.354 0 O-C-N 121.333 -0.854 . . . . 70.510000000000005 111.339 -177.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.519 ' HB ' ' H ' ' A' ' 81' ' ' ASP . 79.5 m -64.29 -39.13 93.3 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 120.737 -1.227 . . . . 70.400000000000006 108.909 172.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 96.8 mt -61.15 -50.33 80.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 O-C-N 121.116 -0.99 . . . . 50.119999999999997 109.345 173.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.46 ' HA ' ' CZ ' ' A' ' 60' ' ' PHE . 0.0 OUTLIER -64.53 -32.26 73.83 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 118.966 -1.094 . . . . 61.520000000000003 111.087 -174.985 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.09 -53.05 60.87 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 109.203 -0.666 . . . . 73.519999999999996 109.203 172.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.438 ' HG2' ' CD2' ' A' ' 36' ' ' TRP . 0.0 OUTLIER -60.66 -44.88 95.94 Favored 'General case' 0 N--CA 1.463 0.178 0 O-C-N 120.956 -1.09 . . . . 74.140000000000001 113.366 -173.101 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 59.7 mtt -59.92 -20.97 60.36 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 118.662 0.665 . . . . 71.430000000000007 111.828 178.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 66.4 t -98.3 -25.51 4.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 C-N-CA 125.028 1.331 . . . . 74.439999999999998 110.542 -176.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -60.19 -54.03 50.63 Favored 'General case' 0 N--CA 1.463 0.201 0 O-C-N 120.75 -1.219 . . . . 61.399999999999999 108.56 173.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 4.0 pp -73.97 7.01 2.88 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.45 1.1 . . . . 73.420000000000002 112.85 -178.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 21.5 ttt-85 -56.24 -50.46 71.24 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 120.011 -1.681 . . . . 73.420000000000002 112.692 -176.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.34 -31.91 72.98 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 119.409 1.004 . . . . 73.5 112.388 -178.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 73.7 m -47.42 -36.64 10.15 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.284 1.434 . . . . 64.519999999999996 110.147 178.072 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -53.94 -46.65 71.61 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 124.983 1.313 . . . . 51.200000000000003 113.192 -175.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.433 ' HA ' ' HB1' ' A' ' 25' ' ' ALA . 15.6 ptt-85 -82.72 -34.78 27.15 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 120.541 -0.464 . . . . 63.399999999999999 111.364 178.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -59.29 -41.24 88.5 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.242 1.017 . . . . 65.439999999999998 109.634 -179.023 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 60.8 mm-40 -50.18 -49.92 50.91 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 126.463 1.905 . . . . 74.099999999999994 112.645 174.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 21.6 mm -59.61 -48.31 87.85 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-N 118.925 0.784 . . . . 65.329999999999998 109.047 178.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 97.7 mt -68.38 -5.16 4.01 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 C-N-CA 126.846 2.058 . . . . 63.420000000000002 110.888 -178.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -103.74 -17.86 14.92 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 125.419 1.488 . . . . 73.099999999999994 111.381 175.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -132.55 46.0 2.68 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 125.026 1.331 . . . . 70.400000000000006 109.324 -168.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 24.5 mt . . . . . 0 C--O 1.249 1.027 0 C-N-CA 130.277 3.431 . . . . 73.400000000000006 108.197 -176.455 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.7 ptt? . . . . . 0 N--CA 1.473 0.683 0 CA-C-O 118.784 -0.627 . . . . 71.519999999999996 112.447 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.2 t -91.66 -30.14 16.49 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.669 1.122 . . . . 75.129999999999995 109.778 -163.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.7 p -88.29 111.41 21.67 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 126.846 2.058 . . . . 74.209999999999994 107.676 174.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 35.5 p90 -147.05 176.68 9.75 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.229 1.012 . . . . 72.219999999999999 109.647 176.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -135.58 174.8 10.21 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 123.891 0.876 . . . . 73.129999999999995 109.404 175.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -124.08 -36.72 2.65 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 126.252 1.821 . . . . 74.540000000000006 110.806 -174.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 18.1 ptt180 -88.93 37.01 0.82 Allowed 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.994 1.27 . . . . 74.239999999999995 110.465 -179.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 -118.91 -15.85 9.3 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.245 1.418 . . . . 74.430000000000007 112.752 -169.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 44.6 mtm180 -94.67 163.59 13.31 Favored 'General case' 0 N--CA 1.464 0.268 0 O-C-N 120.378 -1.451 . . . . 74.329999999999998 109.244 156.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -160.41 71.05 0.43 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.406 1.483 . . . . 72.439999999999998 108.705 178.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -74.42 10.0 1.49 Allowed 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 115.719 1.748 . . . . 73.209999999999994 115.719 -172.051 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -45.0 -42.75 8.56 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 115.921 1.823 . . . . 72.239999999999995 115.921 -162.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -129.12 -1.16 5.17 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.969 1.308 . . . . 62.43 112.096 169.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.1 mtpt -63.57 -19.97 65.26 Favored 'General case' 0 C--O 1.223 -0.295 0 O-C-N 121.016 -1.052 . . . . 51.009999999999998 113.634 -171.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -49.22 -33.24 12.18 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 127.415 2.286 . . . . 73.299999999999997 114.559 -173.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.59 -20.67 63.63 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.154 0.582 . . . . 74.5 112.287 -178.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -113.98 -169.18 1.47 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 129.95 3.3 . . . . 70.540000000000006 105.915 178.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 57.94 -169.99 0.11 Allowed 'General case' 0 C--O 1.239 0.515 0 C-N-CA 124.516 1.126 . . . . 73.319999999999993 110.644 177.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -143.34 -48.06 0.3 Allowed 'General case' 0 C--N 1.333 -0.146 0 O-C-N 120.4 -1.437 . . . . 53.030000000000001 110.71 171.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 64.3 tt0 -60.55 -32.24 71.31 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.079 0.552 . . . . 72.140000000000001 110.937 -171.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 72.3 mt -71.81 -41.2 68.53 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.225 -0.922 . . . . 73.409999999999997 110.491 178.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -63.57 -42.72 98.29 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.3 1.04 . . . . 72.120000000000005 110.514 173.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -54.53 -41.55 69.83 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.001 0.92 . . . . 75.400000000000006 109.884 174.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.36 -16.66 6.01 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 117.267 -1.349 . . . . 64.219999999999999 114.1 175.452 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -97.01 -32.01 12.22 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 121.145 1.793 . . . . 70.540000000000006 113.642 173.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.0 tp10 -46.1 -43.09 14.5 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.805 1.642 . . . . 65.329999999999998 112.035 -176.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -91.42 26.3 2.31 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.046 1.338 . . . . 61.399999999999999 112.277 -167.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 2.8 mmt180 -112.23 2.73 16.75 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 120.569 -1.332 . . . . 73.430000000000007 111.924 177.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 19.3 mtt-85 -63.53 -23.92 67.59 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.332 1.423 . . . . 73.120000000000005 112.295 -175.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -135.11 -16.17 1.92 Allowed 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 117.067 -1.444 . . . . 63.530000000000001 114.559 173.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.07 6.88 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 128.112 2.565 . . . . 71.400000000000006 114.578 -173.117 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.443 HD13 HD22 ' A' ' 92' ' ' LEU . 0.3 OUTLIER -137.35 -1.7 2.08 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 127.456 2.302 . . . . 65.129999999999995 110.693 -166.956 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 52.3 tp -66.8 -30.75 71.03 Favored 'General case' 0 C--O 1.232 0.152 0 C-N-CA 127.104 2.162 . . . . 70.329999999999998 110.824 170.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -65.69 -43.8 93.62 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.924 -0.87 . . . . 52.130000000000003 110.924 170.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -65.08 -23.85 67.28 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 118.376 1.088 . . . . 71.519999999999996 111.996 -173.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 22.5 t90 -60.15 -69.28 0.22 Allowed 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 124.415 1.086 . . . . 74.230000000000004 108.97 168.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.0 -40.45 80.75 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 122.954 0.502 . . . . 72.409999999999997 111.699 -177.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.26 -54.72 27.7 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.669 1.187 . . . . 61.32 109.908 173.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -64.08 -36.44 93.25 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-N 117.866 0.303 . . . . 25.440000000000001 112.389 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 38.2 mt -62.63 -38.98 92.37 Favored 'General case' 0 C--O 1.233 0.225 0 O-C-N 120.766 -1.432 . . . . 65.439999999999998 110.696 176.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 92.5 mt -88.16 6.87 34.51 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 126.951 2.1 . . . . 63.140000000000001 113.282 -178.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 81.82 12.95 80.63 Favored Glycine 0 CA--C 1.531 1.093 0 CA-C-N 119.839 1.2 . . . . 72.099999999999994 113.996 171.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 15.4 mttm -90.83 149.47 21.95 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 126.026 1.73 . . . . 53.210000000000001 109.888 172.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.0 p -148.72 175.71 10.98 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 126.863 2.065 . . . . 71.5 110.054 178.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 58.08 -135.51 51.74 Favored Glycine 0 CA--C 1.525 0.667 0 C-N-CA 124.322 0.963 . . . . 71.099999999999994 111.72 172.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -51.62 -46.41 63.62 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.934 1.294 . . . . 73.340000000000003 111.163 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.8 -38.35 87.78 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.325 -0.852 . . . . 72.540000000000006 110.385 -173.647 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -74.0 -45.09 52.05 Favored 'General case' 0 N--CA 1.455 -0.22 0 O-C-N 121.887 -0.508 . . . . 34.409999999999997 111.075 171.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 52.0 mtm-85 -59.07 -55.23 37.69 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 118.058 -0.972 . . . . 73.430000000000007 112.633 -172.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.18 -34.39 77.92 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 118.331 -0.842 . . . . 52.32 110.196 -172.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -61.82 -45.47 93.69 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-O 121.835 0.826 . . . . 74.430000000000007 109.858 173.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.18 -26.61 68.44 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 120.563 -1.336 . . . . 73.420000000000002 113.277 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 41.3 mt -84.22 -12.82 54.16 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.757 1.223 . . . . 75.319999999999993 111.158 177.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 40.9 p -105.27 3.37 29.91 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 119.609 1.095 . . . . 75.400000000000006 111.699 175.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.2 t -118.1 98.68 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 C-N-CA 126.039 1.736 . . . . 72.239999999999995 108.191 -173.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 1.9 t -129.65 66.66 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 N-CA-C 107.658 -1.238 . . . . 54.439999999999998 107.658 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . 0.278 6.6 t 51.28 -164.67 0.05 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.199 1.8 . . . . 74.430000000000007 111.425 -178.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -165.38 -154.31 0.21 Allowed 'General case' 0 C--O 1.239 0.532 0 C-N-CA 129.253 3.021 . . . . 74.230000000000004 103.411 156.682 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -84.18 -176.82 6.44 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 120.518 1.508 . . . . 42.350000000000001 113.05 177.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -145.6 -13.17 0.5 Allowed 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 127.167 2.187 . . . . 74.530000000000001 110.903 175.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -68.62 -168.18 0.11 Allowed 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 119.586 1.084 . . . . 75.230000000000004 110.011 165.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 46.98 72.78 1.15 Allowed Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 126.296 1.838 . . . . 74.140000000000001 112.423 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -74.61 158.71 43.47 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 124.991 3.794 . . . . 73.129999999999995 111.987 -172.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 92.04 -5.35 78.7 Favored Glycine 0 CA--C 1.532 1.118 0 C-N-CA 124.491 1.043 . . . . 64.239999999999995 112.601 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -121.09 57.08 1.0 Allowed 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 126.99 2.116 . . . . 75.409999999999997 106.821 -165.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -44.53 102.12 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 130.715 3.606 . . . . 62.149999999999999 109.397 178.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -128.2 -83.6 0.59 Allowed 'General case' 0 N--CA 1.467 0.38 0 O-C-N 121.61 -0.681 . . . . 61.43 110.362 170.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 7.1 p -61.74 -45.7 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 CA-C-N 119.091 0.859 . . . . 72.25 110.276 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -64.91 -23.05 67.11 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 115.037 1.495 . . . . 75.409999999999997 115.037 170.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 75.7 ttt-85 -63.12 -54.29 40.2 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 121.172 1.806 . . . . 70.430000000000007 110.604 -178.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -71.74 9.35 0.9 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.995 0.918 . . . . 63.299999999999997 111.567 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 69.0 mt -132.86 -5.07 3.16 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 124.794 1.238 . . . . 65.219999999999999 114.185 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -100.75 -79.65 0.5 Allowed 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.86 1.264 . . . . 74.310000000000002 108.053 173.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.02 -45.73 91.82 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 118.422 0.556 . . . . 65.200000000000003 110.339 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.77 -29.51 66.85 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.078 0.551 . . . . 74.219999999999999 110.858 -175.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 10.4 tp -111.7 19.35 18.14 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 127.085 2.154 . . . . 73.219999999999999 111.213 -166.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -44.56 126.82 5.69 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 127.075 2.15 . . . . 65.430000000000007 111.635 -169.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 86.54 -12.21 61.7 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 126.231 1.872 . . . . 74.230000000000004 113.579 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 32.2 mtmm -117.31 10.63 13.76 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.689 1.195 . . . . 71.510000000000005 110.445 -175.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -147.03 175.03 11.0 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 126.39 1.876 . . . . 71.340000000000003 110.02 177.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.505 ' H ' ' HB ' ' A' ' 84' ' ' THR . 2.8 m-20 -150.14 172.38 15.38 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 105.617 -1.994 . . . . 63.539999999999999 105.617 154.254 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -55.67 -52.03 65.25 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 124.672 1.189 . . . . 73.120000000000005 109.38 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -66.42 -29.98 70.25 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.821 0.848 . . . . 71.409999999999997 111.036 -178.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.505 ' HB ' ' H ' ' A' ' 81' ' ' ASP . 99.0 m -70.19 -44.48 68.6 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 118.541 -0.742 . . . . 65.409999999999997 109.193 -179.205 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 69.7 mt -55.15 -46.48 77.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 CA-C-N 119.829 1.195 . . . . 71.409999999999997 109.616 -175.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.98 -47.97 76.7 Favored 'General case' 0 C--N 1.347 0.496 0 CA-C-O 121.595 0.712 . . . . 72.209999999999994 109.568 -179.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -88.01 29.38 0.94 Allowed 'General case' 0 N--CA 1.443 -0.808 0 C-N-CA 125.552 1.541 . . . . 73.310000000000002 111.025 -176.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.31 -48.51 2.88 Favored 'General case' 0 CA--C 1.513 -0.466 0 O-C-N 121.111 -0.993 . . . . 62.539999999999999 109.132 158.349 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 27.0 mtm -57.49 -42.64 83.09 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 117.771 0.26 . . . . 74.340000000000003 111.052 -176.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 27.1 t -79.81 -31.88 13.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 124.347 1.059 . . . . 63.439999999999998 111.957 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -62.18 -24.81 67.41 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.883 1.273 . . . . 71.549999999999997 112.604 -170.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.443 HD22 HD13 ' A' ' 32' ' ' LEU . 20.8 mt -86.84 -1.05 57.48 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 114.941 1.46 . . . . 73.420000000000002 114.941 -165.151 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 73.6 mtp180 -56.45 -50.01 72.94 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 120.306 -1.496 . . . . 71.510000000000005 112.844 -171.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.02 -20.39 59.64 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 120.031 1.287 . . . . 62.43 112.105 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.6 m -56.5 -25.35 51.12 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.064 0.847 . . . . 74.420000000000002 110.373 176.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.13 -51.34 69.71 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 114.556 1.317 . . . . 74.430000000000007 114.556 176.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -74.93 -38.22 61.83 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 108.994 -0.743 . . . . 70.409999999999997 108.994 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -56.2 -53.68 54.28 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 124.955 1.302 . . . . 72.420000000000002 109.454 -175.739 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -58.29 -44.58 88.55 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-O 118.839 -0.601 . . . . 74.219999999999999 112.529 -174.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 16.9 mm -65.2 -42.02 93.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 119.079 0.854 . . . . 73.200000000000003 109.003 -178.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 98.0 mt -69.74 -15.71 19.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 N-CA-C 109.479 -0.563 . . . . 74.310000000000002 109.479 177.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -85.78 -11.0 54.62 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 126.012 1.725 . . . . 62.310000000000002 111.225 174.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 66.6 mt-10 -129.77 42.03 3.34 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 128.177 2.591 . . . . 61.340000000000003 108.925 -166.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 92.7 mt . . . . . 0 C--O 1.255 1.372 0 N-CA-C 108.697 -0.853 . . . . 71.510000000000005 108.697 -177.145 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.9 tpt . . . . . 0 N--CA 1.465 0.3 0 N-CA-C 108.328 -0.99 . . . . 64.109999999999999 108.328 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 14.1 p -65.85 163.09 17.56 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.171 0.588 . . . . 74.519999999999996 110.136 175.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 13.4 t -148.86 162.42 39.88 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.473 -0.936 . . . . 73.140000000000001 108.473 170.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -91.05 163.6 14.25 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 107.656 -1.238 . . . . 71.540000000000006 107.656 170.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -70.71 156.1 39.91 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 109.047 -0.723 . . . . 62.420000000000002 109.047 172.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -133.45 158.04 44.09 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 125.278 1.431 . . . . 74.549999999999997 109.572 178.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 14.6 mmt180 -78.9 80.85 5.23 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 107.717 -1.216 . . . . 74.040000000000006 107.717 177.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.423 ' HG2' ' H ' ' A' ' 9' ' ' ARG . 3.8 pt-20 -74.4 -46.5 39.88 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.564 -0.743 . . . . 74.239999999999995 111.338 -163.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.423 ' H ' ' HG2' ' A' ' 8' ' ' GLU . 3.5 mpp_? -101.41 172.33 7.05 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.581 1.553 . . . . 73.239999999999995 110.357 173.551 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 62.39 45.87 6.24 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 127.311 2.244 . . . . 33.32 112.311 -171.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . 0.497 ' HB3' HD13 ' A' ' 21' ' ' LEU . 0.7 OUTLIER -58.44 -17.66 22.48 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.325 0.861 . . . . 62.420000000000002 113.325 164.453 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -46.38 -42.46 15.02 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 128.87 2.868 . . . . 73.219999999999999 112.75 -172.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.07 13.82 13.03 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.8 1.24 . . . . 71.109999999999999 111.329 178.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 19.0 mttm -108.25 -13.24 14.94 Favored 'General case' 0 C--O 1.225 -0.199 0 C-N-CA 124.596 1.159 . . . . 54.439999999999998 112.398 176.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -64.35 -27.02 68.73 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 120.494 1.497 . . . . 74.030000000000001 110.86 170.288 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -86.94 26.24 1.18 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.698 1.599 . . . . 63.210000000000001 112.36 173.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -167.54 -167.94 0.96 Allowed 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 119.465 1.03 . . . . 74.030000000000001 109.965 -178.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 57.8 -160.7 0.24 Allowed 'General case' 0 C--O 1.238 0.474 0 C-N-CA 125.765 1.626 . . . . 72.239999999999995 110.499 165.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -140.19 -32.86 0.59 Allowed 'General case' 0 C--O 1.219 -0.532 0 O-C-N 120.985 -1.072 . . . . 72.329999999999998 111.029 160.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -49.31 -41.66 38.99 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 125.274 1.43 . . . . 64.540000000000006 111.985 -168.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.497 HD13 ' HB3' ' A' ' 11' ' ' HIS . 67.9 mt -91.62 -37.28 13.17 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 119.048 -0.501 . . . . 73.349999999999994 110.785 -176.266 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 27.0 t30 -53.33 -45.18 68.97 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 119.106 0.867 . . . . 63.240000000000002 110.539 170.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -60.87 -39.77 90.45 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 125.801 1.641 . . . . 73.140000000000001 110.499 -178.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -45.78 -44.92 14.36 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 121.181 -0.949 . . . . 75.019999999999996 110.964 171.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.581 ' HB1' ' HA ' ' A' ' 97' ' ' ARG . . . -75.31 -62.19 1.65 Allowed 'General case' 0 C--O 1.235 0.312 0 C-N-CA 126.208 1.803 . . . . 74.329999999999998 112.915 177.076 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -61.51 -16.54 48.48 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.741 1.216 . . . . 71.420000000000002 111.713 -173.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -119.49 37.39 4.18 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.331 1.852 . . . . 33.140000000000001 111.366 -177.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.13 6.12 4.2 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 121.289 -0.882 . . . . 60.329999999999998 112.634 168.387 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 43.2 ptt85 -63.36 -19.05 64.31 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 120.566 -1.334 . . . . 72.400000000000006 113.27 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -78.72 -20.36 50.24 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 119.803 1.183 . . . . 75.120000000000005 112.142 175.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.49 -19.06 63.75 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 120.323 1.419 . . . . 74.349999999999994 112.65 -168.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.19 2.14 9.18 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.709 2.004 . . . . 60.030000000000001 111.684 -168.495 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.5 mt -60.96 -28.8 69.24 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.702 1.201 . . . . 64.430000000000007 111.336 171.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -61.24 -37.2 93.61 Favored Glycine 0 C--O 1.223 -0.533 0 N-CA-C 111.317 -0.713 . . . . 61.229999999999997 111.317 -178.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -62.28 -33.51 74.78 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.419 1.088 . . . . 72.150000000000006 110.227 -170.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 10.2 t90 -62.65 -65.09 0.74 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.689 1.596 . . . . 64.109999999999999 110.044 170.268 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.26 -21.09 66.69 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.412 0.685 . . . . 61.119999999999997 112.481 -171.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -70.77 -55.3 8.9 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 125.024 1.33 . . . . 55.43 109.257 168.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -49.26 -45.07 35.16 Favored Glycine 0 CA--C 1.527 0.842 0 C-N-CA 124.231 0.919 . . . . 54.5 112.042 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 16.1 mt -61.06 -32.74 72.37 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.496 1.118 . . . . 74.329999999999998 113.89 179.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 95.7 mt -85.66 -3.45 58.89 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.365 1.066 . . . . 73.030000000000001 112.446 176.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.11 19.69 56.87 Favored Glycine 0 CA--C 1.526 0.763 0 CA-C-O 118.424 -1.209 . . . . 42.409999999999997 113.374 -175.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 14.3 mmtp -101.53 119.18 38.37 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 125.81 1.644 . . . . 72.430000000000007 108.655 177.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.8 p -152.6 135.56 15.57 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.433 0.693 . . . . 55.340000000000003 110.827 -179.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 87.59 -148.85 21.39 Favored Glycine 0 CA--C 1.533 1.2 0 N-CA-C 110.894 -0.883 . . . . 75.310000000000002 110.894 -164.23 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -63.96 -22.11 66.78 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.937 1.458 . . . . 73.019999999999996 114.937 -161.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.76 -51.29 23.44 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 108.253 -1.018 . . . . 74.230000000000004 108.253 175.31 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -56.51 -40.19 74.6 Favored 'General case' 0 C--N 1.344 0.334 0 O-C-N 121.69 -0.631 . . . . 71.310000000000002 109.886 171.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.02 -25.58 67.74 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.756 1.223 . . . . 75.319999999999993 113.002 179.623 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.05 -51.66 11.83 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 119.533 1.06 . . . . 74.010000000000005 109.663 169.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -60.15 -29.08 68.42 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.266 1.026 . . . . 64.349999999999994 112.822 -177.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.0 -18.97 49.92 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 120.461 -1.399 . . . . 55.420000000000002 112.513 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 22.0 mt -90.74 -15.38 30.33 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.126 0.97 . . . . 71.209999999999994 111.651 -168.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.8 t -95.92 -29.26 14.28 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.64 1.176 . . . . 63.340000000000003 111.411 -178.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 5.3 p -70.8 8.53 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 126.202 1.801 . . . . 43.509999999999998 114.374 -166.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 5.2 m -104.14 49.12 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 O-C-N 119.196 -2.19 . . . . 75.319999999999993 112.004 -163.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.4 t -58.74 -50.48 73.76 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 109.797 -0.446 . . . . 63.0 109.797 172.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.0 t 52.3 69.43 0.68 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.539 1.136 . . . . 64.299999999999997 108.784 -167.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.2 t0 -146.65 108.01 4.25 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 105.114 -2.18 . . . . 72.099999999999994 105.114 179.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -170.9 23.16 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.167 0.587 . . . . 75.019999999999996 111.902 -168.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -92.61 81.89 4.8 Favored 'General case' 0 N--CA 1.464 0.246 0 O-C-N 120.555 -1.341 . . . . 61.399999999999999 111.06 -170.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 56.33 61.26 7.53 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 124.827 1.251 . . . . 72.409999999999997 109.295 -169.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -80.59 178.92 6.51 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 124.279 3.32 . . . . 71.129999999999995 113.448 -161.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.16 -171.44 7.55 Favored Glycine 0 CA--C 1.534 1.265 0 C-N-CA 125.141 1.353 . . . . 54.200000000000003 113.691 177.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -85.69 2.37 45.6 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 127.232 2.213 . . . . 72.409999999999997 111.126 178.548 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 178.32 -163.19 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.367 1.867 . . . . 70.0 107.958 -168.162 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . 0.268 5.1 t70 68.53 -66.29 0.24 Allowed 'General case' 0 CA--C 1.518 -0.278 0 C-N-CA 131.378 3.871 . . . . 71.230000000000004 111.725 -172.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 30.1 t -47.76 -63.57 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 125.448 1.499 . . . . 74.409999999999997 108.476 170.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -79.37 -5.23 54.12 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 115.011 1.486 . . . . 75.140000000000001 115.011 -179.382 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.2 ptt180 -54.07 -19.85 5.55 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 115.486 1.661 . . . . 74.299999999999997 115.486 -172.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -113.21 -10.84 13.33 Favored 'General case' 0 CA--C 1.516 -0.345 0 C-N-CA 124.034 0.934 . . . . 62.229999999999997 112.648 177.339 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 17.9 tp -94.34 -58.43 2.21 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.881 1.273 . . . . 73.120000000000005 108.086 -175.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.32 -49.14 70.38 Favored 'General case' 0 C--O 1.223 -0.291 0 C-N-CA 124.897 1.279 . . . . 43.119999999999997 109.529 170.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.9 -20.58 65.94 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 114.314 1.227 . . . . 53.399999999999999 114.314 -178.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.08 -52.75 8.26 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 106.954 -1.498 . . . . 62.43 106.954 170.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 90.5 mt -80.39 39.67 0.47 Allowed 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 127.264 2.225 . . . . 73.340000000000003 110.785 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 62.0 tt0 -55.67 113.26 1.39 Allowed 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 126.579 1.952 . . . . 75.010000000000005 107.504 173.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 80.19 6.95 88.95 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 124.491 1.043 . . . . 53.140000000000001 114.58 -177.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 27.2 mtmm -130.43 -2.58 4.36 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 118.779 1.29 . . . . 75.040000000000006 113.443 -176.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -151.33 106.68 3.33 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 119.993 1.269 . . . . 74.040000000000006 110.379 175.036 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -64.53 166.48 8.43 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 108.458 -0.942 . . . . 71.239999999999995 108.458 167.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -55.46 -39.47 70.39 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 120.85 -1.156 . . . . 64.409999999999997 110.47 177.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -75.73 -16.73 60.1 Favored 'General case' 0 CA--C 1.53 0.188 0 O-C-N 121.483 -0.761 . . . . 75.230000000000004 111.276 -177.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 96.3 m -68.75 -43.81 75.04 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 118.64 0.655 . . . . 54.119999999999997 109.625 170.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 3.1 mt -62.29 -57.08 13.7 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-N 119.9 1.227 . . . . 75.299999999999997 108.82 -176.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.96 -44.58 67.22 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-N 118.274 0.488 . . . . 74.109999999999999 111.528 178.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.28 -52.67 64.64 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 108.922 -0.77 . . . . 73.120000000000005 108.922 -177.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -63.85 -43.76 95.17 Favored 'General case' 0 CA--C 1.518 -0.285 0 C-N-CA 123.748 0.819 . . . . 72.319999999999993 112.869 -174.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 10.0 mtt -58.29 -42.92 87.65 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 118.887 0.767 . . . . 60.219999999999999 110.757 177.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 60.0 t -68.68 -40.24 81.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 124.086 0.954 . . . . 35.210000000000001 110.39 179.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -58.26 -52.5 65.34 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 119.655 1.116 . . . . 72.310000000000002 110.947 -173.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 22.3 mt -67.97 1.68 2.53 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.509 1.924 . . . . 60.210000000000001 112.765 -168.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -67.83 -19.39 65.05 Favored 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 125.307 1.443 . . . . 72.200000000000003 112.112 -176.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -76.81 -56.27 4.75 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 119.994 1.27 . . . . 63.229999999999997 109.293 172.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 55.3 m -51.21 -36.85 43.57 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.21 1.404 . . . . 64.129999999999995 110.566 177.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.33 -50.82 68.64 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.693 0.797 . . . . 60.229999999999997 113.033 175.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.581 ' HA ' ' HB1' ' A' ' 25' ' ' ALA . 12.1 ptm180 -76.87 -35.7 57.28 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 118.522 0.601 . . . . 74.019999999999996 110.645 -179.175 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -61.47 -37.99 85.62 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 124.955 1.302 . . . . 73.329999999999998 111.817 179.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -63.37 -20.76 65.81 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 119.235 0.925 . . . . 73.219999999999999 112.854 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 41.9 mm -79.34 -29.49 13.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 CA-C-N 119.328 0.967 . . . . 73.019999999999996 110.605 174.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 15.9 mm -61.14 -23.78 31.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 N-CA-C 108.641 -0.874 . . . . 75.049999999999997 108.641 167.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -93.76 9.65 36.25 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.523 0.729 . . . . 74.409999999999997 111.779 176.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 88.3 mt-10 -132.29 37.49 3.54 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.582 1.953 . . . . 73.349999999999994 108.886 -179.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 96.9 mt . . . . . 0 C--O 1.254 1.339 0 C-N-CA 125.779 1.631 . . . . 75.310000000000002 109.331 166.456 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.468 0 N-CA-C 106.799 -1.556 . . . . 75.299999999999997 106.799 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 26.6 m 62.5 114.93 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.571 1.148 . . . . 75.040000000000006 109.301 -158.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -146.07 168.61 20.53 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.302 1.441 . . . . 71.140000000000001 108.675 178.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 12.7 t80 70.04 -70.17 0.15 Allowed 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 127.085 2.154 . . . . 75.140000000000001 112.009 175.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 61.36 13.1 4.71 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 126.997 2.119 . . . . 61.439999999999998 114.449 167.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.7 t0 -87.54 115.28 24.86 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 125.312 1.445 . . . . 43.310000000000002 107.29 170.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 22.8 ptt85 -46.14 139.69 4.4 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.995 2.118 . . . . 75.030000000000001 112.631 -174.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -72.36 174.0 7.95 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-O 122.991 1.376 . . . . 73.099999999999994 110.558 174.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.5 mtm180 -93.15 -176.73 4.25 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.558 1.543 . . . . 71.230000000000004 109.164 -171.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 44.26 61.47 2.36 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.128 1.771 . . . . 72.230000000000004 113.268 170.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -59.64 -14.84 15.36 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 115.444 1.646 . . . . 74.420000000000002 115.444 -172.319 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.443 ' HG3' ' H ' ' A' ' 13' ' ' ALA . 7.0 pt-20 -44.94 -78.75 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.951 2.101 . . . . 73.099999999999994 113.306 -168.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.443 ' H ' ' HG3' ' A' ' 12' ' ' GLU . . . -81.56 -2.57 50.46 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.627 0.771 . . . . 72.0 112.655 -179.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 31.4 mttm -75.6 -11.04 59.93 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.115 0.966 . . . . 64.129999999999995 112.329 176.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -61.56 -27.04 68.34 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 120.536 1.516 . . . . 75.439999999999998 112.571 -174.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -86.86 16.0 5.3 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.583 1.553 . . . . 62.219999999999999 113.033 174.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 50.9 m-70 -140.69 -65.55 0.45 Allowed 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.077 1.751 . . . . 74.219999999999999 109.966 -173.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -84.24 84.78 7.5 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 126.047 1.739 . . . . 74.409999999999997 107.427 -172.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -56.87 -26.07 57.94 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 114.811 -1.086 . . . . 75.239999999999995 110.912 175.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.01 -34.19 77.84 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.505 1.122 . . . . 64.129999999999995 111.592 174.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 82.0 mt -77.51 -36.96 52.04 Favored 'General case' 0 C--O 1.232 0.184 0 O-C-N 120.215 -1.553 . . . . 73.299999999999997 109.451 173.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -66.52 -29.74 69.9 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 121.244 -0.91 . . . . 74.400000000000006 111.062 176.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -58.62 -45.9 88.22 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.809 1.244 . . . . 63.109999999999999 110.879 172.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.31 -30.92 13.07 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.773 0.829 . . . . 73.200000000000003 112.247 174.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.18 -24.65 34.86 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 113.73 1.011 . . . . 73.209999999999994 113.73 -174.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -79.84 -16.57 55.19 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 119.352 0.978 . . . . 62.439999999999998 110.972 173.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -74.26 -160.12 0.09 Allowed 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 126.389 1.876 . . . . 71.109999999999999 108.932 166.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.4 mmt180 59.7 -29.65 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 128.973 2.909 . . . . 44.32 115.818 -176.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.1 ptt180 -50.9 -12.86 0.12 Allowed 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 130.89 3.676 . . . . 75.420000000000002 116.114 -174.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 25.4 m120 -113.4 -23.57 9.79 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 119.574 1.079 . . . . 62.509999999999998 112.275 178.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.9 -44.45 91.23 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 120.9 1.682 . . . . 72.030000000000001 110.301 173.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -79.69 -13.39 59.51 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 113.451 0.908 . . . . 71.420000000000002 113.451 -171.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.43 HD11 ' HB2' ' A' ' 89' ' ' MET . 15.7 mt -62.02 -24.99 67.39 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.642 0.777 . . . . 70.430000000000007 111.681 173.45 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -57.55 -39.44 90.88 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.899 -0.88 . . . . 11.34 110.899 176.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -65.36 -35.05 79.81 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.631 1.215 . . . . 72.420000000000002 111.108 -179.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.5 ' CD1' ' HE2' ' A' ' 88' ' ' LYS . 56.4 t90 -66.19 -61.88 1.78 Allowed 'General case' 0 C--N 1.342 0.242 0 C-N-CA 123.738 0.815 . . . . 71.140000000000001 108.969 178.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -59.08 -39.95 83.71 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 119.123 -0.465 . . . . 74.409999999999997 110.985 -178.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.0 -50.31 73.09 Favored 'General case' 0 C--N 1.339 0.15 0 CA-C-N 118.981 0.81 . . . . 53.219999999999999 110.889 172.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -52.28 -50.4 46.86 Favored Glycine 0 C--N 1.335 0.504 0 C-N-CA 124.977 1.275 . . . . 71.329999999999998 110.96 179.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 91.4 mt -58.53 -51.34 70.28 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 123.816 0.846 . . . . 73.129999999999995 109.764 175.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 32.1 mt -66.19 -6.11 12.45 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 115.406 1.632 . . . . 65.25 115.406 -176.315 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 80.61 12.48 82.86 Favored Glycine 0 CA--C 1.529 0.929 0 CA-C-N 119.078 0.854 . . . . 54.350000000000001 112.626 -177.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 57.8 mttt -87.86 129.1 35.31 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 118.834 1.317 . . . . 64.519999999999996 108.4 170.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 61.2 p -144.53 160.43 41.14 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.825 0.85 . . . . 70.319999999999993 108.764 167.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.82 -145.33 32.41 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 110.488 -1.045 . . . . 53.140000000000001 110.488 -175.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -57.36 -35.23 69.69 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.741 1.217 . . . . 45.25 110.583 -178.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -54.21 -43.56 70.89 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.309 1.044 . . . . 53.439999999999998 111.24 175.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -77.59 -42.56 34.71 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 121.997 -0.439 . . . . 72.349999999999994 109.924 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.3 ptt180 -63.29 -46.07 88.46 Favored 'General case' 0 C--O 1.225 -0.186 0 N-CA-C 109.511 -0.551 . . . . 74.439999999999998 109.511 -174.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.59 -44.16 96.57 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 126.13 1.772 . . . . 54.229999999999997 110.212 -176.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 17.1 t80 -60.78 -55.5 32.34 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.281 0.632 . . . . 74.430000000000007 109.445 171.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.81 -5.52 2.08 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 125.416 1.486 . . . . 54.32 114.045 -176.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 45.5 mt -65.11 -34.38 78.27 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 120.708 -1.245 . . . . 71.239999999999995 110.369 169.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 13.8 t -133.98 73.45 1.5 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 122.51 1.147 . . . . 53.020000000000003 109.943 -165.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.6 m -136.03 12.98 0.97 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 126.023 1.729 . . . . 54.020000000000003 111.688 -178.143 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 16.0 t -82.78 90.23 2.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 O-C-N 120.626 -1.296 . . . . 44.219999999999999 109.99 -171.493 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 5.3 t -147.51 131.6 17.3 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 126.171 1.788 . . . . 74.319999999999993 106.554 176.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.6 p -143.4 95.95 2.83 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 124.113 0.965 . . . . 62.119999999999997 108.402 176.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.4 t0 -141.0 89.46 2.25 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 107.429 -1.323 . . . . 71.109999999999999 107.429 -175.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -160.38 176.02 12.14 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 126.247 1.819 . . . . 54.310000000000002 109.66 -175.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 39.0 t70 51.8 91.62 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.109 0 C-N-CA 126.982 2.113 . . . . 64.140000000000001 109.882 -160.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 52.5 72.54 1.15 Allowed Pre-proline 0 CA--C 1.546 0.792 0 C-N-CA 129.77 3.228 . . . . 74.519999999999996 113.708 -168.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -71.36 168.69 22.73 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 123.174 2.583 . . . . 61.549999999999997 111.012 173.148 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -107.88 -33.75 2.97 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 125.131 1.348 . . . . 73.140000000000001 112.904 178.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -133.48 -14.07 2.58 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 125.54 1.536 . . . . 73.420000000000002 111.337 -179.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 63.32 26.15 14.94 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.769 1.228 . . . . 75.519999999999996 111.071 163.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -76.46 25.44 0.13 Allowed 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 125.882 1.673 . . . . 75.530000000000001 113.602 -165.233 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 1.6 p -131.31 -57.67 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.576 0 C-N-CA 127.83 2.452 . . . . 62.450000000000003 107.655 179.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 46.9 t80 -55.78 -44.02 77.33 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 119.526 1.057 . . . . 62.549999999999997 109.56 172.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.3 ttt180 -62.1 -11.75 15.72 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 114.824 1.416 . . . . 62.539999999999999 114.824 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 55.8 mmtt -105.63 -48.79 3.57 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 120.04 1.291 . . . . 74.519999999999996 109.368 175.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 13.8 mt -70.72 -27.83 64.27 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 118.48 -0.771 . . . . 72.549999999999997 110.956 -172.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.05 -53.25 21.36 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-N 119.434 1.015 . . . . 53.109999999999999 108.529 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.92 -20.96 66.72 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 117.955 -1.021 . . . . 74.109999999999999 113.05 174.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -69.88 -56.78 6.15 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 103.741 -2.689 . . . . 63.539999999999999 103.741 170.187 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 97.2 mt -77.6 31.56 0.16 Allowed 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 127.135 2.174 . . . . 64.230000000000004 112.141 -174.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -57.06 105.15 0.2 Allowed 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 126.779 2.032 . . . . 64.349999999999994 109.306 174.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 101.84 -1.36 52.04 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 126.153 1.835 . . . . 65.230000000000004 114.788 -177.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 28.9 mtmm -133.24 10.96 4.17 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 126.027 1.731 . . . . 74.329999999999998 113.088 -177.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -151.33 176.04 11.64 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 121.842 0.83 . . . . 44.25 111.683 175.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.431 ' H ' ' HB ' ' A' ' 84' ' ' THR . 7.6 m-20 -140.65 163.68 32.22 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 127.582 2.353 . . . . 71.519999999999996 105.599 172.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -46.05 -61.78 1.61 Allowed 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 126.109 1.763 . . . . 62.310000000000002 110.358 169.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -67.57 -38.11 83.61 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.188 0.595 . . . . 51.409999999999997 111.821 -176.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.431 ' HB ' ' H ' ' A' ' 81' ' ' ASP . 28.5 m -55.57 -46.39 77.2 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.802 0.841 . . . . 64.409999999999997 110.895 174.508 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 7.5 mt -70.28 -56.84 9.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 120.181 1.355 . . . . 72.439999999999998 110.301 173.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.87 -17.65 61.82 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 119.676 1.126 . . . . 75.25 113.153 -170.272 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -88.99 -32.86 17.42 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 119.541 1.064 . . . . 72.519999999999996 112.823 171.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.5 ' HE2' ' CD1' ' A' ' 36' ' ' TRP . 57.7 tptt -63.64 -70.27 0.23 Allowed 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.718 1.207 . . . . 74.530000000000001 112.178 -169.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.43 ' HB2' HD11 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -61.02 -31.64 71.26 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 112.806 0.669 . . . . 75.129999999999995 112.806 -167.553 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 74.2 t -58.74 -38.76 73.95 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 C-N-CA 124.925 1.29 . . . . 71.540000000000006 109.428 176.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -73.4 -21.4 60.5 Favored 'General case' 0 C--O 1.232 0.181 0 O-C-N 121.67 -0.644 . . . . 72.439999999999998 111.336 -172.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 89.0 mt -72.25 8.17 1.44 Allowed 'General case' 0 C--O 1.227 -0.127 0 C-N-CA 123.785 0.834 . . . . 64.430000000000007 111.661 -170.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 38.1 ttp85 -57.88 -44.52 86.75 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 121.224 -0.923 . . . . 54.509999999999998 110.015 174.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.52 -50.24 74.68 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-N 118.466 0.576 . . . . 62.350000000000001 110.851 171.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -58.3 -36.91 74.04 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 121.609 -0.682 . . . . 61.450000000000003 110.713 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -71.23 -48.82 49.0 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.718 1.207 . . . . 33.119999999999997 111.754 -177.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -63.2 -30.22 71.41 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 117.723 0.238 . . . . 75.219999999999999 110.659 177.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -57.66 -53.56 56.75 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 125.565 1.546 . . . . 71.019999999999996 111.048 170.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -57.2 -16.76 8.87 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 114.037 1.125 . . . . 61.43 114.037 -174.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 50.0 mm -71.23 -61.86 1.52 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 118.927 0.785 . . . . 73.400000000000006 110.168 168.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 84.5 mt -67.71 -19.36 24.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 124.478 1.111 . . . . 72.239999999999995 110.48 -173.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -69.55 -16.38 63.41 Favored 'General case' 0 N--CA 1.429 -1.517 0 C-N-CA 124.247 1.019 . . . . 73.109999999999999 111.839 172.053 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -145.7 67.84 1.21 Allowed 'General case' 0 C--O 1.235 0.312 0 CA-C-N 119.899 1.227 . . . . 64.239999999999995 109.867 -173.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 15.2 mm . . . . . 0 C--O 1.252 1.185 0 C-N-CA 125.249 1.42 . . . . 74.230000000000004 108.74 173.876 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ptt? . . . . . 0 N--CA 1.478 0.933 0 CA-C-O 118.226 -0.892 . . . . 44.310000000000002 110.445 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 13.9 t -128.56 178.07 6.57 Favored 'General case' 0 C--O 1.239 0.547 0 N-CA-C 106.465 -1.68 . . . . 71.319999999999993 106.465 161.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.1 p -152.71 145.3 24.19 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 129.491 3.116 . . . . 63.420000000000002 105.631 -176.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -156.17 84.09 1.0 Allowed 'General case' 0 C--O 1.236 0.366 0 CA-C-N 119.857 1.208 . . . . 74.140000000000001 109.003 -174.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -79.2 93.97 5.32 Favored 'General case' 0 C--O 1.234 0.243 0 O-C-N 121.379 -0.826 . . . . 61.539999999999999 109.938 178.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 66.6 t0 -158.22 97.24 1.49 Allowed 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 103.481 -2.785 . . . . 64.420000000000002 103.481 165.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.5 ttp180 -130.46 120.22 23.85 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 106.993 -1.484 . . . . 73.549999999999997 106.993 -173.356 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.3 pm0 -68.78 163.87 23.12 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 122.117 0.96 . . . . 74.140000000000001 111.541 173.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.405 HH11 ' HG2' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -74.47 -52.35 12.22 Favored 'General case' 0 C--O 1.226 -0.142 0 CA-C-N 114.791 -1.095 . . . . 65.329999999999998 109.249 -179.59 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 46.12 68.62 0.57 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 126.992 2.117 . . . . 74.239999999999995 111.821 176.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -71.02 -4.85 27.12 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 115.249 1.574 . . . . 74.420000000000002 115.249 -169.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -62.34 129.58 41.36 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 108.823 -0.806 . . . . 73.150000000000006 108.823 -177.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 57.26 -8.63 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 127.889 2.476 . . . . 70.340000000000003 115.535 -169.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -77.33 -25.13 50.85 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 119.93 1.241 . . . . 72.150000000000006 112.066 174.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -62.39 -17.6 59.53 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 114.18 1.178 . . . . 74.329999999999998 114.18 -169.614 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -126.28 40.29 3.76 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 125.622 1.569 . . . . 73.340000000000003 108.847 173.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -149.37 -75.54 0.16 Allowed 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 107.79 -1.189 . . . . 72.349999999999994 107.79 179.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.57 117.77 9.23 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 124.804 1.241 . . . . 74.25 108.631 -178.178 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.74 -31.13 72.2 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 124.168 0.987 . . . . 62.520000000000003 111.669 -173.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -60.74 -62.55 1.77 Allowed 'General case' 0 C--O 1.231 0.095 0 C-N-CA 125.717 1.607 . . . . 71.129999999999995 112.163 -177.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 36.0 mt -72.03 -32.81 67.49 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 121.788 -0.57 . . . . 64.230000000000004 109.481 -169.218 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 58.0 t-20 -53.57 -59.93 3.96 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 126.36 1.864 . . . . 74.109999999999999 108.744 169.4 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -56.22 -45.6 79.86 Favored 'General case' 0 CA--C 1.517 -0.298 0 C-N-CA 123.665 0.786 . . . . 73.319999999999993 111.483 179.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.37 -31.4 33.61 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 119.234 0.924 . . . . 74.340000000000003 112.268 -177.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -91.58 -53.97 4.09 Favored 'General case' 0 N--CA 1.443 -0.823 0 C-N-CA 125.274 1.43 . . . . 72.239999999999995 111.868 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -58.29 -25.12 61.46 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.73 -0.606 . . . . 74.310000000000002 110.962 179.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -106.88 7.54 30.16 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 125.094 1.358 . . . . 52.020000000000003 112.401 -177.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.47 -14.98 3.46 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 120.744 -1.223 . . . . 74.099999999999994 113.124 174.597 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 49.5 mtm180 -62.42 16.56 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 131.344 3.858 . . . . 74.340000000000003 116.113 -166.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.592 HD21 ' N ' ' A' ' 58' ' ' SER . 1.0 OUTLIER -124.61 -70.05 0.77 Allowed 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 119.719 1.145 . . . . 70.409999999999997 108.819 165.336 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.451 ' HD2' ' H ' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -60.34 -19.83 56.98 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.467 1.284 . . . . 73.319999999999993 114.467 -165.828 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.18 -19.93 66.21 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 113.039 0.755 . . . . 74.120000000000005 113.039 174.291 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 20.9 tp -72.49 -27.53 62.33 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 126.436 1.894 . . . . 73.400000000000006 110.905 171.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -63.25 -53.66 38.12 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 108.469 -1.852 . . . . 42.219999999999999 108.469 164.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -63.59 -7.13 6.39 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.231 1.412 . . . . 71.239999999999995 113.791 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 22.6 t90 -86.02 -79.4 0.25 Allowed 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 107.37 -1.344 . . . . 72.329999999999998 107.37 165.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -60.37 -21.86 62.62 Favored 'General case' 0 C--O 1.225 -0.193 0 C-N-CA 124.804 1.242 . . . . 74.420000000000002 114.099 -167.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -54.09 -53.49 52.51 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.861 1.209 . . . . 74.5 109.866 176.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -54.74 -48.78 64.44 Favored Glycine 0 CA--C 1.524 0.644 0 C-N-CA 124.254 0.931 . . . . 63.340000000000003 111.771 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.0 mp -52.9 -39.56 62.85 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.523 1.529 . . . . 71.209999999999994 111.78 175.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 67.8 mt -86.8 1.44 52.3 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.704 1.602 . . . . 75.129999999999995 112.881 -177.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.79 29.64 25.81 Favored Glycine 0 CA--C 1.526 0.771 0 C-N-CA 124.391 0.996 . . . . 53.130000000000003 112.864 177.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.9 mttt -128.76 122.0 29.62 Favored 'General case' 0 CA--C 1.523 -0.092 0 C-N-CA 125.642 1.577 . . . . 64.340000000000003 108.566 -168.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 82.4 p -138.26 179.59 6.36 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 124.077 0.951 . . . . 64.540000000000006 109.387 175.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 52.46 -131.0 38.77 Favored Glycine 0 CA--C 1.523 0.579 0 C-N-CA 124.613 1.102 . . . . 42.009999999999998 111.414 178.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -61.8 -28.77 69.69 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 113.258 0.836 . . . . 61.530000000000001 113.258 -176.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -68.63 -47.56 66.31 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 122.61 1.195 . . . . 60.539999999999999 110.424 179.254 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.72 -36.54 81.25 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 114.721 -1.127 . . . . 61.140000000000001 111.079 172.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.5 ttm-85 -53.34 -52.28 59.72 Favored 'General case' 0 N--CA 1.444 -0.755 0 C-N-CA 123.712 0.805 . . . . 73.140000000000001 111.43 175.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.74 -45.04 94.55 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 118.413 0.551 . . . . 50.210000000000001 111.042 -177.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -54.23 -45.89 72.4 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.054 0.941 . . . . 74.310000000000002 110.051 175.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.97 -13.09 30.6 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 114.106 1.15 . . . . 52.200000000000003 114.106 179.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 18.3 mt -94.14 -14.58 25.52 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 120.905 -1.122 . . . . 73.5 110.773 179.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 12.5 t -110.24 29.06 8.02 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.067 1.747 . . . . 73.510000000000005 109.721 172.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 58.5 t -134.07 75.76 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 N-CA-C 107.337 -1.357 . . . . 44.030000000000001 107.337 170.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.481 HG12 ' H ' ' A' ' 57' ' ' THR . 1.6 t -137.36 168.19 21.63 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 C-N-CA 125.047 1.339 . . . . 73.400000000000006 107.744 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.481 ' H ' HG12 ' A' ' 56' ' ' VAL . 1.0 OUTLIER 67.2 -36.13 0.27 Allowed 'General case' 0 CA--C 1.553 1.078 1 C-N-CA 135.327 5.451 . . . . 61.530000000000001 116.186 -175.767 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.592 ' N ' HD21 ' A' ' 30' ' ' ASN . 95.0 p 65.96 146.43 0.04 OUTLIER 'General case' 0 C--N 1.345 0.383 0 C-N-CA 129.038 2.935 . . . . 73.129999999999995 111.985 -168.053 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -158.79 93.97 1.21 Allowed 'General case' 0 C--O 1.234 0.28 0 N-CA-C 108.934 -0.765 . . . . 51.299999999999997 108.934 -167.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.468 ' CE2' ' HB3' ' A' ' 86' ' ' ARG . 0.2 OUTLIER -164.68 51.84 0.12 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.445 1.098 . . . . 71.319999999999993 110.868 -173.614 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.55 ' H ' ' HB2' ' A' ' 65' ' ' ASP . 0.4 OUTLIER -147.99 122.51 9.77 Favored 'General case' 0 N--CA 1.477 0.925 0 O-C-N 120.576 -1.328 . . . . 72.409999999999997 113.203 -168.531 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 57.26 165.36 0.07 OUTLIER Pre-proline 0 N--CA 1.48 1.044 0 C-N-CA 127.623 2.369 . . . . 73.510000000000005 113.254 -160.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -74.62 70.67 4.93 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 123.595 2.863 . . . . 65.510000000000005 110.455 177.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -164.22 -42.77 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 125.216 1.389 . . . . 64.409999999999997 110.993 175.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.55 ' HB2' ' H ' ' A' ' 61' ' ' ASP . 5.1 m-20 -85.78 86.03 7.37 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 105.851 -1.907 . . . . 74.239999999999995 105.851 -175.143 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -139.42 72.15 1.4 Allowed 'General case' 0 N--CA 1.445 -0.716 0 N-CA-C 105.345 -2.095 . . . . 51.130000000000003 105.345 170.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.84 -65.05 1.04 Allowed 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 109.904 -0.406 . . . . 72.530000000000001 109.904 173.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.3 p -67.0 -44.1 88.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 118.393 0.542 . . . . 70.5 110.648 -177.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -61.72 -33.34 73.87 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 121.493 -0.754 . . . . 74.329999999999998 111.231 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 17.5 tpp180 -51.82 -50.76 60.2 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 124.804 1.242 . . . . 72.400000000000006 111.341 -171.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.91 -26.8 22.53 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 119.455 -0.307 . . . . 70.340000000000003 111.073 -177.751 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -52.44 -61.41 2.29 Favored 'General case' 0 CA--C 1.52 -0.197 0 C-N-CA 123.974 0.91 . . . . 70.310000000000002 108.839 177.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.72 -36.45 80.97 Favored 'General case' 0 N--CA 1.456 -0.165 0 O-C-N 123.889 0.743 . . . . 54.340000000000003 111.931 -171.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.39 -45.13 85.24 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.03 0.443 . . . . 71.400000000000006 110.534 178.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -65.81 -48.13 72.73 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 122.131 0.967 . . . . 71.219999999999999 109.65 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 11.8 tp -87.2 10.34 17.24 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 127.35 2.26 . . . . 72.230000000000004 113.26 -169.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -47.54 111.13 0.38 Allowed 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 127.313 2.245 . . . . 60.009999999999998 110.446 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 106.1 -2.26 38.0 Favored Glycine 0 CA--C 1.524 0.629 0 C-N-CA 125.768 1.652 . . . . 74.400000000000006 113.599 177.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.35 -0.13 5.68 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 119.722 1.761 . . . . 61.439999999999998 112.475 -179.329 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -147.89 176.35 10.22 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 125.065 1.346 . . . . 54.399999999999999 108.88 176.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -141.57 170.8 15.05 Favored 'General case' 0 CA--C 1.511 -0.521 0 C-N-CA 125.464 1.506 . . . . 65.299999999999997 107.88 174.584 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -65.47 -52.76 50.71 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 125.59 1.556 . . . . 70.030000000000001 108.63 -177.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -67.38 -29.95 69.61 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.463 0.705 . . . . 74.540000000000006 110.34 178.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 5.0 m -65.46 -57.8 7.39 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.419 0.688 . . . . 73.209999999999994 110.271 173.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 21.1 mt -60.29 -53.05 54.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 CA-C-N 120.511 1.505 . . . . 72.519999999999996 109.269 -171.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.468 ' HB3' ' CE2' ' A' ' 60' ' ' PHE . 0.9 OUTLIER -55.1 -37.58 67.02 Favored 'General case' 0 C--N 1.342 0.265 0 O-C-N 123.999 0.812 . . . . 71.219999999999999 110.858 -178.626 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -71.19 -47.91 54.75 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-O 118.375 -0.821 . . . . 61.299999999999997 109.285 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -50.51 -60.97 2.48 Favored 'General case' 0 CA--C 1.516 -0.345 0 C-N-CA 125.051 1.34 . . . . 73.219999999999999 109.295 -177.517 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . 0.282 0.0 OUTLIER -59.16 -38.35 79.53 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 120.271 -0.572 . . . . 61.329999999999998 111.928 -165.747 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 32.0 t -70.29 -53.16 24.32 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 125.249 1.42 . . . . 64.140000000000001 110.558 174.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -63.69 -26.15 68.53 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 120.178 -1.576 . . . . 65.239999999999995 111.769 -168.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 44.9 mt -64.6 8.95 0.09 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.856 1.662 . . . . 71.5 113.753 177.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -45.0 -64.11 0.78 Allowed 'General case' 0 C--N 1.34 0.195 0 C-N-CA 127.588 2.355 . . . . 73.209999999999994 113.13 -177.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.25 -20.2 28.81 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 118.966 0.803 . . . . 62.439999999999998 111.41 178.245 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.2 m -57.56 -30.04 64.91 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 120.858 -1.151 . . . . 74.519999999999996 110.242 174.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -54.18 -36.39 63.35 Favored 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 124.929 1.292 . . . . 52.240000000000002 114.253 170.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 18.5 ptt180 -90.78 -24.41 20.34 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 117.606 -1.188 . . . . 70.400000000000006 111.671 179.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -56.4 -59.28 5.2 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 119.044 0.838 . . . . 65.420000000000002 109.108 169.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -58.07 -20.63 40.94 Favored 'General case' 0 C--O 1.223 -0.315 0 N-CA-C 114.636 1.347 . . . . 74.5 114.636 -168.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 8.4 mm -89.19 -35.36 7.58 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 O-C-N 120.696 -1.253 . . . . 64.530000000000001 110.016 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 97.0 mt -66.96 -30.32 49.22 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 N-CA-C 108.579 -0.897 . . . . 73.109999999999999 108.579 168.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 2.2 t -71.69 -43.0 66.75 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.067 1.347 . . . . 74.319999999999993 109.413 178.175 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -129.49 70.2 1.42 Allowed 'General case' 0 C--O 1.234 0.288 0 C-N-CA 125.778 1.631 . . . . 73.340000000000003 107.508 -169.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 76.7 mt . . . . . 0 C--O 1.248 0.975 0 C-N-CA 126.533 1.933 . . . . 54.43 110.76 -176.007 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.459 ' HG2' ' H ' ' A' ' 2' ' ' THR . 3.2 ttt . . . . . 0 N--CA 1.475 0.801 0 N-CA-C 108.484 -0.932 . . . . 74.409999999999997 108.484 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.541 HG22 ' H ' ' A' ' 3' ' ' THR . 17.4 m 66.18 -164.18 0.23 Allowed 'General case' 0 C--O 1.243 0.715 0 CA-C-N 118.796 0.725 . . . . 72.129999999999995 109.182 167.14 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.541 ' H ' HG22 ' A' ' 2' ' ' THR . 0.7 OUTLIER -119.69 178.08 4.71 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.932 2.093 . . . . 74.340000000000003 107.235 166.841 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -151.35 174.46 13.3 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 124.635 1.174 . . . . 74.239999999999995 108.393 167.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -115.08 -177.41 3.12 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.145 1.378 . . . . 73.450000000000003 107.866 -176.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -144.57 83.41 1.71 Allowed 'General case' 0 CA--C 1.52 -0.179 0 O-C-N 120.746 -1.221 . . . . 64.120000000000005 108.606 158.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -91.74 154.32 19.04 Favored 'General case' 0 C--O 1.236 0.381 0 O-C-N 121.78 -0.575 . . . . 73.310000000000002 110.284 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -69.89 157.0 38.24 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.456 -0.942 . . . . 75.540000000000006 108.456 167.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -61.5 144.86 53.54 Favored 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 126.916 2.086 . . . . 72.25 109.913 175.523 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -172.45 95.83 0.14 Allowed 'General case' 0 C--O 1.234 0.285 0 C-N-CA 126.904 2.082 . . . . 75.510000000000005 106.632 169.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -131.86 9.94 4.61 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 115.432 1.641 . . . . 64.409999999999997 115.432 177.318 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -53.78 121.37 7.75 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.647 1.112 . . . . 75.319999999999993 109.12 174.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 48.51 -0.23 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 129.577 3.151 . . . . 63.399999999999999 117.248 -176.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.3 mmtt -76.59 -6.77 53.36 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 125.58 1.552 . . . . 73.409999999999997 112.808 -173.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -58.85 -36.0 73.87 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 119.449 1.022 . . . . 72.319999999999993 111.809 177.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.79 16.75 0.08 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.59 1.956 . . . . 64.430000000000007 113.399 178.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 44.8 t-80 -152.15 -73.49 0.14 Allowed 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 123.508 0.723 . . . . 75.510000000000005 109.94 -163.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -83.73 145.39 28.76 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 123.811 0.844 . . . . 72.530000000000001 108.841 -170.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -81.41 -50.57 9.29 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-O 117.945 -1.026 . . . . 75.329999999999998 109.771 175.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -44.94 -42.85 8.51 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 126.489 1.915 . . . . 75.329999999999998 113.392 -178.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 82.8 mt -76.38 -28.9 56.93 Favored 'General case' 0 C--N 1.33 -0.274 0 O-C-N 120.908 -1.12 . . . . 64.420000000000002 111.004 -174.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -80.03 -28.81 39.28 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.716 2.006 . . . . 73.439999999999998 111.212 171.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -56.63 -48.67 77.01 Favored 'General case' 0 C--O 1.226 -0.142 0 C-N-CA 126.929 2.092 . . . . 74.439999999999998 109.696 -171.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.45 -41.71 63.53 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 118.526 -0.75 . . . . 60.509999999999998 112.537 175.481 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.15 -54.27 43.56 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 124.515 1.126 . . . . 44.439999999999998 111.153 178.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -66.19 -11.26 48.51 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 112.647 0.61 . . . . 72.340000000000003 112.647 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -121.3 32.59 5.86 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.42 1.488 . . . . 60.329999999999998 111.335 -177.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -120.01 17.5 12.5 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.057 1.343 . . . . 72.140000000000001 112.86 178.304 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 71.7 mtm-85 -71.23 -48.82 48.94 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 120.296 -1.503 . . . . 74.109999999999999 111.825 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 30.3 m120 -62.19 -27.63 69.11 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 114.642 1.349 . . . . 74.120000000000005 114.642 -163.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.485 ' HD3' HD13 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -56.11 -34.61 66.2 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 119.322 0.964 . . . . 71.420000000000002 113.29 172.672 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.485 HD13 ' HD3' ' A' ' 31' ' ' ARG . 1.1 mm? -75.14 -33.23 61.51 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 123.613 0.765 . . . . 55.020000000000003 108.995 -177.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.426 HD21 ' HA ' ' A' ' 89' ' ' MET . 3.9 mm? -62.64 -33.44 75.02 Favored 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 108.625 -0.879 . . . . 54.409999999999997 108.625 169.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -67.81 -14.36 65.23 Favored Glycine 0 CA--C 1.538 1.524 0 CA-C-O 117.709 -1.606 . . . . 63.119999999999997 113.685 170.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -91.52 -18.69 23.73 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 121.291 2.545 . . . . 74.450000000000003 111.255 169.026 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 10.6 t90 -76.62 -79.23 0.11 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.148 1.379 . . . . 64.349999999999994 110.518 -176.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -50.69 -29.84 12.24 Favored 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 127.472 2.309 . . . . 73.209999999999994 112.722 -171.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -44.57 -52.87 7.65 Favored 'General case' 0 N--CA 1.445 -0.684 0 C-N-CA 126.64 1.976 . . . . 74.150000000000006 110.616 173.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -53.45 -48.73 59.47 Favored Glycine 0 C--N 1.337 0.625 0 N-CA-C 110.479 -1.048 . . . . 71.230000000000004 110.479 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.41 ' H ' ' CD1' ' A' ' 40' ' ' LEU . 2.2 mp -61.79 -46.48 89.36 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 126.728 2.011 . . . . 73.129999999999995 108.621 -177.37 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.0 mp -62.97 -18.28 63.04 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.083 1.353 . . . . 63.32 112.899 175.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 106.08 -1.91 38.07 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 127.065 2.269 . . . . 52.109999999999999 112.8 177.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 44.4 mttm -75.1 143.53 43.32 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 118.466 1.133 . . . . 71.319999999999993 108.65 178.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.1 p -142.16 178.53 7.48 Favored 'General case' 0 C--N 1.316 -0.863 0 C-N-CA 124.043 0.937 . . . . 73.319999999999993 109.326 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 55.08 -119.89 15.23 Favored Glycine 0 N--CA 1.442 -0.922 0 C-N-CA 124.63 1.109 . . . . 64.319999999999993 110.544 168.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -82.86 -22.52 34.03 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 123.568 0.747 . . . . 64.340000000000003 112.768 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -72.43 -41.51 66.11 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.003 -1.06 . . . . 60.210000000000001 110.372 -176.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.8 -46.71 88.36 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.647 -0.872 . . . . 73.329999999999998 108.647 168.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -59.17 -33.63 71.15 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 118.419 -0.801 . . . . 74.25 112.895 179.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.56 -51.23 29.9 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 124.704 1.202 . . . . 72.150000000000006 109.849 175.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -56.77 -30.28 63.47 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.5 1.12 . . . . 75.239999999999995 111.857 176.432 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.45 1.09 2.48 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 120.468 -1.395 . . . . 75.239999999999995 114.32 175.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.0 mt -108.81 1.49 20.99 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 125.263 1.425 . . . . 64.109999999999999 110.147 179.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 77.4 p -129.9 18.79 5.58 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.165 0.893 . . . . 72.530000000000001 112.163 -168.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 5.4 t -132.97 102.68 5.23 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 C-N-CA 125.06 1.344 . . . . 63.240000000000002 109.08 177.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 4.2 p -146.78 128.15 6.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 O-C-N 120.884 -1.135 . . . . 71.319999999999993 110.058 175.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 5.5 t -170.55 87.13 0.12 Allowed 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 106.663 -1.606 . . . . 62.32 106.663 178.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.1 t -83.08 59.38 4.91 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.76 2.024 . . . . 72.299999999999997 108.173 -172.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 38.2 m-20 -139.17 39.7 2.11 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.397 1.879 . . . . 74.120000000000005 109.537 -159.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -138.28 61.39 1.59 Allowed 'General case' 0 C--O 1.235 0.328 0 O-C-N 120.124 -1.61 . . . . 73.329999999999998 110.015 -166.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -150.84 4.92 0.49 Allowed 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 115.432 1.641 . . . . 75.239999999999995 115.432 167.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -67.73 159.49 78.5 Favored Pre-proline 0 CA--C 1.542 0.673 0 CA-C-N 119.509 1.05 . . . . 62.420000000000002 108.911 160.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -79.45 65.18 8.9 Favored 'Trans proline' 0 CA--C 1.544 0.989 0 C-N-CA 122.586 2.191 . . . . 55.119999999999997 113.35 -165.636 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 135.75 -62.35 0.61 Allowed Glycine 0 CA--C 1.523 0.582 0 C-N-CA 126.023 1.773 . . . . 63.229999999999997 109.692 176.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . 0.265 14.2 t70 44.83 -45.42 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.494 1 C-N-CA 134.094 4.958 . . . . 63.100000000000001 118.522 -178.233 . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 66.93 -3.25 0.97 Allowed 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 126.31 1.844 . . . . 74.120000000000005 115.865 153.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -97.46 -21.17 17.29 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 119.883 -1.761 . . . . 74.310000000000002 111.459 174.13 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 48.2 t -84.38 -48.88 16.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 C-N-CA 124.17 0.988 . . . . 62.229999999999997 109.939 -177.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.43 -22.11 60.98 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 118.868 0.758 . . . . 74.099999999999994 112.889 -179.001 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.0 ttt180 -44.6 -43.14 7.94 Favored 'General case' 0 CA--C 1.516 -0.352 0 C-N-CA 128.429 2.692 . . . . 73.420000000000002 112.021 172.114 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -74.0 -15.79 61.09 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 118.403 -0.808 . . . . 74.219999999999999 111.98 -171.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 70.0 mt -96.32 -53.93 3.45 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.55 -0.907 . . . . 64.439999999999998 108.55 167.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -52.62 -40.47 62.78 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.753 1.621 . . . . 53.049999999999997 113.109 -169.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.35 -48.18 62.11 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.847 0.459 . . . . 74.140000000000001 111.159 177.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -67.24 -28.77 68.33 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 120.852 -1.155 . . . . 55.420000000000002 111.262 -176.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 14.2 tp -103.78 13.43 33.02 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 128.063 2.545 . . . . 54.420000000000002 111.824 -172.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -59.34 111.84 1.52 Allowed 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 126.268 1.827 . . . . 64.549999999999997 109.462 -177.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 105.49 -3.61 39.9 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 126.084 1.802 . . . . 71.239999999999995 113.077 -174.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 14.3 mtmm -134.16 -0.4 3.03 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 118.959 1.38 . . . . 72.030000000000001 112.474 -177.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -144.93 172.15 13.44 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 119.028 0.831 . . . . 75.239999999999995 110.506 168.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -132.83 161.45 34.12 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 125.845 1.658 . . . . 63.219999999999999 107.478 -178.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -64.73 -49.74 69.67 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.117 -0.947 . . . . 75.239999999999995 110.066 -164.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -71.64 -34.94 70.21 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 122.695 0.398 . . . . 75.519999999999996 110.042 177.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 52.3 m -57.24 -45.71 83.69 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.004 0.922 . . . . 61.140000000000001 111.062 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 79.8 mt -58.5 -48.58 85.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 CA-C-N 119.589 1.086 . . . . 60.340000000000003 110.404 179.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.64 -44.75 93.39 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 118.943 0.792 . . . . 71.129999999999995 110.667 -175.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.7 -38.08 89.76 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.198 0.599 . . . . 75.239999999999995 111.567 179.046 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.36 -47.04 76.36 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.319 0.648 . . . . 75.019999999999996 110.744 -177.078 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . 0.426 ' HA ' HD21 ' A' ' 33' ' ' LEU . 10.5 mtt -61.84 -30.59 70.94 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 120.992 0.425 . . . . 62.119999999999997 111.853 -178.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 92.1 t -86.6 -25.44 6.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 124.915 1.286 . . . . 52.210000000000001 110.207 -171.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 90.2 mt-10 -56.99 -45.02 83.26 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.459 1.104 . . . . 55.509999999999998 110.459 175.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 4.2 pp -101.28 18.69 19.32 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 127.592 2.357 . . . . 74.040000000000006 112.688 -174.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.71 -31.08 72.14 Favored 'General case' 0 N--CA 1.469 0.493 0 O-C-N 119.92 -1.738 . . . . 75.400000000000006 113.945 -173.757 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -78.09 -37.2 46.99 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 119.665 1.12 . . . . 53.530000000000001 111.313 173.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 6.1 m -45.38 -47.56 13.51 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.435 1.894 . . . . 74.439999999999998 110.902 -172.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -64.75 -40.47 95.36 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 113.945 1.091 . . . . 63.530000000000001 113.945 -177.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 11.6 ptt180 -73.87 -33.13 63.93 Favored 'General case' 0 C--N 1.342 0.247 0 CA-C-O 117.436 -1.268 . . . . 62.520000000000003 110.59 -175.489 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -49.47 -55.69 12.36 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 118.314 -0.85 . . . . 55.399999999999999 109.034 171.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -53.12 -39.84 63.74 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-O 118.475 -0.774 . . . . 63.299999999999997 112.987 -173.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 8.5 mm -63.23 -46.41 95.85 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 120.04 1.291 . . . . 75.120000000000005 109.961 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 56.0 mt -67.03 -24.52 32.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 124.821 1.248 . . . . 73.109999999999999 109.095 179.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.13 -12.57 59.65 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.527 1.931 . . . . 74.329999999999998 111.53 176.23 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -121.36 24.07 10.12 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 125.587 1.555 . . . . 73.25 109.873 -163.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 33.0 mm . . . . . 0 C--O 1.255 1.346 0 N-CA-C 107.371 -1.344 . . . . 41.240000000000002 107.371 176.443 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.7 mtt . . . . . 0 N--CA 1.471 0.592 0 N-CA-C 106.952 -1.499 . . . . 55.420000000000002 106.952 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 42.1 p -136.43 -39.93 0.65 Allowed 'General case' 0 C--O 1.235 0.319 0 C-N-CA 123.008 0.523 . . . . 71.299999999999997 110.568 -168.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 6.8 m 68.46 -62.44 0.37 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 127.516 2.326 . . . . 64.439999999999998 112.062 172.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 47.1 p90 -137.67 -37.21 0.61 Allowed 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 126.817 2.047 . . . . 74.140000000000001 109.503 175.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 44.84 90.44 0.01 OUTLIER 'General case' 0 C--N 1.342 0.242 0 C-N-CA 129.111 2.964 . . . . 53.539999999999999 112.323 -176.623 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -56.46 -66.78 0.38 Allowed 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.1 0.96 . . . . 64.239999999999995 110.713 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -88.7 157.86 18.39 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 122.341 0.256 . . . . 75.239999999999995 110.334 -171.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -96.43 -85.82 0.33 Allowed 'General case' 0 CA--C 1.54 0.561 0 O-C-N 123.462 0.476 . . . . 63.240000000000002 111.006 -176.09 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 81.0 mtm-85 -128.29 -63.8 0.98 Allowed 'General case' 0 N--CA 1.475 0.781 0 O-C-N 120.796 -1.19 . . . . 75.219999999999999 112.705 -168.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 45.23 77.36 0.08 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 127.745 2.418 . . . . 53.399999999999999 114.359 179.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -60.59 16.19 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 127.36 2.264 . . . . 71.439999999999998 116.607 170.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -77.37 117.53 18.95 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 119.481 -2.012 . . . . 72.140000000000001 109.369 -171.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.29 -15.94 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 128.335 2.654 . . . . 71.310000000000002 116.069 -164.123 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 30.4 mttm -74.27 2.91 8.12 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.873 2.069 . . . . 74.120000000000005 115.802 -173.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.601 ' CZ ' ' HB2' ' A' ' 25' ' ' ALA . 0.1 OUTLIER -80.71 1.56 29.68 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 119.513 -1.992 . . . . 71.010000000000005 112.307 175.388 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -120.86 -154.75 0.6 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.922 2.089 . . . . 64.230000000000004 105.568 159.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 65.92 -54.61 0.37 Allowed 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 129.167 2.987 . . . . 73.099999999999994 115.711 168.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -96.0 -175.44 3.4 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 127.747 2.419 . . . . 75.200000000000003 107.604 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -113.72 -39.98 3.9 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 117.747 -1.12 . . . . 73.420000000000002 110.515 166.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 77.8 mt-10 -45.55 -54.02 8.17 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.066 1.346 . . . . 61.210000000000001 112.521 -175.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -72.34 -33.93 67.67 Favored 'General case' 0 N--CA 1.436 -1.137 0 O-C-N 121.01 -1.056 . . . . 63.229999999999997 111.931 -177.262 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -72.34 -30.01 64.35 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 123.37 0.668 . . . . 63.399999999999999 110.697 177.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.22 -45.84 90.04 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.674 1.189 . . . . 75.140000000000001 109.644 177.38 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 13.3 mttp -53.06 -39.63 63.4 Favored 'General case' 0 N--CA 1.463 0.182 0 O-C-N 121.599 -0.688 . . . . 72.439999999999998 110.927 172.231 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.601 ' HB2' ' CZ ' ' A' ' 15' ' ' PHE . . . -78.98 -28.64 43.53 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 114.098 1.147 . . . . 60.130000000000003 114.098 179.322 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -67.6 -40.61 84.75 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 108.436 -0.95 . . . . 74.0 108.436 178.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -109.06 54.99 0.64 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 122.004 0.907 . . . . 64.439999999999998 110.221 -156.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.5 ppt_? -151.71 -15.45 0.19 Allowed 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 114.215 1.191 . . . . 62.219999999999999 114.215 -177.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.13 -22.25 16.07 Favored 'General case' 0 C--O 1.231 0.088 0 O-C-N 120.69 -1.256 . . . . 73.200000000000003 114.031 -178.169 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -105.12 -25.32 12.55 Favored 'General case' 0 CA--C 1.518 -0.25 0 N-CA-C 113.99 1.107 . . . . 73.319999999999993 113.99 176.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.92 -22.4 64.33 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 118.919 0.782 . . . . 75.140000000000001 112.317 -169.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.4 -11.87 47.93 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 124.589 1.155 . . . . 64.109999999999999 113.678 -178.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 16.9 tp -72.88 -21.75 60.88 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.814 1.246 . . . . 75.0 112.243 -175.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -66.19 -37.59 93.1 Favored Glycine 0 CA--C 1.521 0.434 0 N-CA-C 110.898 -0.881 . . . . 75.129999999999995 110.898 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -54.73 -34.97 63.19 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 126.377 1.871 . . . . 73.340000000000003 111.568 178.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 28.3 t90 -70.26 -81.53 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.673 -0.862 . . . . 73.239999999999995 108.673 174.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -57.92 -24.7 58.99 Favored 'General case' 0 C--N 1.34 0.178 0 N-CA-C 114.311 1.226 . . . . 75.209999999999994 114.311 -167.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.01 -56.41 14.46 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 119.725 1.148 . . . . 73.299999999999997 109.954 176.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -53.45 -49.05 58.59 Favored Glycine 0 CA--C 1.527 0.79 0 CA-C-O 119.282 -0.732 . . . . 71.329999999999998 111.889 177.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 8.4 mp -52.41 -45.88 66.09 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.609 1.163 . . . . 74.329999999999998 110.892 179.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 84.8 mt -79.02 0.28 28.35 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 127.0 2.12 . . . . 74.310000000000002 112.862 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 71.41 3.07 52.33 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 124.691 1.138 . . . . 62.229999999999997 113.113 -175.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -63.48 127.72 32.6 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 106.178 -1.786 . . . . 74.140000000000001 106.178 175.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 37.7 p -136.37 171.79 13.97 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 107.98 -1.119 . . . . 52.229999999999997 107.98 175.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 51.14 -125.69 25.2 Favored Glycine 0 CA--C 1.524 0.634 0 C-N-CA 124.024 0.821 . . . . 31.350000000000001 112.632 172.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -61.89 -37.27 83.94 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.804 1.242 . . . . 73.219999999999999 111.704 -176.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.49 -43.03 73.97 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.686 0.795 . . . . 72.019999999999996 110.944 -177.399 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.77 -41.84 87.07 Favored 'General case' 0 C--O 1.227 -0.102 0 C-N-CA 123.577 0.751 . . . . 73.129999999999995 109.799 173.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 23.0 mtm180 -54.45 -57.3 11.84 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 118.87 -0.586 . . . . 75.319999999999993 109.531 176.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.58 -33.47 75.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 119.081 0.855 . . . . 74.310000000000002 111.49 -170.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 61.4 t80 -60.29 -55.24 36.11 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.284 1.034 . . . . 64.329999999999998 109.269 169.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.75 -36.7 81.77 Favored 'General case' 0 N--CA 1.462 0.128 0 C-N-CA 125.597 1.559 . . . . 42.530000000000001 113.604 -175.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.2 mt -59.69 -23.28 62.99 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 124.981 1.312 . . . . 73.040000000000006 111.149 -174.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.45 -82.22 0.62 Allowed 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 126.083 1.753 . . . . 74.340000000000003 107.585 178.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . 0.353 8.9 p 44.38 25.77 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 C-N-CA 128.315 2.646 . . . . 63.020000000000003 114.023 -171.308 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 3.6 m -100.79 125.68 54.62 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.855 0 O-C-N 119.042 -2.286 . . . . 64.239999999999995 110.688 178.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.8 t -153.57 -171.68 3.98 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 128.289 2.636 . . . . 55.240000000000002 105.379 170.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.8 m -104.35 74.46 1.18 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.686 1.194 . . . . 73.140000000000001 108.724 -165.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -66.41 102.79 0.92 Allowed 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 121.614 0.721 . . . . 72.409999999999997 112.026 -169.232 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 51.74 58.46 5.45 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.08 1.752 . . . . 62.109999999999999 109.39 -175.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.81 86.7 7.2 Favored 'General case' 0 N--CA 1.462 0.126 0 C-N-CA 125.062 1.345 . . . . 73.219999999999999 110.485 -175.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 63.79 163.93 0.12 Allowed Pre-proline 0 CA--C 1.546 0.801 0 C-N-CA 126.662 1.985 . . . . 75.430000000000007 112.946 -172.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -82.59 64.85 8.19 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 122.5 2.134 . . . . 61.420000000000002 112.323 -164.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -171.63 5.87 0.04 OUTLIER Glycine 0 CA--C 1.526 0.763 0 CA-C-O 118.22 -1.322 . . . . 71.329999999999998 114.393 176.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -131.89 23.52 4.6 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 118.79 1.295 . . . . 72.420000000000002 111.645 -167.268 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -60.39 1.22 0.13 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 127.022 2.129 . . . . 75.0 114.36 -174.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -58.91 -23.57 61.38 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.783 1.633 . . . . 73.319999999999993 111.633 -176.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 87.2 t -56.9 -49.02 80.41 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 O-C-N 119.901 -1.75 . . . . 60.229999999999997 110.579 169.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -65.88 -38.73 89.55 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 118.701 -0.666 . . . . 64.099999999999994 110.285 176.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.5 tpt180 -52.41 -56.51 14.55 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 118.349 0.522 . . . . 61.340000000000003 110.026 177.248 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? -63.28 -50.58 69.57 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 124.101 0.96 . . . . 64.209999999999994 109.459 -178.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 9.1 mt -56.15 -50.59 70.71 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-O 118.342 -0.837 . . . . 72.299999999999997 110.329 -176.303 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.07 -39.12 92.77 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 119.623 1.101 . . . . 75.040000000000006 112.419 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.36 -25.6 66.06 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 118.756 0.707 . . . . 71.010000000000005 111.498 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.05 -38.03 16.91 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 124.004 0.921 . . . . 71.230000000000004 111.035 174.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 94.3 mt -86.03 37.93 0.74 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.158 1.783 . . . . 71.420000000000002 109.84 175.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -61.65 102.33 0.25 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.472 1.909 . . . . 71.140000000000001 108.386 176.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 89.97 9.85 65.34 Favored Glycine 0 CA--C 1.523 0.569 0 C-N-CA 124.665 1.126 . . . . 72.230000000000004 112.876 -177.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -129.11 -10.95 4.74 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 119.475 1.637 . . . . 73.0 113.019 -173.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -149.27 171.37 16.61 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 119.207 0.912 . . . . 63.310000000000002 111.286 172.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -120.87 165.34 15.33 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 125.01 1.324 . . . . 62.210000000000001 109.973 -171.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -57.03 -26.69 60.73 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 126.842 2.057 . . . . 55.299999999999997 113.576 179.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -109.46 -22.47 12.0 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.885 0.874 . . . . 72.230000000000004 113.056 174.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.8 m -65.6 -37.88 87.87 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 120.562 -1.337 . . . . 43.240000000000002 113.132 -175.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 10.4 mt -69.69 -56.45 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 N-CA-C 107.627 -1.249 . . . . 64.430000000000007 107.627 179.326 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.51 -36.43 66.68 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 123.172 0.589 . . . . 73.319999999999993 110.979 -174.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -69.24 -38.89 78.7 Favored 'General case' 0 N--CA 1.443 -0.807 0 O-C-N 123.658 0.599 . . . . 73.310000000000002 110.858 179.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 6.3 tppt? -64.0 -49.66 71.56 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 119.448 1.022 . . . . 62.409999999999997 109.08 -161.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -43.88 97.16 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 113.119 0.785 . . . . 73.030000000000001 113.119 -177.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 58.6 t -65.04 -37.02 79.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 C-N-CA 123.985 0.914 . . . . 72.430000000000007 110.772 177.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -66.37 -26.49 67.29 Favored 'General case' 0 C--O 1.237 0.436 0 O-C-N 120.584 -1.322 . . . . 75.230000000000004 112.053 -175.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 45.3 mt -87.48 9.65 20.2 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.081 0.952 . . . . 75.209999999999994 112.322 -167.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 76.2 mtt85 -52.81 -46.62 67.78 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 120.88 1.673 . . . . 73.230000000000004 111.155 175.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -54.56 -66.23 0.44 Allowed 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 125.728 1.611 . . . . 73.010000000000005 109.12 177.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.6 m -48.01 -52.01 21.7 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 126.096 1.758 . . . . 62.329999999999998 110.766 -178.653 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.7 -36.14 73.75 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.874 1.27 . . . . 55.200000000000003 111.711 -177.445 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 14.8 ttp180 -59.4 -57.9 10.98 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 119.947 1.249 . . . . 63.43 108.45 173.126 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -65.82 -30.56 71.21 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-O 116.574 -1.679 . . . . 74.209999999999994 112.065 -169.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -48.85 -54.53 14.86 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-N 119.898 1.226 . . . . 73.319999999999993 110.237 174.199 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 18.8 mm -55.97 -47.1 80.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-N 119.684 1.129 . . . . 35.25 111.56 179.227 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 50.6 mt -66.66 -18.17 23.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 124.329 1.051 . . . . 64.340000000000003 109.569 -178.226 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 1.4 t -115.72 19.42 15.25 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.708 2.003 . . . . 73.420000000000002 110.058 -174.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -130.65 19.72 5.14 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.695 1.998 . . . . 72.329999999999998 110.341 177.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 33.3 mm . . . . . 0 C--O 1.247 0.943 0 CA-C-O 116.788 -1.577 . . . . 51.43 109.369 177.195 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 34.1 mtt . . . . . 0 N--CA 1.471 0.616 0 N-CA-C 108.86 -0.792 . . . . 73.430000000000007 108.86 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 22.8 p 53.53 175.23 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 127.691 2.396 . . . . 71.510000000000005 115.093 175.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -139.28 88.42 2.27 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 106.494 -1.669 . . . . 74.530000000000001 106.494 178.525 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -136.27 123.48 21.77 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 124.209 1.004 . . . . 73.219999999999999 109.116 -177.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -178.88 -170.71 0.2 Allowed 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 127.242 2.217 . . . . 65.299999999999997 106.589 -159.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.9 t70 61.11 -166.0 0.21 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.55 1.14 . . . . 50.520000000000003 110.357 -177.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 66.7 mtp180 -79.67 151.35 30.55 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 119.695 -1.878 . . . . 74.040000000000006 109.357 171.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.0 tp10 -94.04 -86.28 0.27 Allowed 'General case' 0 CA--C 1.533 0.325 0 O-C-N 123.932 0.77 . . . . 53.329999999999998 109.277 176.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 62.6 mtp180 -149.68 -85.8 0.09 Allowed 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.501 1.121 . . . . 72.109999999999999 108.582 -166.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -164.93 84.37 0.39 Allowed 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 124.806 1.243 . . . . 61.32 109.316 174.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -80.19 34.3 0.3 Allowed 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 114.125 1.157 . . . . 74.299999999999997 114.125 -175.447 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.44 ' HG3' ' H ' ' A' ' 13' ' ' ALA . 6.1 pt-20 -70.08 -85.54 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.64 1.109 . . . . 63.310000000000002 111.444 -176.151 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.44 ' H ' ' HG3' ' A' ' 12' ' ' GLU . . . -72.1 -11.88 60.95 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.736 -1.228 . . . . 42.439999999999998 112.112 177.176 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 51.2 mmtt -57.68 -22.9 48.66 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 125.026 1.33 . . . . 74.540000000000006 113.528 -178.255 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -60.41 -18.79 53.09 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.561 0.744 . . . . 74.400000000000006 112.796 177.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -125.97 55.29 1.47 Allowed 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.258 1.023 . . . . 65.430000000000007 108.41 168.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -156.05 -55.62 0.09 Allowed 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 118.413 -0.803 . . . . 72.099999999999994 111.206 -179.027 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -117.19 122.6 44.5 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 119.093 0.86 . . . . 71.530000000000001 110.357 -165.018 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -57.41 -32.51 66.93 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 125.952 1.701 . . . . 64.129999999999995 112.893 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -63.28 -52.8 60.54 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 123.447 0.699 . . . . 61.420000000000002 111.439 -179.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 44.2 mt -71.97 -39.99 68.95 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 108.463 -0.939 . . . . 34.109999999999999 108.463 -176.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -47.11 -48.31 23.01 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 117.36 -1.305 . . . . 65.200000000000003 111.475 166.325 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -64.79 -48.39 74.63 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 120.419 1.463 . . . . 64.209999999999994 110.803 177.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -50.42 -42.37 53.75 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 121.514 -0.741 . . . . 70.230000000000004 110.798 175.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -90.65 -9.58 46.35 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 125.343 1.457 . . . . 62.100000000000001 114.615 -177.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.07 -41.37 82.02 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 119.723 1.147 . . . . 71.400000000000006 110.552 -174.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -117.48 -85.26 0.64 Allowed 'General case' 0 N--CA 1.442 -0.84 0 N-CA-C 106.266 -1.753 . . . . 52.229999999999997 106.266 -160.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.346 0.0 OUTLIER 48.56 -1.41 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 117.652 2.464 . . . . 72.030000000000001 117.652 171.099 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 -80.13 4.96 15.66 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 121.358 1.89 . . . . 73.299999999999997 112.111 -177.267 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -130.65 -26.98 2.18 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-O 117.31 -1.329 . . . . 44.210000000000001 111.044 178.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.83 -55.01 7.16 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 120.686 1.585 . . . . 71.109999999999999 108.894 175.368 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.452 ' HA ' ' HG3' ' A' ' 35' ' ' GLU . 0.2 OUTLIER -61.01 -13.71 18.23 Favored 'General case' 0 N--CA 1.445 -0.713 0 C-N-CA 126.41 1.884 . . . . 71.219999999999999 115.266 -175.974 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 29.6 tp -71.38 -32.59 68.65 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 120.782 -1.199 . . . . 62.420000000000002 110.262 -172.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.01 -34.82 90.94 Favored Glycine 0 CA--C 1.529 0.948 0 N-CA-C 110.949 -0.861 . . . . 74.340000000000003 110.949 173.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.452 ' HG3' ' HA ' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -65.32 -19.14 65.82 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.754 1.277 . . . . 64.420000000000002 111.406 -173.425 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 19.9 t90 -74.4 -75.71 0.15 Allowed 'General case' 0 C--N 1.341 0.227 0 N-CA-C 107.946 -1.131 . . . . 70.349999999999994 107.946 169.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -54.7 -29.3 52.69 Favored 'General case' 0 C--O 1.222 -0.356 0 C-N-CA 125.139 1.375 . . . . 34.299999999999997 112.722 -171.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -45.08 -53.75 7.55 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.903 1.229 . . . . 65.239999999999995 111.222 169.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.4 -33.52 87.46 Favored Glycine 0 CA--C 1.532 1.109 0 O-C-N 121.95 -0.469 . . . . 74.450000000000003 112.01 -177.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.429 HD22 HD11 ' A' ' 76' ' ' LEU . 7.4 mp -66.12 -50.93 62.31 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.608 1.563 . . . . 65.140000000000001 109.588 173.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.7 mp -62.99 -28.45 70.1 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 125.498 1.519 . . . . 73.409999999999997 113.072 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 108.92 20.82 7.78 Favored Glycine 0 CA--C 1.527 0.802 0 C-N-CA 124.892 1.234 . . . . 72.120000000000005 112.878 -179.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.0 mttt -106.83 135.66 47.99 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 125.794 1.638 . . . . 73.409999999999997 107.944 178.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 17.5 p -138.29 154.22 49.03 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 124.458 1.103 . . . . 71.219999999999999 108.789 -176.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 49.94 -118.06 5.38 Favored Glycine 0 CA--C 1.523 0.555 0 N-CA-C 111.214 -0.754 . . . . 72.340000000000003 111.214 173.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -57.71 -36.86 72.58 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.765 1.626 . . . . 72.140000000000001 113.313 -177.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -68.01 -45.85 72.88 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 122.024 0.916 . . . . 75.239999999999995 109.851 177.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.92 -32.53 74.08 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.695 0.798 . . . . 70.040000000000006 110.475 177.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.7 ttm180 -54.88 -52.12 63.82 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 124.332 1.053 . . . . 73.120000000000005 111.266 178.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.47 -41.22 96.9 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-O 121.671 0.748 . . . . 74.230000000000004 110.988 -179.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -65.14 -37.65 88.09 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 121.252 0.549 . . . . 72.420000000000002 111.396 178.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.09 -1.47 5.99 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.169 1.387 . . . . 34.420000000000002 112.596 177.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 35.7 mt -106.83 7.96 30.49 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.895 1.678 . . . . 64.040000000000006 111.106 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.0 t -141.21 19.94 2.26 Favored 'General case' 0 CA--C 1.543 0.673 0 O-C-N 121.409 -0.807 . . . . 74.430000000000007 112.963 -174.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 25.8 t -130.84 73.49 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 O-C-N 120.445 -1.409 . . . . 73.430000000000007 107.884 178.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 79.9 t -142.15 124.72 14.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 C-N-CA 124.155 0.982 . . . . 74.010000000000005 108.959 175.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.7 t -155.2 -55.66 0.09 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 106.033 -1.839 . . . . 61.399999999999999 106.033 169.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.32 88.38 0.09 Allowed 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 122.385 1.088 . . . . 72.420000000000002 109.871 -166.006 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -146.28 158.19 43.86 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 107.537 -1.283 . . . . 64.230000000000004 107.537 148.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -158.92 -164.68 1.47 Allowed 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 104.501 -2.407 . . . . 72.200000000000003 104.501 170.702 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 66.33 -155.75 0.25 Allowed 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 120.207 1.367 . . . . 65.230000000000004 109.231 -179.481 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 65.58 167.49 0.11 Allowed Pre-proline 0 CA--C 1.556 1.188 0 CA-C-N 120.706 1.594 . . . . 72.200000000000003 110.853 -178.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -61.47 172.15 3.71 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 CA-C-N 121.211 1.468 . . . . 71.430000000000007 109.855 162.275 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -67.48 92.51 0.22 Allowed Glycine 0 CA--C 1.522 0.515 0 N-CA-C 110.368 -1.093 . . . . 63.32 110.368 -176.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.48 -14.57 32.48 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 118.945 1.372 . . . . 75.010000000000005 111.576 175.343 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 49.44 55.86 8.7 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.544 1.938 . . . . 65.209999999999994 111.049 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -111.12 -58.65 2.08 Favored 'General case' 0 CA--C 1.522 -0.12 0 O-C-N 121.949 -0.47 . . . . 62.140000000000001 110.349 -177.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 85.6 t -84.74 -39.66 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 O-C-N 121.528 -0.733 . . . . 73.040000000000006 111.199 -175.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.437 ' CE2' ' HG2' ' A' ' 82' ' ' GLU . 2.3 t80 -74.4 -25.15 59.29 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.503 -0.748 . . . . 63.420000000000002 111.553 179.173 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.7 ttm180 -44.88 -67.77 0.26 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.065 1.746 . . . . 74.049999999999997 112.848 -174.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.576 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -55.13 -46.75 75.66 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 126.087 1.755 . . . . 72.340000000000003 110.115 -177.01 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.65 -57.44 11.94 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 125.267 1.427 . . . . 62.219999999999999 110.189 -177.392 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.423 ' HB2' ' CE2' ' A' ' 69' ' ' PHE . . . -65.59 -36.64 84.33 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.998 0.519 . . . . 74.430000000000007 110.906 -175.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.82 -47.07 85.02 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 122.828 0.451 . . . . 54.509999999999998 111.148 176.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.06 -48.85 78.39 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 124.906 1.283 . . . . 75.430000000000007 109.873 179.332 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.429 HD11 HD22 ' A' ' 40' ' ' LEU . 11.8 tp -100.84 14.65 31.05 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 125.819 1.647 . . . . 74.340000000000003 112.959 -159.175 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -47.01 119.81 2.74 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 127.315 2.246 . . . . 62.329999999999998 110.987 -174.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 86.53 -1.74 87.27 Favored Glycine 0 CA--C 1.524 0.614 0 C-N-CA 124.657 1.122 . . . . 72.329999999999998 113.571 175.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -124.73 0.47 8.09 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 118.675 1.237 . . . . 70.219999999999999 110.512 -174.579 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -148.98 176.14 10.69 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 125.86 1.664 . . . . 50.530000000000001 109.794 171.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -135.69 162.02 33.91 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 126.45 1.9 . . . . 74.239999999999995 107.14 -177.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.437 ' HG2' ' CE2' ' A' ' 69' ' ' PHE . 0.3 OUTLIER -54.43 -55.29 30.29 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 124.926 1.29 . . . . 70.209999999999994 111.409 178.499 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -68.7 -31.45 70.56 Favored 'General case' 0 C--O 1.225 -0.201 0 O-C-N 121.529 -0.732 . . . . 74.239999999999995 111.008 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 77.0 m -66.23 -39.48 89.59 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 118.751 -0.643 . . . . 73.409999999999997 109.286 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 75.0 mt -65.62 -48.32 83.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-N 119.795 1.18 . . . . 71.329999999999998 108.89 175.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.6 ppt_? -63.43 -36.81 84.97 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 118.771 -0.633 . . . . 73.329999999999998 110.818 -175.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -66.49 -54.62 21.88 Favored 'General case' 0 N--CA 1.445 -0.72 0 C-N-CA 124.244 1.018 . . . . 70.409999999999997 109.312 174.442 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.404 ' O ' HD22 ' A' ' 92' ' ' LEU . 10.7 tptt -50.07 -51.88 39.01 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 118.828 0.74 . . . . 74.099999999999994 110.62 -171.027 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 12.6 ptp -64.19 -29.56 70.66 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 120.049 -0.66 . . . . 72.319999999999993 112.27 -175.312 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 89.2 t -79.58 -28.34 12.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 124.159 0.984 . . . . 74.430000000000007 111.072 174.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -54.0 -51.58 63.48 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 121.217 1.826 . . . . 64.010000000000005 110.432 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.404 HD22 ' O ' ' A' ' 88' ' ' LYS . 0.2 OUTLIER -75.31 6.12 4.84 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.828 0.677 . . . . 65.299999999999997 112.828 -174.167 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 36.2 ttm180 -47.64 -41.12 21.48 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.306 1.442 . . . . 73.329999999999998 112.516 -174.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -96.96 -27.39 14.66 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 113.268 0.84 . . . . 53.5 113.268 173.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 44.5 m -59.33 -35.61 74.14 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 120.467 -1.395 . . . . 54.329999999999998 110.962 177.593 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -51.44 -45.01 62.5 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.189 0.996 . . . . 73.120000000000005 112.246 -177.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.47 -27.21 67.63 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-O 119.167 -0.444 . . . . 72.0 112.09 -178.065 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -80.11 -38.55 31.37 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 109.105 -0.702 . . . . 74.109999999999999 109.105 -178.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -55.94 -44.57 78.54 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-O 117.636 -1.173 . . . . 72.409999999999997 112.84 -176.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 20.0 mm -56.1 -49.27 76.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 120.234 1.379 . . . . 73.439999999999998 108.729 178.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 53.7 mt -69.93 -7.04 7.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 C-N-CA 125.245 1.418 . . . . 72.109999999999999 111.453 178.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 9.5 t -117.45 21.38 13.09 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.853 2.061 . . . . 74.340000000000003 110.767 178.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 -119.53 13.39 12.56 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.926 2.091 . . . . 72.439999999999998 108.604 176.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.255 1.363 0 N-CA-C 108.273 -1.01 . . . . 74.109999999999999 108.273 177.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.0 mtm . . . . . 0 N--CA 1.471 0.623 0 N-CA-C 107.531 -1.285 . . . . 73.530000000000001 107.531 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.89 20.02 3.5 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 119.67 1.123 . . . . 52.109999999999999 111.824 -163.506 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 63.48 -173.44 0.16 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.39 1.476 . . . . 74.340000000000003 110.374 -169.562 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -59.68 154.23 18.38 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 124.588 1.155 . . . . 74.409999999999997 109.578 167.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -85.86 156.47 20.53 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 107.48 -1.304 . . . . 51.439999999999998 107.48 151.054 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -147.6 -60.66 0.27 Allowed 'General case' 0 C--O 1.235 0.34 0 N-CA-C 106.355 -1.72 . . . . 71.239999999999995 106.355 -179.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 26.0 ptt-85 -53.63 164.82 0.48 Allowed 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 126.777 2.031 . . . . 72.540000000000006 111.444 162.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -68.23 -81.71 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.659 0.784 . . . . 73.400000000000006 110.258 174.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 32.6 mtp180 -147.17 -70.46 0.23 Allowed 'General case' 0 N--CA 1.465 0.321 0 O-C-N 121.221 -0.924 . . . . 55.509999999999998 109.815 -157.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 44.69 73.92 0.14 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 127.716 2.406 . . . . 63.0 111.224 -176.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -132.83 -163.45 1.35 Allowed 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 127.086 2.155 . . . . 75.099999999999994 107.942 178.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . 0.256 12.9 pt-20 49.69 81.72 0.06 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.911 1.685 . . . . 73.209999999999994 111.461 -176.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.42 39.64 14.9 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 126.288 1.835 . . . . 63.210000000000001 112.756 -177.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.3 mmtt -107.38 -9.46 16.01 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 125.166 1.386 . . . . 75.200000000000003 112.487 -178.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -51.15 -31.22 19.08 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 125.006 1.322 . . . . 75.120000000000005 113.817 176.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.33 -8.11 29.86 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.438 1.095 . . . . 61.009999999999998 113.169 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 18.0 t-80 -117.88 161.2 20.14 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 126.648 1.979 . . . . 71.340000000000003 107.63 -175.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 58.18 -158.07 0.29 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.405 1.082 . . . . 75.129999999999995 109.133 177.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -136.33 -34.11 0.79 Allowed 'General case' 0 C--O 1.223 -0.312 0 C-N-CA 124.277 1.031 . . . . 74.200000000000003 109.222 159.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -45.92 -40.36 10.07 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 125.074 1.35 . . . . 74.299999999999997 111.939 177.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 18.7 mt -66.16 -39.45 89.8 Favored 'General case' 0 C--N 1.331 -0.201 0 O-C-N 120.936 -1.102 . . . . 64.409999999999997 110.918 -175.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -76.76 -26.64 54.76 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.365 1.466 . . . . 62.219999999999999 110.611 174.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -55.36 -39.88 70.61 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.811 1.244 . . . . 72.310000000000002 111.229 -169.697 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.496 ' HE2' HD12 ' A' ' 100' ' ' ILE . 16.1 ptmt -54.38 -46.5 73.07 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 120.692 -1.255 . . . . 72.5 111.259 175.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.609 ' HB1' ' HA ' ' A' ' 97' ' ' ARG . . . -65.38 -58.71 5.22 Favored 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 125.693 1.597 . . . . 74.0 110.847 179.423 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -67.82 -3.45 9.6 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.06 0.763 . . . . 54.240000000000002 113.06 -176.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -116.38 11.41 14.97 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.675 1.99 . . . . 64.310000000000002 112.888 171.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.6 mmt-85 -74.84 -14.42 60.68 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 119.626 -1.921 . . . . 64.430000000000007 112.543 175.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -47.17 -72.41 0.05 Allowed 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 127.37 2.268 . . . . 72.329999999999998 112.819 -163.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -74.13 -5.91 44.55 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 120.76 1.618 . . . . 60.119999999999997 112.993 -177.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.14 -34.98 66.4 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 121.143 1.792 . . . . 74.439999999999998 111.624 -177.027 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.25 -11.76 58.47 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 112.464 0.542 . . . . 55.32 112.464 -175.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -66.93 -22.26 65.95 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 126.103 1.761 . . . . 73.340000000000003 114.239 -171.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -70.08 -31.75 69.38 Favored Glycine 0 C--O 1.224 -0.487 0 C-N-CA 120.608 -0.806 . . . . 74.0 111.301 -179.397 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 75.4 mt-10 -64.65 -33.58 76.26 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 124.035 0.934 . . . . 74.310000000000002 111.517 -172.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 9.0 t90 -58.07 -77.74 0.03 OUTLIER 'General case' 0 C--O 1.233 0.194 0 C-N-CA 124.518 1.127 . . . . 75.230000000000004 108.08 168.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.426 ' HB1' HD13 ' A' ' 76' ' ' LEU . . . -57.28 -29.18 63.64 Favored 'General case' 0 C--O 1.218 -0.565 0 C-N-CA 125.886 1.674 . . . . 74.439999999999998 112.745 -168.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -46.16 -54.56 8.45 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 120.321 1.419 . . . . 54.420000000000002 112.038 176.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -57.86 -40.42 93.05 Favored Glycine 0 CA--C 1.531 1.033 0 CA-C-N 118.707 0.685 . . . . 74.129999999999995 111.443 -179.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.4 mp -63.06 -42.58 99.74 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.364 1.466 . . . . 70.349999999999994 110.362 178.085 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.5 mp -70.08 -0.58 7.93 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 127.899 2.479 . . . . 72.129999999999995 113.198 172.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 71.96 25.54 74.54 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 124.862 1.22 . . . . 71.140000000000001 112.523 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 45.1 mttt -107.98 148.51 29.6 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 125.329 1.452 . . . . 74.530000000000001 108.629 174.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.0 p -142.95 166.78 23.7 Favored 'General case' 0 C--O 1.24 0.563 0 CA-C-O 121.283 0.563 . . . . 71.239999999999995 110.767 171.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 67.13 -113.69 5.79 Favored Glycine 0 N--CA 1.444 -0.793 0 C-N-CA 124.881 1.229 . . . . 74.109999999999999 110.965 168.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -73.44 -41.85 62.71 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.207 -0.497 . . . . 71.340000000000003 111.304 -171.236 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.22 -36.37 82.87 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 110.158 -0.312 . . . . 74.209999999999994 110.158 178.19 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.54 -43.81 93.41 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 122.91 0.484 . . . . 64.340000000000003 110.86 173.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.7 ttt180 -65.27 -47.77 75.51 Favored 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 124.221 1.008 . . . . 73.010000000000005 108.959 179.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.83 -48.13 78.04 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 118.888 -0.577 . . . . 51.130000000000003 110.354 -176.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 45.4 t80 -50.6 -52.6 37.73 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 124.157 0.983 . . . . 74.310000000000002 110.03 172.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.56 -26.55 55.4 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 113.219 0.822 . . . . 64.209999999999994 113.219 178.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 16.3 mt -76.35 -16.95 59.63 Favored 'General case' 0 C--N 1.333 -0.148 0 O-C-N 120.63 -1.294 . . . . 64.299999999999997 111.486 -175.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.6 t -121.26 -8.09 9.25 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 119.965 1.257 . . . . 73.540000000000006 112.664 -172.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 4.7 p -73.19 3.04 1.02 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.095 0 N-CA-C 115.53 1.678 . . . . 63.299999999999997 115.53 -173.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 70.4 t -78.14 110.49 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 O-C-N 119.261 -2.149 . . . . 73.109999999999999 109.315 -168.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.7 p -79.82 -85.98 0.08 Allowed 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.611 1.165 . . . . 54.299999999999997 110.823 177.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.4 t -161.42 -86.48 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 107.053 -1.462 . . . . 72.430000000000007 107.053 -176.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -170.75 162.38 7.66 Favored 'General case' 0 C--N 1.343 0.291 0 C-N-CA 124.476 1.111 . . . . 60.409999999999997 111.131 173.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -83.02 -176.43 6.33 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.89 1.276 . . . . 75.540000000000006 111.894 175.169 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 74.56 -176.98 0.15 Allowed 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 128.76 2.824 . . . . 75.420000000000002 109.575 -166.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 64.73 79.82 0.24 Allowed Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 126.531 1.932 . . . . 62.509999999999998 112.183 166.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.44 95.91 0.47 Allowed 'Trans proline' 0 N--CA 1.458 -0.612 0 C-N-CA 123.304 2.669 . . . . 61.43 110.136 -174.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 178.53 -49.69 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.407 0 CA-C-O 118.473 -1.181 . . . . 72.299999999999997 111.295 176.227 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -52.22 -49.85 63.14 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 125.853 1.661 . . . . 71.5 110.489 -169.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.635 ' HG2' ' H ' ' A' ' 67' ' ' ASP 0.271 10.5 tt0 59.85 -164.05 0.22 Allowed 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 125.042 1.337 . . . . 40.43 108.906 -169.417 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.635 ' H ' ' HG2' ' A' ' 66' ' ' GLU 0.299 44.0 m-20 67.77 -48.05 0.51 Allowed 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 129.978 3.311 . . . . 55.039999999999999 112.277 -172.082 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 69.4 t -48.96 -61.61 0.54 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 C-N-CA 125.628 1.571 . . . . 75.510000000000005 111.13 177.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.445 ' CE2' HD12 ' A' ' 85' ' ' ILE . 17.7 t80 -71.08 -42.35 69.48 Favored 'General case' 0 CA--C 1.527 0.061 0 C-N-CA 123.611 0.764 . . . . 64.230000000000004 110.647 177.248 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -51.84 -50.25 61.26 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.365 1.066 . . . . 63.210000000000001 110.334 -173.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -67.95 -37.8 82.02 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 118.874 -0.584 . . . . 64.519999999999996 110.672 -175.404 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.511 HD22 HD22 ' A' ' 76' ' ' LEU . 0.7 OUTLIER -64.89 -52.46 56.4 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-N 119.062 0.846 . . . . 55.299999999999997 110.276 174.853 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.24 -21.06 65.99 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.629 1.104 . . . . 54.229999999999997 112.365 -177.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.99 -63.7 1.01 Allowed 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.892 0.877 . . . . 75.230000000000004 110.606 166.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.61 -21.71 66.6 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.859 0.863 . . . . 71.409999999999997 112.698 -174.049 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.897 HD23 ' HB2' ' A' ' 80' ' ' ALA . 10.3 tp -113.1 19.29 17.3 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.918 2.487 . . . . 74.549999999999997 110.79 -171.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -51.23 110.24 0.42 Allowed 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.586 1.954 . . . . 62.210000000000001 108.821 171.082 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 94.62 0.14 64.85 Favored Glycine 0 CA--C 1.527 0.843 0 C-N-CA 125.187 1.375 . . . . 62.350000000000001 114.319 178.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.6 7.45 5.28 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.956 1.702 . . . . 64.150000000000006 111.5 178.803 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.897 ' HB2' HD23 ' A' ' 76' ' ' LEU . . . -135.21 176.98 8.17 Favored 'General case' 0 C--O 1.233 0.234 0 O-C-N 120.87 -1.144 . . . . 52.409999999999997 111.116 177.072 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -138.24 168.62 19.36 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 114.168 -1.378 . . . . 73.420000000000002 107.659 158.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 87.5 mt-10 -66.09 -19.19 65.77 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 112.195 -2.275 . . . . 72.400000000000006 111.442 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -110.15 -8.93 14.72 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.022 0.828 . . . . 75.109999999999999 111.403 177.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.1 m -84.2 -41.36 17.06 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.641 -0.662 . . . . 72.239999999999995 110.678 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.445 HD12 ' CE2' ' A' ' 69' ' ' PHE . 79.5 mt -60.2 -44.63 95.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-N 119.727 1.149 . . . . 55.210000000000001 109.504 -179.018 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -58.71 -24.94 62.36 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 118.34 0.518 . . . . 62.420000000000002 112.218 178.208 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -94.12 -5.52 47.05 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 118.548 -0.739 . . . . 34.119999999999997 111.943 -178.721 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -93.23 -64.52 1.08 Allowed 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 120.046 1.293 . . . . 64.200000000000003 110.154 173.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 2.0 mtm -64.71 -29.09 70.07 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 119.597 -0.841 . . . . 75.540000000000006 111.62 -161.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 27.4 t -63.51 -47.53 91.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 125.106 1.362 . . . . 52.100000000000001 110.795 176.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -59.65 -45.99 90.35 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 119.301 0.955 . . . . 54.420000000000002 111.23 -170.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 6.3 mt -72.38 -0.74 13.21 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 125.126 1.37 . . . . 63.219999999999999 110.704 -167.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 45.3 ttt180 -51.17 -38.6 53.1 Favored 'General case' 0 N--CA 1.445 -0.691 0 C-N-CA 124.254 1.022 . . . . 74.329999999999998 110.764 164.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.01 -53.31 40.25 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.974 0.807 . . . . 43.219999999999999 110.711 176.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.0 m -54.7 -31.27 57.74 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.027 1.731 . . . . 52.219999999999999 111.283 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.7 -53.37 59.12 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.431 1.092 . . . . 74.299999999999997 112.313 -178.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.609 ' HA ' ' HB1' ' A' ' 25' ' ' ALA . 14.6 ptm180 -70.43 -37.55 74.41 Favored 'General case' 0 CA--C 1.519 -0.229 0 C-N-CA 120.053 -0.659 . . . . 64.329999999999998 110.991 179.232 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -59.0 -46.29 88.55 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-O 118.072 -0.966 . . . . 63.109999999999999 111.488 -174.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -59.62 -31.98 69.99 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 119.029 0.831 . . . . 62.030000000000001 112.791 -174.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.496 HD12 ' HE2' ' A' ' 24' ' ' LYS . 27.2 mm -73.39 -38.2 52.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 O-C-N 121.224 -0.922 . . . . 73.329999999999998 110.374 177.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 82.3 mt -74.76 -13.63 15.54 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 C-N-CA 124.187 0.995 . . . . 74.099999999999994 109.191 177.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 16.1 t -85.62 -40.82 15.81 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.213 1.405 . . . . 40.310000000000002 108.154 174.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -128.71 65.61 1.42 Allowed 'General case' 0 C--O 1.239 0.541 0 C-N-CA 124.745 1.218 . . . . 71.200000000000003 107.781 -169.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.414 HD12 ' H ' ' A' ' 104' ' ' ILE . 5.1 mp . . . . . 0 C--O 1.253 1.286 0 N-CA-C 107.403 -1.332 . . . . 72.030000000000001 107.403 176.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.2 mtt . . . . . 0 N--CA 1.469 0.492 0 N-CA-C 106.863 -1.532 . . . . 61.409999999999997 106.863 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.4 t -103.31 -25.45 13.31 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.854 1.262 . . . . 70.400000000000006 111.923 -161.511 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.2 m 44.95 44.57 8.12 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.641 1.576 . . . . 70.219999999999999 112.559 175.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 47.26 70.41 0.41 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 126.827 2.051 . . . . 73.219999999999999 111.499 -168.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -60.82 141.71 56.79 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 123.42 0.688 . . . . 32.530000000000001 109.522 -178.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -152.63 -85.27 0.07 Allowed 'General case' 0 N--CA 1.445 -0.724 0 CA-C-O 118.773 -0.632 . . . . 72.230000000000004 110.015 -173.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 71.7 mtm180 -117.27 60.08 0.76 Allowed 'General case' 0 CA--C 1.518 -0.285 0 C-N-CA 125.201 1.4 . . . . 70.400000000000006 107.557 -175.035 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -65.9 -29.52 69.97 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.721 1.209 . . . . 62.520000000000003 112.209 -175.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.8 -164.76 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.542 1.537 . . . . 72.400000000000006 113.434 178.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 57.22 46.76 18.19 Favored 'General case' 0 C--O 1.227 -0.101 0 C-N-CA 127.026 2.131 . . . . 63.100000000000001 111.488 -176.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -64.53 1.36 0.83 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 114.39 1.256 . . . . 65.409999999999997 114.39 167.242 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -50.94 98.38 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 127.232 2.213 . . . . 72.510000000000005 110.676 179.469 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 53.05 11.85 0.25 Allowed 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 115.846 1.795 . . . . 54.200000000000003 115.846 -171.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 54.3 mttt -84.71 -4.04 58.84 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 124.691 1.197 . . . . 65.519999999999996 113.192 177.153 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -55.18 -30.36 59.74 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 120.927 1.694 . . . . 73.209999999999994 112.445 -179.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -77.76 5.51 9.28 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 113.749 1.018 . . . . 70.5 113.749 179.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 10.2 t-80 -143.47 176.61 9.05 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.607 1.563 . . . . 64.219999999999999 109.472 -176.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 62.76 -171.8 0.16 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.87 1.668 . . . . 73.239999999999995 111.992 165.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -118.3 -35.82 3.71 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 124.713 1.205 . . . . 72.099999999999994 110.001 171.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 36.3 mp0 -45.08 -50.25 11.12 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 127.409 2.284 . . . . 74.439999999999998 112.327 -172.612 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.78 ' H ' HD22 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -75.23 -44.18 47.63 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 124.255 1.022 . . . . 74.420000000000002 111.568 -176.882 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -57.51 -44.97 85.44 Favored 'General case' 0 C--O 1.219 -0.527 0 C-N-CA 125.017 1.327 . . . . 73.209999999999994 109.988 178.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.72 -48.22 66.81 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.006 1.322 . . . . 73.239999999999995 110.249 -177.868 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 42.3 mttp -61.48 -57.65 11.32 Favored 'General case' 0 C--O 1.232 0.175 0 O-C-N 121.584 -0.697 . . . . 50.420000000000002 110.352 171.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -71.98 -16.16 62.07 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 114.248 1.203 . . . . 65.030000000000001 114.248 -165.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -62.48 -50.82 69.92 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 127.561 2.344 . . . . 74.030000000000001 108.783 167.027 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.57 16.95 17.4 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 114.333 1.234 . . . . 54.399999999999999 114.333 -145.393 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -109.86 -6.97 15.07 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 116.301 1.963 . . . . 71.200000000000003 116.301 -154.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.9 ptt180 -62.64 -16.62 57.71 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 121.375 1.898 . . . . 65.120000000000005 115.319 -170.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -116.95 -13.4 10.64 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 126.346 1.859 . . . . 70.109999999999999 112.636 173.248 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.1 -8.32 11.64 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 121.575 1.989 . . . . 70.430000000000007 113.625 -175.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.468 ' H ' HD23 ' A' ' 32' ' ' LEU . 1.4 pt? -104.68 -3.2 23.98 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 126.457 1.903 . . . . 63.219999999999999 114.697 179.581 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 35.6 tp -68.71 -35.3 76.99 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 123.759 0.824 . . . . 74.120000000000005 111.043 -176.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -57.09 -42.87 93.36 Favored Glycine 0 C--O 1.221 -0.715 0 CA-C-O 118.78 -1.011 . . . . 53.219999999999999 110.72 166.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -64.77 -16.74 63.42 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 118.924 1.362 . . . . 74.329999999999998 112.369 -176.041 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 14.2 t90 -80.64 -63.7 1.35 Allowed 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.955 0.902 . . . . 74.040000000000006 109.137 164.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.7 -29.67 27.94 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.577 1.551 . . . . 54.219999999999999 114.189 -174.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.02 -61.51 2.22 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 125.927 1.691 . . . . 65.200000000000003 111.385 -177.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.85 -15.53 58.09 Favored Glycine 0 CA--C 1.531 1.082 0 CA-C-N 118.709 0.686 . . . . 71.040000000000006 113.153 -177.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 19.8 mt -76.69 -43.91 35.81 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.789 1.236 . . . . 72.200000000000003 109.215 173.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.451 HD23 ' HE3' ' A' ' 79' ' ' LYS . 24.2 mt -71.33 1.66 5.89 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.955 2.102 . . . . 64.340000000000003 112.001 165.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.05 0.5 44.02 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.763 1.649 . . . . 61.200000000000003 114.278 -177.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -65.51 127.52 32.17 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 125.386 1.474 . . . . 72.340000000000003 107.431 173.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.6 p -140.69 147.52 39.38 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.408 -0.59 . . . . 73.040000000000006 109.408 -179.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 82.27 -129.89 9.35 Favored Glycine 0 C--N 1.33 0.23 0 N-CA-C 111.17 -0.772 . . . . 74.319999999999993 111.17 172.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -70.04 -28.31 65.36 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.353 -0.61 . . . . 71.040000000000006 109.353 179.305 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -62.49 -41.29 98.7 Favored 'General case' 0 CA--C 1.514 -0.424 0 C-N-CA 125.181 1.392 . . . . 71.230000000000004 111.131 177.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.85 -57.26 7.35 Favored 'General case' 0 N--CA 1.441 -0.878 0 N-CA-C 107.385 -1.339 . . . . 54.140000000000001 107.385 172.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.07 -51.85 29.06 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 118.62 0.645 . . . . 74.200000000000003 112.116 -175.449 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.47 -38.65 90.64 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.009 1.323 . . . . 74.420000000000002 111.799 -179.177 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -62.73 -44.1 97.08 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.923 0.889 . . . . 71.239999999999995 110.289 174.392 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.4 -27.11 68.78 Favored 'General case' 0 CA--C 1.53 0.182 0 O-C-N 121.299 -0.875 . . . . 71.329999999999998 112.992 -176.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 9.2 mt -60.28 -49.02 79.27 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 119.031 0.832 . . . . 71.319999999999993 108.861 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.5 t -76.25 6.19 5.85 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 125.155 1.382 . . . . 74.329999999999998 112.04 179.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 98.6 t -119.48 94.04 2.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 C-N-CA 125.355 1.462 . . . . 63.020000000000003 108.41 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.5 p -140.93 157.46 22.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 106.533 -1.654 . . . . 73.010000000000005 106.533 155.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 13.4 t -171.49 -170.77 0.84 Allowed 'General case' 0 C--O 1.239 0.547 0 C-N-CA 126.233 1.813 . . . . 51.43 106.562 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 49.1 m -134.91 46.85 2.4 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.224 1.41 . . . . 73.0 110.07 -177.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -60.23 149.53 32.9 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 123.367 0.667 . . . . 72.319999999999993 111.92 -176.107 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 52.32 158.58 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 131.053 3.741 . . . . 74.239999999999995 112.615 -173.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 68.31 -24.46 0.13 Allowed 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 125.672 1.589 . . . . 65.140000000000001 113.328 -176.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -67.17 157.0 86.62 Favored Pre-proline 0 C--O 1.242 0.676 0 CA-C-N 119.308 0.958 . . . . 72.230000000000004 110.512 162.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -85.27 63.94 6.0 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 123.122 2.548 . . . . 70.040000000000006 111.865 -166.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -132.07 -170.99 12.7 Favored Glycine 0 CA--C 1.525 0.704 0 C-N-CA 126.472 1.987 . . . . 65.030000000000001 109.61 178.246 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -120.66 -74.76 0.6 Allowed 'General case' 0 C--O 1.233 0.228 0 N-CA-C 107.498 -1.297 . . . . 61.130000000000003 107.498 176.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -106.64 4.08 27.53 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.958 1.303 . . . . 74.120000000000005 112.431 178.229 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -72.81 -15.25 61.63 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.908 1.283 . . . . 45.43 113.749 -151.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 67.5 t -106.33 -41.57 6.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 O-C-N 120.331 -1.481 . . . . 73.400000000000006 109.684 168.266 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -49.6 -37.59 28.36 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.282 1.033 . . . . 74.120000000000005 111.438 176.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.0 -28.25 16.3 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.647 1.579 . . . . 72.140000000000001 113.932 175.329 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -86.25 -41.6 14.48 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 108.529 -0.915 . . . . 62.039999999999999 108.529 -176.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.21 -52.82 11.26 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.407 0.683 . . . . 74.340000000000003 110.728 -178.722 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.34 -21.92 66.75 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 125.17 1.388 . . . . 74.010000000000005 111.356 -175.362 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.25 -41.84 96.77 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 118.461 0.573 . . . . 73.219999999999999 111.001 169.254 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.02 -53.33 15.15 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 107.954 -1.128 . . . . 70.239999999999995 107.954 177.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.522 ' HA ' ' HE2' ' A' ' 79' ' ' LYS . 65.5 mt -83.91 33.12 0.48 Allowed 'General case' 0 C--O 1.233 0.218 0 C-N-CA 125.551 1.54 . . . . 74.319999999999993 111.794 -179.393 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -67.64 121.06 15.08 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 106.429 -1.693 . . . . 74.329999999999998 106.429 175.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 85.44 -0.27 88.4 Favored Glycine 0 CA--C 1.532 1.14 0 C-N-CA 124.977 1.275 . . . . 74.120000000000005 113.756 -173.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.522 ' HE2' ' HA ' ' A' ' 76' ' ' LEU . 36.3 mtmm -135.6 -5.28 2.25 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 118.744 1.272 . . . . 72.019999999999996 113.224 -161.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -164.07 122.4 1.85 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-N 119.99 1.268 . . . . 41.130000000000003 110.531 179.024 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.85 161.27 29.13 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.334 1.054 . . . . 64.0 108.896 175.196 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -49.08 -52.66 24.41 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 126.01 1.724 . . . . 73.329999999999998 108.664 165.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -66.78 -8.39 28.05 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.177 1.391 . . . . 72.120000000000005 112.225 -171.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 17.9 m -111.88 -44.18 3.5 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 126.512 1.925 . . . . 73.439999999999998 110.319 -179.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 74.5 mt -52.46 -56.46 6.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-N 119.654 1.115 . . . . 44.140000000000001 108.276 172.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -56.5 -29.95 62.43 Favored 'General case' 0 N--CA 1.457 -0.115 0 C-N-CA 123.515 0.726 . . . . 74.310000000000002 112.015 -175.125 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -84.16 -50.18 8.16 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 124.435 1.094 . . . . 65.239999999999995 109.242 -174.334 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.8 tppt? -60.17 -36.36 77.4 Favored 'General case' 0 N--CA 1.463 0.19 0 O-C-N 121.749 -0.594 . . . . 72.329999999999998 111.313 -173.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 28.7 mtt -54.26 -52.81 60.2 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.864 0.466 . . . . 63.130000000000003 109.775 173.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 79.3 t -61.78 -30.65 48.88 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 125.376 1.47 . . . . 70.099999999999994 110.854 -177.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 62.1 tt0 -69.5 -52.4 26.87 Favored 'General case' 0 CA--C 1.53 0.186 0 O-C-N 121.062 -1.024 . . . . 71.129999999999995 110.274 174.083 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 38.9 mt -67.52 -24.86 65.61 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.309 1.044 . . . . 73.420000000000002 110.44 -176.284 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 42.0 ttp180 -56.93 -33.39 66.93 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 124.955 1.302 . . . . 54.100000000000001 110.605 174.336 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -68.26 -47.88 66.53 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 118.533 -0.746 . . . . 63.130000000000003 111.11 177.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 31.0 m -56.0 -81.87 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 126.582 1.953 . . . . 71.310000000000002 110.098 -178.305 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 43.55 -75.03 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.306 1 C-N-CA 132.874 4.47 . . . . 72.310000000000002 113.983 165.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 20.0 ptt-85 -66.6 -40.24 88.77 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.235 -0.893 . . . . 74.230000000000004 109.727 -177.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -59.78 -36.16 76.13 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-O 117.973 -1.013 . . . . 71.140000000000001 110.589 -177.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -57.98 -42.18 84.56 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 118.981 0.81 . . . . 65.030000000000001 111.291 -177.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 24.1 mm -56.81 -45.49 83.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-N 119.775 1.171 . . . . 65.400000000000006 109.6 176.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 27.8 mt -74.15 -17.53 16.99 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 C-N-CA 124.379 1.072 . . . . 74.530000000000001 110.075 -177.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 21.0 t -87.38 -0.9 57.46 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.142 1.777 . . . . 74.120000000000005 110.578 172.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 78.8 mt-10 -132.12 42.61 3.12 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 126.325 1.85 . . . . 74.329999999999998 107.536 -166.143 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.0 mt . . . . . 0 C--O 1.251 1.18 0 N-CA-C 105.328 -2.101 . . . . 74.430000000000007 105.328 169.647 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.471 0.602 0 N-CA-C 106.843 -1.54 . . . . 75.530000000000001 106.843 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.3 m -150.5 101.34 2.95 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 107.843 -1.169 . . . . 64.109999999999999 107.843 -174.044 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 10.9 p -140.27 120.85 14.21 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 123.958 0.903 . . . . 74.219999999999999 108.587 -173.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -159.32 174.13 15.23 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.379 1.472 . . . . 73.120000000000005 107.916 170.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -64.86 -168.53 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 129.544 3.138 . . . . 74.099999999999994 113.179 -176.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -56.66 115.43 2.54 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 125.295 1.438 . . . . 62.200000000000003 111.426 -177.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.8 mtm180 -122.08 165.59 15.82 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 125.974 1.71 . . . . 73.109999999999999 108.618 -178.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.62 169.78 3.7 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 124.954 1.302 . . . . 73.099999999999994 114.132 -166.705 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.15 157.74 3.31 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 113.659 -1.609 . . . . 55.0 112.628 -162.316 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -124.3 61.37 1.12 Allowed 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 124.573 1.149 . . . . 71.540000000000006 110.46 -165.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -149.57 177.07 10.07 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.356 1.462 . . . . 73.099999999999994 112.809 -176.427 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . 0.285 5.1 pt-20 44.65 -84.98 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 128.998 2.919 . . . . 73.310000000000002 114.318 -178.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.91 -22.1 64.02 Favored 'General case' 0 N--CA 1.462 0.163 0 O-C-N 121.243 -0.911 . . . . 74.329999999999998 113.214 176.263 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.529 ' HB3' HD13 ' A' ' 21' ' ' LEU . 3.4 mptt -64.96 -19.52 66.0 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-O 117.034 -1.46 . . . . 75.129999999999995 113.798 171.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -54.29 -39.83 67.3 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 121.699 2.045 . . . . 62.43 112.278 -177.662 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.65 -11.47 45.1 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.451 1.1 . . . . 54.039999999999999 113.467 177.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 -104.24 164.05 11.99 Favored 'General case' 0 N--CA 1.445 -0.705 0 C-N-CA 126.732 2.013 . . . . 74.420000000000002 108.422 177.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 51.34 -154.93 0.15 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.402 1.081 . . . . 74.129999999999995 108.571 -176.02 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -133.99 -19.83 1.99 Allowed 'General case' 0 C--O 1.222 -0.363 0 C-N-CA 125.038 1.335 . . . . 71.129999999999995 109.086 148.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -44.21 -43.37 7.15 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 127.437 2.295 . . . . 54.229999999999997 111.959 177.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.529 HD13 ' HB3' ' A' ' 14' ' ' LYS . 11.9 mt -67.83 -44.15 77.91 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 125.649 1.58 . . . . 61.140000000000001 111.56 -176.442 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -83.88 -20.72 32.58 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 123.6 0.76 . . . . 74.420000000000002 111.813 -178.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.29 -55.13 19.9 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 124.257 1.023 . . . . 61.530000000000001 109.081 -169.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.7 pttp -45.01 -53.44 7.75 Favored 'General case' 0 C--N 1.34 0.155 0 C-N-CA 124.793 1.237 . . . . 72.420000000000002 113.36 176.369 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.592 ' HB1' ' HA ' ' A' ' 97' ' ' ARG . . . -52.83 -57.1 11.31 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.11 0.964 . . . . 72.519999999999996 110.335 -179.615 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -78.16 13.42 1.48 Allowed 'General case' 0 C--O 1.242 0.684 0 C-N-CA 124.568 1.147 . . . . 74.420000000000002 112.76 -176.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.1 3.21 2.63 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 124.823 1.249 . . . . 75.400000000000006 112.656 -173.351 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.94 7.48 13.22 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.655 1.116 . . . . 74.230000000000004 113.994 -173.185 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 20.3 ptt-85 -60.19 -33.69 72.57 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 121.025 1.738 . . . . 72.230000000000004 109.874 177.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.448 ' HB3' HG13 ' A' ' 56' ' ' VAL . 0.4 OUTLIER -70.63 -12.5 61.6 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 120.547 -1.346 . . . . 72.120000000000005 112.606 -179.762 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -81.71 -50.7 8.98 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 120.41 1.459 . . . . 64.219999999999999 109.516 -175.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.29 -13.37 62.35 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 115.633 -0.712 . . . . 75.439999999999998 112.452 -179.693 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 17.0 mt -58.36 -32.18 68.31 Favored 'General case' 0 N--CA 1.468 0.448 0 O-C-N 120.645 -1.284 . . . . 63.240000000000002 111.457 171.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -72.98 -6.56 68.22 Favored Glycine 0 CA--C 1.528 0.882 0 O-C-N 121.25 -0.906 . . . . 52.350000000000001 112.28 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -83.09 -20.52 34.72 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 120.94 -1.329 . . . . 73.340000000000003 111.822 171.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 36.7 t90 -74.68 -82.06 0.07 Allowed 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.336 1.054 . . . . 74.329999999999998 108.668 179.511 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.68 -17.25 21.0 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.211 1.404 . . . . 51.450000000000003 113.791 -171.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -51.66 -55.44 19.42 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.174 0.59 . . . . 71.340000000000003 110.363 172.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -62.26 -41.98 99.72 Favored Glycine 0 CA--C 1.527 0.814 0 N-CA-C 111.276 -0.73 . . . . 31.530000000000001 111.276 -175.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.0 mp -56.56 -34.11 66.8 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.57 1.548 . . . . 72.439999999999998 111.695 176.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 71.8 mt -94.54 4.37 53.94 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.766 2.027 . . . . 62.439999999999998 112.456 176.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 76.41 42.58 22.39 Favored Glycine 0 CA--C 1.527 0.833 0 O-C-N 120.849 -1.157 . . . . 52.439999999999998 113.109 176.314 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 30.5 mttm -127.34 132.66 50.18 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 126.358 1.863 . . . . 74.530000000000001 108.038 176.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 45.3 p -134.45 -179.1 5.37 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 124.797 1.239 . . . . 71.430000000000007 108.094 164.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 46.49 -123.08 6.92 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 125.398 1.475 . . . . 73.519999999999996 113.318 173.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -63.49 -31.42 72.58 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 117.405 0.602 . . . . 72.239999999999995 112.372 -174.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -77.07 -40.26 46.79 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.677 0.751 . . . . 64.409999999999997 110.846 -177.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.12 -33.3 74.2 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.846 -0.616 . . . . 74.510000000000005 110.272 168.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 7.0 ttm-85 -58.24 -55.95 28.4 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.417 -0.957 . . . . 75.450000000000003 108.417 173.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.68 -43.01 80.05 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.852 1.261 . . . . 74.310000000000002 111.103 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -60.67 -41.92 96.05 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.347 1.059 . . . . 54.420000000000002 111.344 175.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.97 -0.49 18.92 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 120.476 -1.39 . . . . 72.540000000000006 113.345 -178.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.4 mt -79.42 5.31 13.02 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 120.782 1.628 . . . . 74.409999999999997 112.331 177.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.31 -22.46 1.75 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.534 1.133 . . . . 64.319999999999993 112.466 -174.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 35.6 m -64.43 -12.08 11.66 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 N-CA-C 115.526 1.676 . . . . 74.439999999999998 115.526 -171.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.448 HG13 ' HB3' ' A' ' 30' ' ' ASN . 9.9 t -88.23 115.85 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 N-CA-C 107.935 -1.135 . . . . 72.209999999999994 107.935 -170.678 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.2 t -139.8 -53.69 0.54 Allowed 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 126.304 1.841 . . . . 73.25 106.359 -178.21 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.7 t 64.62 50.67 2.07 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.264 1.426 . . . . 74.109999999999999 110.432 176.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -132.08 117.68 18.66 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 104.251 -2.5 . . . . 60.420000000000002 104.251 -178.288 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.425 ' CZ ' ' HB3' ' A' ' 86' ' ' ARG . 0.2 OUTLIER -176.9 38.24 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.687 1.595 . . . . 74.099999999999994 109.491 177.16 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -119.07 -8.35 10.21 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 120.352 -1.468 . . . . 61.439999999999998 111.366 -163.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -140.63 162.42 49.17 Favored Pre-proline 0 CA--C 1.54 0.589 0 C-N-CA 125.528 1.531 . . . . 54.020000000000003 111.325 -171.735 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -73.2 -9.86 23.7 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 123.952 3.102 . . . . 63.439999999999998 113.701 -174.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -105.08 16.09 46.65 Favored Glycine 0 CA--C 1.526 0.75 0 C-N-CA 124.847 1.213 . . . . 74.349999999999994 111.801 178.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -93.88 4.39 54.0 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.314 1.057 . . . . 71.120000000000005 111.397 -179.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -53.96 -38.26 64.8 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 119.505 1.048 . . . . 71.319999999999993 112.085 -172.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -59.45 -25.38 64.33 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-O 119.033 -0.508 . . . . 75.140000000000001 111.298 -177.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.439 ' HA ' ' HE3' ' A' ' 71' ' ' LYS . 57.3 t -63.16 -36.74 77.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-N 119.255 0.934 . . . . 54.009999999999998 110.305 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -89.74 -19.1 25.17 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 123.797 0.839 . . . . 40.229999999999997 110.189 -179.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.5 -36.17 79.74 Favored 'General case' 0 CA--C 1.522 -0.133 0 N-CA-C 115.154 1.539 . . . . 74.540000000000006 115.154 -167.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.686 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -68.74 -53.44 21.93 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 106.635 -1.617 . . . . 61.240000000000002 106.635 -175.508 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -47.6 -61.39 1.96 Allowed 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 126.102 1.761 . . . . 71.150000000000006 109.064 172.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.89 -42.98 76.77 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 124.154 0.909 . . . . 35.210000000000001 111.405 -171.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -75.53 -35.64 60.68 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.776 1.028 . . . . 75.209999999999994 113.776 -179.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -73.75 -44.07 57.28 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 120.904 -1.123 . . . . 63.520000000000003 109.419 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 12.6 tp -86.04 13.76 7.21 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 128.332 2.653 . . . . 71.549999999999997 110.681 -179.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -55.73 123.08 12.94 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 125.407 1.483 . . . . 74.25 108.43 -178.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 98.75 -11.43 62.72 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 124.787 1.184 . . . . 63.549999999999997 113.728 -174.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.5 mtmm -128.71 6.6 5.62 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 119.058 1.429 . . . . 74.140000000000001 112.534 -171.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -146.92 174.32 11.61 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.997 0.919 . . . . 64.120000000000005 109.735 170.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -130.35 156.8 44.1 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 125.329 1.452 . . . . 73.310000000000002 107.595 -178.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 68.3 mm-40 -66.26 -20.76 66.2 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 125.207 1.403 . . . . 74.140000000000001 112.425 -177.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 21.8 pt-20 -94.78 -22.77 17.86 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 120.929 -1.107 . . . . 54.210000000000001 112.371 170.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.5 m -79.38 -40.71 29.45 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.028 0.931 . . . . 63.210000000000001 110.583 -172.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 77.6 mt -56.65 -57.34 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 CA-C-N 119.524 1.056 . . . . 75.340000000000003 108.507 -177.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.425 ' HB3' ' CZ ' ' A' ' 60' ' ' PHE . 0.1 OUTLIER -59.87 -41.11 90.81 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-N 118.15 0.432 . . . . 73.540000000000006 112.123 -179.646 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.51 -44.78 85.31 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 122.967 0.507 . . . . 71.430000000000007 110.385 -179.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.73 -26.17 61.43 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.861 0.864 . . . . 75.510000000000005 112.465 -179.482 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 21.9 mtt -73.1 -41.2 64.3 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 119.014 0.825 . . . . 64.099999999999994 110.803 177.607 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 11.9 t -73.11 -31.19 33.99 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.137 0.975 . . . . 63.310000000000002 110.129 178.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -48.61 -57.71 5.8 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 126.074 1.75 . . . . 61.520000000000003 111.769 -174.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.93 25.3 0.12 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.767 1.627 . . . . 61.109999999999999 114.138 -179.41 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 3.4 mtt-85 -50.54 -48.28 57.35 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 125.61 1.564 . . . . 74.299999999999997 113.539 -177.408 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.17 -38.88 21.75 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 123.924 0.89 . . . . 63.299999999999997 109.939 177.374 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.8 m -50.8 -39.09 51.98 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.561 1.544 . . . . 75.310000000000002 110.817 -179.122 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.3 -38.63 77.43 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.14 -0.975 . . . . 73.540000000000006 113.591 178.352 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.592 ' HA ' ' HB1' ' A' ' 25' ' ' ALA . 5.0 ptm180 -86.24 -27.02 24.71 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.313 0.96 . . . . 53.100000000000001 112.156 175.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -66.84 -48.91 67.42 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 123.99 0.916 . . . . 75.530000000000001 111.78 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 56.9 mt-30 -59.59 -29.25 67.83 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 118.297 0.498 . . . . 64.239999999999995 111.918 -169.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 42.3 mm -67.39 -32.42 57.22 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 124.488 1.115 . . . . 74.5 112.351 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 51.3 mt -88.95 -21.85 6.76 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 N-CA-C 108.529 -0.915 . . . . 75.420000000000002 108.529 176.294 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 4.3 t -71.34 -37.31 71.71 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.973 -0.454 . . . . 62.140000000000001 109.804 172.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -135.53 76.04 1.59 Allowed 'General case' 0 C--O 1.236 0.367 0 C-N-CA 127.012 2.125 . . . . 74.439999999999998 105.549 -165.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 9.1 mt . . . . . 0 C--O 1.247 0.951 0 C-N-CA 127.602 2.361 . . . . 74.510000000000005 107.896 -177.416 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.0 ttm . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 109.305 -0.628 . . . . 64.140000000000001 109.305 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -76.65 175.1 9.64 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 108.741 -0.837 . . . . 74.400000000000006 108.741 154.373 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -124.38 -53.24 1.71 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 127.525 2.33 . . . . 72.299999999999997 107.323 165.106 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 55.5 t80 70.86 77.19 0.18 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 127.411 2.285 . . . . 72.120000000000005 108.675 -177.556 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . 0.339 0.0 OUTLIER 45.56 -171.18 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 130.357 3.463 . . . . 71.299999999999997 111.326 -163.893 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -162.91 113.0 1.4 Allowed 'General case' 0 C--O 1.236 0.391 0 C-N-CA 126.188 1.795 . . . . 75.430000000000007 106.368 171.148 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -107.1 -175.28 2.75 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.62 1.168 . . . . 62.420000000000002 110.066 -169.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.6 pm0 -55.77 174.58 0.11 Allowed 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 122.229 1.014 . . . . 73.5 113.138 167.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.3 mtm180 -90.03 -67.55 0.84 Allowed 'General case' 0 N--CA 1.469 0.495 0 O-C-N 120.657 -1.277 . . . . 52.409999999999997 111.824 -174.531 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 44.64 71.1 0.28 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.869 2.068 . . . . 63.530000000000001 111.291 176.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -134.63 8.19 3.58 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.233 1.813 . . . . 75.540000000000006 110.719 -168.754 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -67.72 108.4 2.92 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 107.972 -1.121 . . . . 75.439999999999998 107.972 -174.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.15 14.33 5.41 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.242 1.417 . . . . 51.140000000000001 114.101 -179.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 13.3 mttt -85.15 -3.81 58.94 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.132 1.773 . . . . 72.519999999999996 113.44 176.478 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.435 ' CE1' HG21 ' A' ' 100' ' ' ILE . 0.1 OUTLIER -68.46 -32.65 72.82 Favored 'General case' 0 C--O 1.234 0.263 0 O-C-N 120.732 -1.23 . . . . 53.439999999999998 110.321 -165.955 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -79.91 14.24 1.87 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.043 1.737 . . . . 71.519999999999996 113.309 171.223 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -127.47 -21.41 3.83 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.983 1.265 . . . . 71.299999999999997 114.123 -164.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -152.58 168.13 26.58 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 119.745 1.157 . . . . 74.540000000000006 110.361 176.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -69.88 -46.0 66.43 Favored 'General case' 0 C--O 1.224 -0.281 0 O-C-N 121.608 -0.682 . . . . 73.129999999999995 111.295 171.169 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -45.61 -54.55 7.52 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.349 1.46 . . . . 64.120000000000005 112.119 -166.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.83 ' H ' HD22 ' A' ' 21' ' ' LEU . 0.1 OUTLIER -63.77 -39.48 94.37 Favored 'General case' 0 N--CA 1.436 -1.134 0 O-C-N 120.869 -1.144 . . . . 74.540000000000006 111.441 -175.542 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -61.65 -42.94 99.6 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.859 0.863 . . . . 73.200000000000003 110.872 174.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -55.24 -39.76 70.11 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.705 0.802 . . . . 64.200000000000003 109.95 172.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.07 -40.21 73.22 Favored 'General case' 0 C--N 1.342 0.247 0 O-C-N 120.625 -1.297 . . . . 73.109999999999999 112.351 173.351 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.26 -47.76 72.66 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 119.465 1.029 . . . . 72.120000000000005 111.716 174.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -58.23 -30.4 66.48 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 121.41 0.624 . . . . 75.5 110.578 177.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -99.09 25.2 6.98 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 126.677 1.991 . . . . 73.430000000000007 110.856 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.666 ' HG3' HD11 ' A' ' 100' ' ' ILE . 6.9 mmt-85 -114.4 -6.75 12.91 Favored 'General case' 0 N--CA 1.463 0.223 0 O-C-N 120.852 -1.155 . . . . 75.310000000000002 111.303 165.014 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 30.9 ptt-85 -60.6 -29.92 69.5 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 119.632 1.105 . . . . 75.340000000000003 112.197 -176.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.547 ' HA ' HD12 ' A' ' 33' ' ' LEU . 16.4 m120 -94.92 -13.32 25.51 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 123.864 0.865 . . . . 72.120000000000005 112.401 177.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.407 ' HD2' HD12 ' A' ' 32' ' ' LEU . 0.0 OUTLIER -57.66 -59.84 4.58 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 120.451 1.478 . . . . 74.530000000000001 110.032 178.889 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.407 HD12 ' HD2' ' A' ' 31' ' ' ARG . 3.5 mp -69.26 -25.53 64.32 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.51 -0.768 . . . . 74.450000000000003 109.91 -166.779 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.547 HD12 ' HA ' ' A' ' 30' ' ' ASN . 60.6 mt -51.96 -33.13 36.37 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.176 0.99 . . . . 71.140000000000001 112.69 173.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -75.24 -36.12 46.36 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 110.124 -1.191 . . . . 72.310000000000002 110.124 -179.113 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -69.17 -23.2 63.91 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.468 1.507 . . . . 64.420000000000002 111.486 -179.29 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 19.0 t90 -67.79 -78.52 0.06 Allowed 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.406 1.082 . . . . 61.049999999999997 108.477 166.276 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -56.5 -26.06 53.23 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 124.481 1.113 . . . . 61.020000000000003 113.242 -168.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -45.84 -54.22 8.46 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.309 0.958 . . . . 51.509999999999998 111.186 170.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.82 -44.12 97.33 Favored Glycine 0 CA--C 1.53 0.97 0 N-CA-C 111.558 -0.617 . . . . 54.109999999999999 111.558 -176.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.5 mp -58.47 -51.64 69.0 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 126.695 1.998 . . . . 73.329999999999998 110.61 176.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.4 mp -54.93 -42.19 71.97 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.678 1.191 . . . . 75.319999999999993 111.304 174.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 112.21 24.83 4.96 Favored Glycine 0 CA--C 1.519 0.307 0 C-N-CA 124.519 1.057 . . . . 64.109999999999999 112.225 -175.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 33.0 mttm -97.31 137.89 35.62 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 126.89 2.076 . . . . 75.450000000000003 107.249 172.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 36.4 p -139.42 167.91 21.03 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 123.806 0.842 . . . . 63.020000000000003 109.011 -178.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 54.04 -130.72 44.23 Favored Glycine 0 CA--C 1.521 0.469 0 C-N-CA 124.747 1.165 . . . . 35.119999999999997 110.81 173.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -71.39 -22.3 61.89 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 118.335 -0.84 . . . . 74.129999999999995 112.878 -179.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -64.16 -47.05 81.36 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.99 1.268 . . . . 74.409999999999997 110.599 175.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.54 -46.61 88.37 Favored 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 125.052 1.341 . . . . 52.340000000000003 109.76 173.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 6.3 ttm-85 -57.22 -50.5 72.68 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.624 0.77 . . . . 73.109999999999999 111.008 177.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.44 -29.51 70.19 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 126.535 1.934 . . . . 75.430000000000007 111.807 -178.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 82.5 t80 -73.31 -40.97 64.09 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.105 0.962 . . . . 73.209999999999994 109.516 171.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -68.16 7.18 0.61 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.55 1.14 . . . . 74.439999999999998 113.536 177.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 42.2 mt -88.28 -15.36 36.0 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.183 0.993 . . . . 72.219999999999999 111.863 172.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.9 t -125.01 3.65 8.0 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 119.211 0.914 . . . . 61.32 111.654 -169.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 5.9 p -62.7 -26.87 41.78 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 O-C-N 120.362 -1.461 . . . . 63.210000000000001 112.648 169.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 4.9 m -72.33 117.76 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.569 0 C-N-CA 127.017 2.127 . . . . 72.510000000000005 110.829 -173.482 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.45 HG23 ' H ' ' A' ' 58' ' ' SER . 0.7 OUTLIER -144.34 -85.69 0.13 Allowed 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 127.339 2.256 . . . . 72.430000000000007 107.106 175.217 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.45 ' H ' HG23 ' A' ' 57' ' ' THR . 10.0 m -161.23 -177.11 5.82 Favored 'General case' 0 N--CA 1.452 -0.373 1 C-N-CA 131.726 4.01 . . . . 75.219999999999999 105.059 174.886 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -101.44 -179.17 3.95 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 126.304 1.841 . . . . 74.329999999999998 108.636 168.338 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -135.21 144.91 47.19 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 125.334 1.453 . . . . 74.540000000000006 108.886 177.082 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -157.28 -11.6 0.09 Allowed 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 123.757 0.823 . . . . 73.140000000000001 112.861 -173.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -157.75 165.59 18.36 Favored Pre-proline 0 CA--C 1.553 1.065 0 CA-C-N 120.564 1.529 . . . . 74.230000000000004 110.638 178.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -85.17 71.75 4.82 Favored 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 122.706 2.271 . . . . 73.209999999999994 113.254 -155.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -159.38 -49.77 0.01 OUTLIER Glycine 0 CA--C 1.526 0.735 0 C-N-CA 123.71 0.672 . . . . 72.549999999999997 111.665 165.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -81.2 17.28 1.32 Allowed 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.028 1.331 . . . . 63.210000000000001 111.622 -175.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -61.85 82.05 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.692 1.597 . . . . 75.030000000000001 109.054 168.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -139.15 -5.21 1.46 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.851 1.26 . . . . 54.25 112.381 179.009 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.402 HG13 ' H ' ' A' ' 69' ' ' PHE . 4.8 p -93.78 -61.76 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 C-N-CA 124.663 1.185 . . . . 73.450000000000003 109.14 175.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.402 ' H ' HG13 ' A' ' 68' ' ' VAL . 0.3 OUTLIER -54.02 -30.82 49.09 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.435 1.494 . . . . 71.310000000000002 110.384 175.619 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.07 -32.87 16.72 Favored 'General case' 0 C--N 1.341 0.23 0 C-N-CA 126.57 1.948 . . . . 71.420000000000002 113.255 -171.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 10.8 mmtt -108.29 -32.97 7.25 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-O 118.327 -0.844 . . . . 54.25 110.946 175.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.36 -47.35 66.18 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.189 0.596 . . . . 64.420000000000002 110.7 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -57.01 -37.16 71.3 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 119.095 -0.478 . . . . 43.409999999999997 112.13 -178.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -80.23 -43.31 21.64 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.258 1.023 . . . . 74.140000000000001 111.532 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.15 -38.84 80.66 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 122.36 1.076 . . . . 72.439999999999998 109.194 178.319 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.534 HD23 ' HB2' ' A' ' 80' ' ' ALA . 9.2 tp -102.55 21.16 15.75 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 128.109 2.564 . . . . 61.119999999999997 111.071 -175.582 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 47.2 tt0 -52.48 114.95 1.54 Allowed 'General case' 0 C--O 1.233 0.234 0 C-N-CA 125.734 1.613 . . . . 63.130000000000003 109.919 -177.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.94 -3.66 81.03 Favored Glycine 0 CA--C 1.532 1.111 0 CA-C-O 118.432 -1.205 . . . . 71.340000000000003 113.112 175.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -118.59 3.74 11.73 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 126.701 2.001 . . . . 60.219999999999999 111.893 -172.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.534 ' HB2' HD23 ' A' ' 76' ' ' LEU . . . -142.68 173.18 11.77 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 126.765 2.026 . . . . 72.230000000000004 106.868 173.317 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -120.47 161.13 21.78 Favored 'General case' 0 C--O 1.24 0.554 0 N-CA-C 105.764 -1.939 . . . . 64.430000000000007 105.764 163.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -55.28 -53.65 53.45 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 123.589 0.756 . . . . 63.039999999999999 110.052 174.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -67.43 -19.25 65.35 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.41 -0.359 . . . . 75.209999999999994 110.655 -174.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 19.6 m -87.5 -39.7 14.94 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 124.788 1.235 . . . . 75.310000000000002 111.504 178.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 89.2 mt -56.79 -55.41 20.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-N 121.636 2.016 . . . . 75.439999999999998 108.377 171.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.65 -7.91 8.65 Favored 'General case' 0 N--CA 1.462 0.166 0 N-CA-C 112.553 0.575 . . . . 73.209999999999994 112.553 -179.107 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -122.5 42.26 3.21 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 125.567 1.547 . . . . 54.310000000000002 107.958 176.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -118.53 -41.27 2.83 Favored 'General case' 0 C--N 1.341 0.207 0 O-C-N 121.648 -0.658 . . . . 55.149999999999999 111.578 166.115 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -63.7 -44.51 93.45 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.28 0.632 . . . . 71.230000000000004 111.421 -175.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 42.2 t -67.76 -31.28 51.64 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 C-N-CA 125.332 1.453 . . . . 64.129999999999995 111.839 179.16 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.69 -60.36 3.78 Favored 'General case' 0 C--O 1.231 0.126 0 O-C-N 120.561 -1.337 . . . . 72.420000000000002 109.821 -169.266 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.88 16.9 1.68 Allowed 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 124.383 1.073 . . . . 75.530000000000001 112.103 -178.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 14.6 ttm180 -49.08 -44.78 42.29 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.451 1.101 . . . . 61.509999999999998 111.006 171.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.32 -58.62 7.52 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 118.713 -0.661 . . . . 31.219999999999999 109.961 175.095 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 5.8 m -52.57 -51.3 60.42 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.483 1.113 . . . . 74.5 110.538 -175.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -63.04 -23.68 67.56 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 113.682 0.994 . . . . 71.409999999999997 113.682 -176.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.2 -68.89 0.54 Allowed 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 106.064 -1.828 . . . . 71.530000000000001 106.064 165.679 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -44.97 -49.15 11.34 Favored 'General case' 0 CA--C 1.518 -0.278 0 C-N-CA 128.124 2.57 . . . . 71.519999999999996 113.197 -167.465 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -52.18 -35.72 49.71 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-O 117.919 -1.039 . . . . 75.530000000000001 112.27 -174.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.666 HD11 ' HG3' ' A' ' 28' ' ' ARG . 14.5 mm -57.94 -54.35 33.17 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 120.071 1.305 . . . . 75.519999999999996 111.056 -178.581 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 80.8 mt -62.63 -19.46 22.91 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 C-N-CA 123.67 0.788 . . . . 74.230000000000004 109.422 178.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.28 5.39 39.96 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 126.867 2.067 . . . . 52.240000000000002 113.153 -179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -121.26 11.82 10.87 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.94 1.696 . . . . 73.540000000000006 110.589 -175.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 35.2 mt . . . . . 0 C--O 1.248 1.007 0 C-N-CA 127.822 2.449 . . . . 71.219999999999999 110.733 -172.999 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 ptm . . . . . 0 N--CA 1.475 0.786 0 N-CA-C 113.574 0.953 . . . . 54.329999999999998 113.574 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.2 p -142.7 169.6 17.27 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 120.269 1.395 . . . . 71.549999999999997 108.475 178.156 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.85 15.28 2.29 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 120.75 -1.219 . . . . 70.420000000000002 112.956 -172.677 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 41.0 m-85 -65.75 -60.05 3.28 Favored 'General case' 0 C--O 1.234 0.287 0 O-C-N 120.715 -1.241 . . . . 62.549999999999997 112.261 -173.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.85 -55.44 6.65 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.344 0.974 . . . . 72.010000000000005 109.657 -173.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 45.8 t0 48.27 84.21 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 129.622 3.169 . . . . 65.109999999999999 112.911 175.079 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.0 mmt180 -137.06 126.75 25.41 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 125.09 1.356 . . . . 73.140000000000001 110.054 -166.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -102.51 -20.05 14.65 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.033 0.933 . . . . 73.129999999999995 112.309 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -88.45 -179.47 6.09 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 118.581 0.628 . . . . 70.010000000000005 110.152 177.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . 56.83 36.46 27.75 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 126.567 1.947 . . . . 74.239999999999995 112.66 175.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . 0.456 ' HA ' HD13 ' A' ' 21' ' ' LEU . 0.5 OUTLIER -63.27 -0.72 0.87 Allowed 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 115.069 1.507 . . . . 60.210000000000001 115.069 176.661 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -59.56 108.15 0.69 Allowed 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 127.666 2.386 . . . . 54.32 109.444 -173.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 55.8 -8.23 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 128.609 2.763 . . . . 64.430000000000007 115.806 -168.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 34.7 mttt -62.78 -23.29 67.15 Favored 'General case' 0 C--O 1.224 -0.254 0 C-N-CA 125.673 1.589 . . . . 73.150000000000006 113.137 -174.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -53.29 -29.36 32.92 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 119.651 1.114 . . . . 70.340000000000003 113.965 -176.01 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -97.83 2.62 49.53 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.715 0.806 . . . . 73.120000000000005 113.096 -178.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.4 m170 -125.45 -62.19 1.22 Allowed 'General case' 0 C--O 1.237 0.428 0 C-N-CA 125.929 1.692 . . . . 43.25 109.077 -170.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -85.93 112.14 20.89 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 106.793 -1.558 . . . . 74.010000000000005 106.793 174.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.53 -36.55 78.99 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-O 118.104 -0.951 . . . . 74.329999999999998 110.987 -175.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.494 ' H ' ' CD ' ' A' ' 20' ' ' GLU . 3.4 mp0 -54.5 -41.51 69.69 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.737 1.153 . . . . 65.129999999999995 111.368 -172.417 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.456 HD13 ' HA ' ' A' ' 11' ' ' HIS . 32.8 mt -64.01 -31.93 73.29 Favored 'General case' 0 C--O 1.233 0.234 0 O-C-N 121.599 -0.688 . . . . 72.349999999999994 111.989 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -84.83 -32.99 22.99 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 125.908 1.683 . . . . 74.040000000000006 110.861 176.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -55.14 -50.52 69.05 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 125.799 1.64 . . . . 70.040000000000006 109.183 -170.118 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.446 ' HE3' ' HA ' ' A' ' 21' ' ' LEU . 13.7 ptpt -52.05 -46.02 64.93 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.58 0.752 . . . . 74.439999999999998 111.992 175.247 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.21 -36.93 80.29 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 124.285 1.034 . . . . 43.509999999999998 111.016 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -71.49 -17.32 62.35 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.673 1.589 . . . . 64.129999999999995 111.201 176.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -123.97 25.58 7.89 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.573 1.949 . . . . 54.210000000000001 113.683 -169.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.321 0.0 OUTLIER -137.03 11.98 3.08 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 115.087 1.514 . . . . 74.010000000000005 115.087 177.421 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.8 ptt-85 -60.87 -18.71 57.77 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 114.955 1.465 . . . . 73.200000000000003 114.955 176.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -94.81 -24.02 17.24 Favored 'General case' 0 C--O 1.225 -0.217 0 CA-C-N 120.476 1.489 . . . . 72.140000000000001 110.671 172.157 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.39 -55.4 21.98 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 119.879 1.218 . . . . 73.209999999999994 111.132 -177.18 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.513 HD13 HE22 ' A' ' 99' ' ' GLN . 1.5 pt? -63.7 -20.7 65.93 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.07 -0.968 . . . . 72.120000000000005 113.307 -174.266 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.4 -38.33 90.65 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.37 1.468 . . . . 70.010000000000005 110.085 -176.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.48 -33.79 88.18 Favored Glycine 0 CA--C 1.527 0.82 0 CA-C-O 119.561 -0.577 . . . . 74.420000000000002 111.774 178.16 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -65.3 -38.33 89.87 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 117.866 0.833 . . . . 72.329999999999998 110.679 -177.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.482 ' CD1' ' HE2' ' A' ' 88' ' ' LYS . 28.8 t90 -60.51 -60.65 3.48 Favored 'General case' 0 C--O 1.228 -0.071 0 N-CA-C 108.291 -1.003 . . . . 74.030000000000001 108.291 177.366 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.05 -45.97 64.91 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 118.816 -0.611 . . . . 63.109999999999999 111.297 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -45.73 -57.5 4.21 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.209 1.004 . . . . 51.420000000000002 112.387 179.51 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.97 -32.08 80.84 Favored Glycine 0 CA--C 1.529 0.944 0 N-CA-C 112.069 -0.412 . . . . 75.299999999999997 112.069 -176.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 80.7 mt -71.07 -48.05 54.81 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 124.139 0.975 . . . . 74.409999999999997 110.66 178.212 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.6 mp -52.83 -31.66 40.23 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 124.859 1.263 . . . . 74.0 111.386 168.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 101.22 8.75 46.51 Favored Glycine 0 CA--C 1.526 0.781 0 C-N-CA 125.748 1.642 . . . . 55.240000000000002 112.394 -177.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.427 ' HE3' ' CD1' ' A' ' 51' ' ' TYR . 48.5 mttm -72.39 127.69 33.35 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 106.554 -1.647 . . . . 74.109999999999999 106.554 167.758 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 17.7 p -144.5 170.02 16.84 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.707 -0.849 . . . . 73.140000000000001 108.707 177.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.53 -131.84 15.19 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 109.205 -1.558 . . . . 73.049999999999997 109.205 -177.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -76.47 -30.8 57.45 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 118.843 -0.598 . . . . 64.120000000000005 111.003 177.347 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -57.6 -41.31 80.98 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 119.576 1.08 . . . . 72.329999999999998 111.585 -176.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.1 -46.52 90.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.645 -1.161 . . . . 64.310000000000002 111.387 174.405 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.8 ttt85 -57.48 -55.09 39.3 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 124.904 1.282 . . . . 71.409999999999997 109.165 178.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.65 -43.7 97.28 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 126.653 1.981 . . . . 52.43 111.376 -178.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.427 ' CD1' ' HE3' ' A' ' 43' ' ' LYS . 43.5 t80 -61.71 -44.39 97.02 Favored 'General case' 0 C--N 1.333 -0.13 0 O-C-N 121.709 -0.619 . . . . 74.409999999999997 109.995 174.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.53 -25.27 62.28 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 121.243 -0.91 . . . . 43.399999999999999 112.766 -175.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 37.7 mt -64.47 -21.04 66.54 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.766 1.227 . . . . 73.230000000000004 114.045 -173.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.9 t -100.71 -5.85 25.9 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.305 0.957 . . . . 74.299999999999997 111.009 -173.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 6.3 t -93.45 82.87 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 O-C-N 120.403 -1.436 . . . . 74.200000000000003 109.535 -164.112 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 3.7 m -132.93 87.8 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.96 0 C-N-CA 127.57 2.348 . . . . 64.5 110.156 -177.173 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.0 t -155.57 133.01 11.01 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 106.022 -1.844 . . . . 70.310000000000002 106.022 -169.369 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.2 t -161.26 76.24 0.53 Allowed 'General case' 0 C--O 1.232 0.138 0 CA-C-N 120.327 1.421 . . . . 41.140000000000001 108.473 -172.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.459 ' H ' ' CG2' ' A' ' 68' ' ' VAL . 26.9 m-20 -144.68 90.47 2.08 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 106.91 -1.515 . . . . 72.540000000000006 106.91 -163.054 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -154.86 -3.9 0.15 Allowed 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.55 1.54 . . . . 73.430000000000007 111.418 -169.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -64.06 -43.71 94.67 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 120.695 -1.253 . . . . 53.439999999999998 111.791 -161.526 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -132.6 163.24 52.09 Favored Pre-proline 0 C--O 1.235 0.33 0 C-N-CA 126.176 1.79 . . . . 64.5 110.298 -176.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -80.55 64.3 8.87 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.352 2.701 . . . . 50.32 111.631 -172.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -134.5 -70.66 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 107.789 -2.124 . . . . 73.409999999999997 107.789 171.769 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.23 -55.1 37.85 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 125.641 1.576 . . . . 71.430000000000007 111.691 -159.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 52.95 11.41 0.21 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 129.178 2.991 . . . . 70.329999999999998 115.719 169.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -74.87 -23.21 58.37 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 113.01 0.744 . . . . 62.299999999999997 113.01 -158.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.459 ' CG2' ' H ' ' A' ' 59' ' ' ASP . 18.0 t -71.2 -62.33 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.219 0 C-N-CA 124.064 0.945 . . . . 70.319999999999993 108.662 177.003 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -60.12 -32.92 71.46 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-O 118.695 -0.669 . . . . 73.219999999999999 110.808 -165.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 25.7 ttp180 -48.42 -58.14 5.07 Favored 'General case' 0 CA--C 1.517 -0.311 0 C-N-CA 123.489 0.716 . . . . 74.230000000000004 110.955 172.254 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.5 mmtp -74.1 -43.6 57.02 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.884 -0.413 . . . . 62.299999999999997 109.884 -177.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.12 -58.72 7.4 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 124.071 0.948 . . . . 71.030000000000001 110.252 -171.266 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.19 -34.43 70.35 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 118.489 -0.767 . . . . 62.409999999999997 111.486 -175.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.62 -33.6 62.62 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 119.412 1.005 . . . . 64.120000000000005 112.299 176.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.49 -27.67 67.2 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.95 -1.094 . . . . 65.439999999999998 109.488 172.594 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.6 tp -120.48 22.85 11.12 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 127.013 2.125 . . . . 65.120000000000005 111.782 -165.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -48.45 114.18 0.91 Allowed 'General case' 0 C--O 1.233 0.199 0 C-N-CA 127.584 2.354 . . . . 72.040000000000006 108.829 173.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 77.54 6.22 86.56 Favored Glycine 0 CA--C 1.538 1.503 0 N-CA-C 114.636 0.614 . . . . 62.340000000000003 114.636 174.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 5.4 pttm -129.28 3.94 5.19 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 119.032 1.416 . . . . 71.310000000000002 113.556 -174.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -139.8 -162.44 1.34 Allowed 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.752 1.221 . . . . 74.230000000000004 108.426 164.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -136.17 147.19 47.58 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 125.595 1.558 . . . . 72.129999999999995 107.772 -176.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -69.16 -15.67 63.46 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.792 0.837 . . . . 65.409999999999997 113.239 -176.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -104.95 -2.08 25.01 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.57 1.148 . . . . 72.040000000000006 112.723 171.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 10.1 m -101.37 -35.9 9.06 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 121.059 -1.025 . . . . 74.420000000000002 112.982 -175.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 22.7 mt -55.09 -53.99 28.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-N 119.192 0.905 . . . . 45.509999999999998 109.342 -178.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -50.14 -51.36 43.93 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 124.026 0.931 . . . . 65.209999999999994 109.507 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -73.37 -9.13 58.38 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 124.404 1.082 . . . . 53.310000000000002 112.6 -172.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.482 ' HE2' ' CD1' ' A' ' 36' ' ' TRP . 57.6 tptt -84.79 -65.21 1.03 Allowed 'General case' 0 CA--C 1.519 -0.243 0 O-C-N 120.184 -1.573 . . . . 75.010000000000005 107.977 178.799 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 3.2 ptt? -61.74 -33.78 74.65 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 113.178 0.807 . . . . 73.439999999999998 113.178 -170.006 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 96.3 t -65.18 -49.19 80.41 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.223 0 C-N-CA 123.917 0.887 . . . . 74.329999999999998 109.497 176.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -62.06 -36.57 82.04 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 121.034 -1.041 . . . . 71.209999999999994 110.932 -173.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 83.2 mt -65.93 -6.11 11.43 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 125.424 1.489 . . . . 63.310000000000002 112.113 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -53.56 -51.82 61.69 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 120.191 1.359 . . . . 74.200000000000003 111.866 -178.009 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -78.95 -9.15 59.43 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.204 0.602 . . . . 70.299999999999997 112.563 -175.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 31.7 m -64.57 -38.21 90.22 Favored 'General case' 0 C--O 1.226 -0.165 0 O-C-N 120.827 -1.171 . . . . 62.439999999999998 110.108 -179.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.613 ' HA ' HE21 ' A' ' 99' ' ' GLN . . . -64.32 -27.06 68.77 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 120.834 -1.166 . . . . 62.039999999999999 113.276 -170.169 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 12.7 tpt85 -65.02 -53.96 37.87 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.53 1.132 . . . . 73.430000000000007 108.713 173.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -63.07 -56.18 19.17 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 124.385 1.074 . . . . 63.350000000000001 110.893 -177.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . 0.613 HE21 ' HA ' ' A' ' 96' ' ' ALA . 11.1 pt20 -63.67 -18.5 64.03 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.541 1.136 . . . . 70.129999999999995 113.27 -164.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 11.6 mm -87.09 -38.53 12.27 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.156 0 C-N-CA 125.767 1.627 . . . . 73.450000000000003 110.076 177.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 76.6 mt -71.84 -28.3 30.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 O-C-N 121.027 -1.046 . . . . 74.109999999999999 108.325 172.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 2.9 t -73.12 -43.72 61.28 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.57 0.748 . . . . 73.319999999999993 109.434 177.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -132.81 82.85 2.02 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 106.015 -1.846 . . . . 61.450000000000003 106.015 -174.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.757 HD12 ' H ' ' A' ' 104' ' ' ILE . 2.0 mp . . . . . 0 C--O 1.253 1.244 0 N-CA-C 106.626 -1.62 . . . . 71.010000000000005 106.626 173.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.7 ttt . . . . . 0 N--CA 1.468 0.43 0 CA-C-O 117.918 -1.039 . . . . 71.219999999999999 109.381 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 61.4 m -54.83 108.9 0.44 Allowed 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.677 1.126 . . . . 75.109999999999999 110.864 179.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 14.2 t -155.0 151.93 29.05 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.502 1.121 . . . . 75.120000000000005 108.351 164.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -152.32 102.91 2.8 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 105.093 -2.188 . . . . 62.240000000000002 105.093 162.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -139.44 20.26 2.56 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 126.212 1.805 . . . . 73.430000000000007 110.339 -166.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 75.01 -56.84 0.62 Allowed 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 129.831 3.252 . . . . 72.129999999999995 110.808 174.088 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.5 mtt180 -69.89 164.11 24.49 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 125.342 1.457 . . . . 71.219999999999999 108.431 164.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -161.12 -55.85 0.05 Allowed 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 115.746 -0.661 . . . . 71.340000000000003 110.474 -156.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.4 ptp85 -130.56 150.89 51.55 Favored 'General case' 0 CA--C 1.497 -1.067 0 C-N-CA 125.157 1.383 . . . . 74.439999999999998 113.045 -154.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -148.31 81.28 1.47 Allowed 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 113.112 -1.858 . . . . 72.540000000000006 109.749 -157.058 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -56.51 -32.21 64.84 Favored 'General case' 0 C--O 1.206 -1.233 0 CA-C-O 117.748 -1.12 . . . . 73.129999999999995 113.362 166.511 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . 0.263 11.0 pt-20 43.99 58.36 3.69 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-N 121.088 1.767 . . . . 64.150000000000006 111.911 -177.422 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 55.84 12.21 0.83 Allowed 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 127.667 2.387 . . . . 70.120000000000005 116.219 -172.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 11.7 mmtt -70.61 -7.26 42.8 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 119.908 -1.745 . . . . 70.150000000000006 113.867 174.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 1.3 m-30 -59.71 -32.5 70.59 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 121.197 1.817 . . . . 65.540000000000006 111.122 176.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -73.95 15.6 0.29 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.642 1.177 . . . . 64.219999999999999 113.54 176.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -153.31 178.04 10.21 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 125.268 1.427 . . . . 70.329999999999998 109.774 -164.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 51.07 -162.46 0.07 Allowed 'General case' 0 C--O 1.236 0.362 0 C-N-CA 128.077 2.551 . . . . 70.239999999999995 111.974 168.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -145.46 8.98 1.19 Allowed 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 125.945 1.698 . . . . 73.030000000000001 110.971 169.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -72.14 -52.37 16.96 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-N 119.288 0.949 . . . . 64.409999999999997 109.725 169.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.903 ' H ' HD22 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -69.69 -46.02 66.99 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 124.658 1.183 . . . . 70.349999999999994 112.288 -169.578 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 39.4 t-20 -58.43 -41.43 85.01 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 124.218 1.007 . . . . 64.239999999999995 110.942 -175.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -47.98 -51.84 22.18 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.832 2.053 . . . . 71.340000000000003 111.748 177.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 3.7 mttp -55.51 -57.65 11.03 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 108.917 -0.772 . . . . 65.319999999999993 108.917 172.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.98 2.96 0.92 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.441 1.496 . . . . 72.129999999999995 113.983 -176.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -98.41 -28.47 13.62 Favored 'General case' 0 N--CA 1.45 -0.468 0 O-C-N 120.504 -1.372 . . . . 72.25 110.388 171.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -128.87 34.7 4.43 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 120.714 -1.241 . . . . 62.109999999999999 113.451 -159.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.452 ' CD ' ' HB1' ' A' ' 96' ' ' ALA . 0.0 OUTLIER -125.12 -6.29 7.22 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 115.262 1.578 . . . . 73.140000000000001 115.262 -172.356 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 76.5 mtt85 -53.89 -22.93 11.06 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 120.109 1.322 . . . . 70.209999999999994 113.535 176.529 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -95.17 -17.6 21.64 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 113.151 0.797 . . . . 71.510000000000005 113.151 177.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.6 ttt180 -56.03 -56.37 21.6 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.548 1.067 . . . . 64.430000000000007 110.784 -179.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -70.67 -16.28 62.79 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 114.085 1.142 . . . . 74.329999999999998 114.085 -176.156 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 12.4 mt -61.9 -25.9 67.84 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.564 1.074 . . . . 74.450000000000003 110.521 167.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.13 -37.42 92.83 Favored Glycine 0 N--CA 1.442 -0.947 0 CA-C-O 119.268 -0.74 . . . . 43.109999999999999 111.963 173.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -65.84 -27.64 68.39 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 118.544 1.172 . . . . 73.239999999999995 110.694 179.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 28.9 t90 -71.77 -62.14 1.53 Allowed 'General case' 0 CA--C 1.534 0.354 0 O-C-N 121.213 -0.929 . . . . 70.439999999999998 109.25 171.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -54.85 -48.95 72.23 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 113.692 0.997 . . . . 63.240000000000002 113.692 -176.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -47.58 -50.38 24.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 119.252 0.933 . . . . 72.340000000000003 111.731 175.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -65.34 -7.13 31.08 Favored Glycine 0 CA--C 1.534 1.265 0 C-N-CA 125.337 1.446 . . . . 71.409999999999997 114.611 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 18.3 mt -102.93 -45.85 4.84 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 126.316 1.846 . . . . 63.520000000000003 109.731 172.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.407 HD22 ' CZ ' ' A' ' 51' ' ' TYR . 1.8 mp -62.33 -10.59 11.6 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 127.099 2.16 . . . . 63.119999999999997 114.805 -176.05 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 89.03 34.41 8.88 Favored Glycine 0 CA--C 1.523 0.561 0 N-CA-C 110.875 -0.89 . . . . 71.310000000000002 110.875 -179.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 16.2 mttm -117.45 143.98 45.48 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 106.755 -1.572 . . . . 63.509999999999998 106.755 172.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 10.2 p -141.92 172.18 13.04 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 107.128 -1.434 . . . . 64.439999999999998 107.128 167.13 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 60.73 -142.98 48.3 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 111.742 -0.543 . . . . 73.099999999999994 111.742 175.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -60.98 -32.02 71.59 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.05 0.389 . . . . 64.400000000000006 112.05 -177.105 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -59.92 -47.19 86.8 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 124.514 1.126 . . . . 73.5 111.199 177.404 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.59 -45.42 94.17 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.29 -0.868 . . . . 71.120000000000005 110.69 172.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.9 ttt180 -58.59 -50.29 74.34 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 123.995 0.918 . . . . 74.409999999999997 111.083 -176.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.19 -48.74 80.44 Favored 'General case' 0 C--O 1.233 0.184 0 C-N-CA 126.984 2.113 . . . . 73.430000000000007 111.412 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.407 ' CZ ' HD22 ' A' ' 41' ' ' LEU . 72.3 t80 -63.67 -37.95 89.28 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.474 -0.766 . . . . 73.519999999999996 110.656 176.688 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -66.2 -14.25 61.59 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 120.858 -1.151 . . . . 75.439999999999998 112.741 177.259 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 22.8 mt -70.08 -31.98 69.82 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 120.169 1.35 . . . . 63.32 110.405 172.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 17.0 p -90.35 -20.06 23.3 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 120.929 -1.107 . . . . 43.310000000000002 111.247 -171.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 57.5 t -68.85 88.35 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 125.787 1.635 . . . . 71.329999999999998 108.615 168.184 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 20.1 t -134.83 138.97 48.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 106.773 -1.565 . . . . 65.230000000000004 106.773 148.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 66.3 p -154.47 167.99 28.19 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 128.437 2.695 . . . . 74.420000000000002 107.362 175.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.5 m -163.42 100.38 0.93 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 125.997 1.719 . . . . 71.049999999999997 106.726 169.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -156.1 45.72 0.45 Allowed 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 119.74 1.155 . . . . 61.409999999999997 113.453 161.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -132.55 -12.87 3.02 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 120.945 -1.097 . . . . 70.140000000000001 111.576 179.54 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -65.85 -19.05 65.74 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.949 -1.094 . . . . 73.409999999999997 110.794 174.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -145.91 155.78 51.65 Favored Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 126.375 1.87 . . . . 72.040000000000006 108.536 -163.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -73.74 101.16 1.35 Allowed 'Trans proline' 0 N--CA 1.459 -0.531 0 C-N-CA 122.942 2.428 . . . . 54.350000000000001 111.968 -161.131 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -109.22 169.0 13.55 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 124.879 1.228 . . . . 53.140000000000001 113.243 -173.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.403 ' CG ' ' H ' ' A' ' 66' ' ' GLU . 7.1 p-10 -84.06 -82.06 0.17 Allowed 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 105.955 -1.869 . . . . 71.010000000000005 105.955 173.475 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.403 ' H ' ' CG ' ' A' ' 65' ' ' ASP . 9.1 tt0 -162.61 81.19 0.51 Allowed 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 119.911 1.232 . . . . 74.439999999999998 109.662 -178.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -111.26 -60.8 1.79 Allowed 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 118.316 -0.85 . . . . 42.130000000000003 110.907 -171.597 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.5 p -79.13 -53.62 13.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 C-N-CA 123.559 0.744 . . . . 64.430000000000007 110.536 176.483 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -56.62 -35.42 68.28 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-O 118.745 -0.645 . . . . 73.319999999999993 109.855 -175.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -48.05 -59.27 3.5 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.078 0.951 . . . . 64.319999999999993 111.578 174.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -72.44 -37.93 68.44 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 118.819 -0.61 . . . . 73.340000000000003 110.058 -175.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.58 -47.27 70.27 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 119.152 0.887 . . . . 73.140000000000001 110.544 -176.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.69 -16.76 63.92 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.473 1.109 . . . . 72.319999999999993 111.121 179.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -77.28 -47.42 20.13 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.013 0.824 . . . . 60.109999999999999 110.843 168.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.95 -24.08 67.71 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.473 1.109 . . . . 73.219999999999999 111.203 177.467 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 79.3 mt -117.17 31.43 6.75 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 126.345 1.858 . . . . 74.450000000000003 111.478 177.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -55.78 117.92 4.09 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 107.211 -1.403 . . . . 72.120000000000005 107.211 168.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 95.63 -10.54 68.76 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 126.317 1.913 . . . . 55.219999999999999 113.713 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.2 mtpp -126.7 1.52 6.78 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 119.696 1.748 . . . . 63.450000000000003 113.756 -165.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -151.0 174.31 13.29 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 119.043 0.838 . . . . 73.239999999999995 110.356 172.27 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -140.47 168.82 18.89 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 127.26 2.224 . . . . 52.420000000000002 105.798 174.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -57.98 -46.16 85.62 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.007 0.923 . . . . 61.109999999999999 111.64 -171.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -76.35 -16.47 59.74 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-O 119.485 -0.293 . . . . 73.420000000000002 110.903 -174.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 95.1 m -70.14 -56.81 5.91 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 107.947 -1.131 . . . . 74.549999999999997 107.947 165.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 47.8 mt -60.38 -55.96 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 C-N-CA 124.482 1.113 . . . . 74.340000000000003 109.938 -171.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.69 -28.08 63.47 Favored 'General case' 0 N--CA 1.456 -0.126 0 O-C-N 122.076 -0.39 . . . . 73.439999999999998 111.524 -175.01 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.62 -46.88 13.76 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.794 0.837 . . . . 74.420000000000002 110.285 -179.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.52 -40.52 75.18 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 122.939 0.495 . . . . 73.140000000000001 110.329 -165.292 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 9.5 mtt -61.26 -43.86 98.18 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 119.143 -0.456 . . . . 61.310000000000002 110.845 -179.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 49.8 t -65.41 -34.89 73.53 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 125.18 1.392 . . . . 71.230000000000004 110.656 -176.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 -55.82 -54.65 41.9 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 108.748 -0.834 . . . . 74.519999999999996 108.748 178.072 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 42.6 mt -71.89 -1.97 16.24 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 126.563 1.945 . . . . 62.119999999999997 112.601 -172.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 27.5 ttp180 -57.13 -52.15 66.46 Favored 'General case' 0 C--O 1.233 0.209 0 C-N-CA 123.912 0.885 . . . . 74.25 110.625 -175.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.85 -49.79 73.51 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.355 1.062 . . . . 71.530000000000001 110.028 177.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.8 m -52.63 -49.99 64.05 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 129.563 3.145 . . . . 61.439999999999998 109.927 -174.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.452 ' HB1' ' CD ' ' A' ' 28' ' ' ARG . . . -53.3 -34.88 59.15 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.577 0.751 . . . . 65.540000000000006 111.637 -179.025 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 9.1 mtm180 -79.01 -45.58 19.93 Favored 'General case' 0 C--O 1.233 0.233 0 O-C-N 121.107 -0.995 . . . . 72.150000000000006 109.032 -177.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -60.35 -39.24 86.46 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 125.0 1.32 . . . . 72.150000000000006 111.164 178.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -56.54 -42.49 78.61 Favored 'General case' 0 C--O 1.221 -0.43 0 C-N-CA 124.577 1.151 . . . . 64.239999999999995 112.715 -177.033 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.5 mm -58.62 -44.9 90.6 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-N 119.996 1.271 . . . . 74.109999999999999 108.979 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 86.9 mt -73.46 -9.72 13.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 124.809 1.244 . . . . 72.430000000000007 110.056 -179.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -109.38 16.77 22.1 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.918 1.687 . . . . 45.049999999999997 109.705 177.105 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -122.63 18.11 10.37 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.51 1.924 . . . . 72.450000000000003 108.491 177.03 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 61.8 mt . . . . . 0 C--O 1.251 1.16 0 CA-C-O 115.859 -2.02 . . . . 70.430000000000007 106.593 173.951 . . . . . . . . 0 0 . 1 stop_ save_