data_1zwg_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 1zwg _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.508 2.45 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 49.7 mm -122.81 -55.08 2.83 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.489 0 O-C-N 121.037 -1.039 . . . . 0.0 109.23 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -72.81 -49.72 28.7 Favored 'General case' 0 N--CA 1.506 2.361 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.6 mp -56.39 -47.88 78.04 Favored 'General case' 0 N--CA 1.507 2.379 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 14.6 mmt -61.55 -42.43 98.81 Favored 'General case' 0 N--CA 1.514 2.739 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 178.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 32.4 t60 -64.16 -34.55 78.33 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.838 -0.538 . . . . 0.0 110.146 178.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -61.0 -27.09 68.06 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.89 -0.506 . . . . 0.0 111.548 179.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -62.04 -53.83 50.01 Favored 'General case' 0 N--CA 1.511 2.622 0 CA-C-N 119.031 0.832 . . . . 0.0 109.492 179.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -71.86 -36.29 61.39 Favored Glycine 0 N--CA 1.505 3.256 0 N-CA-C 109.973 -1.251 . . . . 0.0 109.973 178.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.8 -21.38 66.04 Favored 'General case' 0 N--CA 1.507 2.406 0 CA-C-N 117.651 0.726 . . . . 0.0 110.568 178.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 83.7 t60 -81.22 -93.24 0.05 Allowed 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.492 -0.755 . . . . 0.0 109.225 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.517 ' HG ' ' HA ' ' A' ' 18' ' ' ARG . 0.4 OUTLIER 50.31 -155.11 0.12 Allowed 'General case' 0 N--CA 1.514 2.761 0 CA-C-N 119.198 0.908 . . . . 0.0 110.066 -179.261 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.487 ' HB3' ' CG ' ' A' ' 17' ' ' GLU . 10.3 t30 -164.52 79.17 0.37 Allowed 'General case' 0 N--CA 1.503 2.176 0 O-C-N 120.533 -1.354 . . . . 0.0 111.664 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.7 m 52.0 -78.12 0.01 OUTLIER 'General case' 0 N--CA 1.521 3.085 0 N-CA-C 115.271 1.582 . . . . 0.0 115.271 176.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' MET . . . . . 0.489 ' HA ' ' CG1' ' A' ' 19' ' ' VAL . 0.0 OUTLIER -76.65 -49.09 17.05 Favored 'General case' 0 N--CA 1.519 2.991 0 CA-C-N 119.129 0.877 . . . . 0.0 109.138 -178.497 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.521 ' O ' ' HB2' ' A' ' 21' ' ' TRP . 1.1 pm0 -62.09 -25.71 67.86 Favored 'General case' 0 N--CA 1.51 2.537 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 176.202 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.517 ' HA ' ' HG ' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -73.58 -50.49 20.98 Favored 'General case' 0 N--CA 1.501 2.084 0 CA-C-O 121.414 0.626 . . . . 0.0 109.374 177.535 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.489 ' CG1' ' HA ' ' A' ' 16' ' ' MET . 5.9 p -66.3 -48.53 80.72 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.629 0 O-C-N 121.67 -0.644 . . . . 0.0 112.291 -178.201 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.4 ' HG2' ' HA ' ' A' ' 17' ' ' GLU . 8.9 pt-20 -59.67 -27.18 66.17 Favored 'General case' 0 C--N 1.295 -1.763 0 CA-C-O 121.479 0.657 . . . . 0.0 109.292 176.406 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . 0.521 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 23.9 t90 -77.96 -44.87 25.51 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 178.472 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -64.62 -41.2 96.34 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 -179.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.32 -38.47 81.59 Favored 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 177.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.0 mttp -65.53 -34.83 79.17 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 121.864 -0.523 . . . . 0.0 109.885 178.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.46 ' HE3' ' CZ2' ' A' ' 21' ' ' TRP . 0.8 OUTLIER -61.11 -42.14 97.97 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 122.19 -0.319 . . . . 0.0 110.494 179.246 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.1 mp -71.6 -38.29 70.86 Favored 'General case' 0 N--CA 1.505 2.29 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.86 32.29 3.49 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.904 -0.498 . . . . 0.0 110.401 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.41 121.72 14.48 Favored 'General case' 0 N--CA 1.505 2.322 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.3 m 48.32 35.1 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.521 3.114 0 CA-C-O 121.69 0.757 . . . . 0.0 109.856 -176.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 8.9 m80 -133.61 62.16 1.66 Allowed 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -179.45 -52.17 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.441 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 -177.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 8.8 p90 . . . . . 0 N--CA 1.5 2.034 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.888 179.97 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 . . . . . 0 N--CA 1.505 2.324 0 CA-C-O 119.201 -0.428 . . . . 0.0 111.124 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 44.1 mt -51.12 -45.81 30.93 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.117 0 CA-C-N 119.111 0.869 . . . . 0.0 109.918 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -57.64 -46.48 84.11 Favored 'General case' 0 N--CA 1.517 2.891 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 178.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.09 -43.03 95.83 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 33.1 mmt -63.32 -38.59 91.74 Favored 'General case' 0 N--CA 1.511 2.621 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.3 m80 -60.36 -39.08 85.91 Favored 'General case' 0 N--CA 1.506 2.357 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 178.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -61.28 -43.61 98.6 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.826 -0.546 . . . . 0.0 109.571 178.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -59.39 131.56 51.34 Favored 'General case' 0 N--CA 1.503 2.223 0 CA-C-O 121.221 0.534 . . . . 0.0 109.931 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.504 ' HA2' HD23 ' A' ' 13' ' ' LEU . . . 101.46 -47.12 1.21 Allowed Glycine 0 N--CA 1.501 2.996 0 N-CA-C 109.929 -1.268 . . . . 0.0 109.929 -178.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.33 -43.74 10.14 Favored 'General case' 0 N--CA 1.509 2.476 0 CA-C-N 117.948 0.874 . . . . 0.0 109.272 179.203 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 54.5 t60 -63.98 -57.81 8.59 Favored 'General case' 0 N--CA 1.507 2.375 0 CA-C-O 121.118 0.485 . . . . 0.0 109.932 179.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.654 ' HG ' ' HG3' ' A' ' 18' ' ' ARG . 0.3 OUTLIER -61.81 153.36 28.91 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.079 -177.792 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -172.31 -41.1 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.321 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 15.2 p -139.25 -72.33 0.39 Allowed 'General case' 0 N--CA 1.51 2.559 0 CA-C-N 119.333 0.97 . . . . 0.0 109.737 -179.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -79.42 -20.77 46.73 Favored 'General case' 0 N--CA 1.514 2.746 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 177.692 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.572 ' HB2' ' HA ' ' A' ' 13' ' ' LEU . 1.1 pm0 -89.47 -35.26 16.08 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 176.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.654 ' HG3' ' HG ' ' A' ' 13' ' ' LEU . 7.6 mtt180 -67.18 -41.52 85.76 Favored 'General case' 0 N--CA 1.505 2.278 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 177.096 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.1 p -61.64 -47.36 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.709 0 O-C-N 121.314 -0.866 . . . . 0.0 111.645 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -67.17 -28.33 68.02 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 176.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . 0.445 ' HB3' ' O ' ' A' ' 18' ' ' ARG . 11.8 t90 -70.16 -37.41 75.2 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 176.317 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -71.35 -42.46 68.47 Favored 'General case' 0 N--CA 1.485 1.298 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 -177.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -67.87 -29.47 68.59 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 176.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.11 -8.92 47.45 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.526 -0.733 . . . . 0.0 110.774 178.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.68 -39.11 84.48 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.252 -0.905 . . . . 0.0 109.137 178.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.5 mp -71.71 -33.26 68.62 Favored 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 106.511 -1.663 . . . . 0.0 106.511 175.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.411 ' CB ' ' HB3' ' A' ' 30' ' ' HIS . 17.0 mt-30 -95.95 33.42 1.7 Allowed 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.441 178.488 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -73.45 110.14 7.51 Favored 'General case' 0 N--CA 1.503 2.193 0 N-CA-C 105.792 -1.929 . . . . 0.0 105.792 178.391 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.415 ' CG1' ' HA ' ' A' ' 32' ' ' PHE . 6.4 t 68.96 34.78 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.514 2.731 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 -173.688 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . 0.411 ' HB3' ' CB ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -44.11 92.55 0.01 OUTLIER 'General case' 0 N--CA 1.533 3.714 0 N-CA-C 106.287 -1.746 . . . . 0.0 106.287 175.275 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 21.4 m-80 76.66 -65.62 0.29 Allowed 'General case' 0 N--CA 1.521 3.119 0 N-CA-C 103.061 -2.94 . . . . 0.0 103.061 -171.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.415 ' HA ' ' CG1' ' A' ' 29' ' ' VAL . 80.7 t80 . . . . . 0 C--O 1.204 -1.328 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 174.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 . . . . . 0 N--CA 1.514 2.757 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 49.7 mt -73.42 -41.68 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 121.083 -1.01 . . . . 0.0 109.701 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -69.37 -44.74 70.94 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.768 -0.582 . . . . 0.0 109.475 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.55 -47.7 84.37 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 122.06 -0.4 . . . . 0.0 110.348 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' MET . . . . . 0.526 ' HA ' HD22 ' A' ' 9' ' ' LEU . 0.2 OUTLIER -67.82 -28.46 67.59 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.741 -0.6 . . . . 0.0 110.612 178.792 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 -75.43 -11.11 59.97 Favored 'General case' 0 N--CA 1.511 2.605 0 CA-C-N 118.835 0.743 . . . . 0.0 111.671 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.8 m-80 -98.95 17.38 19.75 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.198 -0.938 . . . . 0.0 111.023 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.526 HD22 ' HA ' ' A' ' 6' ' ' MET . 0.5 OUTLIER -80.51 80.64 6.92 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 120.945 -1.097 . . . . 0.0 111.143 -179.214 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 70.69 45.6 51.79 Favored Glycine 0 N--CA 1.515 3.917 0 N-CA-C 104.634 -3.387 . . . . 0.0 104.634 -174.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.06 31.66 21.52 Favored 'General case' 0 N--CA 1.508 2.447 0 N-CA-C 105.079 -2.193 . . . . 0.0 105.079 -171.538 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.461 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 47.6 t-80 27.0 63.98 0.08 Allowed 'General case' 0 N--CA 1.505 2.278 0 CA-C-O 124.007 1.861 . . . . 0.0 111.121 -175.636 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.579 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.0 OUTLIER -49.88 -22.94 1.66 Allowed 'General case' 0 CA--C 1.567 1.611 0 CA-C-N 111.921 -2.4 . . . . 0.0 114.396 -179.783 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.529 ' HB3' ' HB2' ' A' ' 17' ' ' GLU . 35.6 t30 130.31 161.86 0.0 OUTLIER 'General case' 1 N--CA 1.544 4.233 0 C-N-CA 125.1 1.36 . . . . 0.0 108.498 -178.992 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 8.0 t -59.8 -54.06 50.67 Favored 'General case' 0 N--CA 1.518 2.972 0 O-C-N 120.742 -1.224 . . . . 0.0 111.277 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' MET . . . . . 0.417 ' HA ' ' CG1' ' A' ' 19' ' ' VAL . 0.2 OUTLIER -76.18 -18.14 59.22 Favored 'General case' 0 N--CA 1.517 2.908 0 O-C-N 121.41 -0.807 . . . . 0.0 109.801 178.523 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.529 ' HB2' ' HB3' ' A' ' 14' ' ' ASN . 1.1 mm-40 -77.84 -36.44 50.03 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 176.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.489 ' CA ' HD22 ' A' ' 13' ' ' LEU . 0.4 OUTLIER -64.39 -48.28 76.05 Favored 'General case' 0 C--O 1.184 -2.366 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 179.695 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.417 ' CG1' ' HA ' ' A' ' 16' ' ' MET . 3.4 p -57.16 -46.93 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.278 0 O-C-N 121.846 -0.534 . . . . 0.0 111.733 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -71.81 -28.41 63.57 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 176.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . 0.472 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 14.6 t90 -68.67 -37.06 79.32 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 176.7 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -72.69 -42.66 64.0 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 -178.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -66.35 -27.35 67.81 Favored 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 177.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.5 mtpp -85.92 -35.11 20.71 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.382 -0.823 . . . . 0.0 110.122 179.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -54.73 -41.5 70.44 Favored 'General case' 0 N--CA 1.51 2.529 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -179.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.5 pp -60.82 -34.78 75.07 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 122.054 -0.404 . . . . 0.0 110.321 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.94 -26.14 25.69 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.746 -0.597 . . . . 0.0 110.061 178.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -62.51 -51.93 65.48 Favored 'General case' 0 N--CA 1.513 2.712 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 10.9 p -67.13 -23.08 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.323 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 177.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -97.13 50.03 1.07 Allowed 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 176.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -156.9 -49.28 0.07 Allowed 'General case' 0 N--CA 1.505 2.288 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -178.246 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.485 ' O ' ' CG ' ' A' ' 32' ' ' PHE . 1.1 p90 . . . . . 0 N--CA 1.499 1.981 0 CA-C-O 122.412 1.101 . . . . 0.0 110.028 -179.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.507 2.393 0 CA-C-O 121.423 0.63 . . . . 0.0 110.471 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.1 tp -128.82 -38.14 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.506 2.358 0 O-C-N 121.463 -0.773 . . . . 0.0 110.797 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -74.36 -44.26 53.04 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.281 -0.887 . . . . 0.0 109.673 179.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.3 mt -59.79 -53.2 60.78 Favored 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -62.77 -32.65 73.85 Favored 'General case' 0 N--CA 1.512 2.667 0 O-C-N 122.078 -0.389 . . . . 0.0 110.793 179.112 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -60.42 -37.9 82.32 Favored 'General case' 0 N--CA 1.509 2.502 0 O-C-N 121.527 -0.733 . . . . 0.0 110.039 178.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.613 ' HA ' ' CB ' ' A' ' 12' ' ' HIS . 30.2 m-80 -80.53 41.35 0.54 Allowed 'General case' 0 N--CA 1.508 2.464 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -178.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.465 ' O ' ' CD1' ' A' ' 13' ' ' LEU . 3.0 mm? -123.71 175.4 6.88 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 174.631 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.42 ' HA3' ' CD1' ' A' ' 21' ' ' TRP . . . 61.64 41.43 99.59 Favored Glycine 1 N--CA 1.521 4.329 1 N-CA-C 102.5 -4.24 . . . . 0.0 102.5 -171.066 . . . . . . . . 4 3 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.9 mtmp? 87.2 -61.65 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 104.699 -2.334 . . . . 0.0 104.699 -170.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.613 ' CB ' ' HA ' ' A' ' 8' ' ' ASN . 0.3 OUTLIER 153.83 -21.37 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.562 0 C-N-CA 126.426 1.891 . . . . 0.0 109.483 -178.107 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.64 ' HB2' ' HG3' ' A' ' 17' ' ' GLU . 0.0 OUTLIER 33.21 -154.57 0.0 OUTLIER 'General case' 0 N--CA 1.515 2.78 0 C-N-CA 125.791 1.636 . . . . 0.0 115.307 176.661 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -172.03 -47.8 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.463 0 O-C-N 120.995 -1.066 . . . . 0.0 113.074 -179.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.6 p -144.85 -78.91 0.19 Allowed 'General case' 0 N--CA 1.514 2.763 0 CA-C-N 119.794 1.179 . . . . 0.0 110.351 -179.047 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' MET . . . . . 0.503 ' HA ' HG13 ' A' ' 19' ' ' VAL . 2.1 mmt -68.29 -23.92 64.8 Favored 'General case' 0 N--CA 1.518 2.971 0 CA-C-N 119.044 0.838 . . . . 0.0 109.645 178.278 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.64 ' HG3' ' HB2' ' A' ' 13' ' ' LEU . 1.0 OUTLIER -89.59 -23.83 21.86 Favored 'General case' 0 N--CA 1.501 2.115 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 175.542 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.564 ' HG3' ' CD2' ' A' ' 13' ' ' LEU . 9.1 ttt85 -71.33 -46.3 60.95 Favored 'General case' 0 N--CA 1.51 2.547 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 176.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.503 HG13 ' HA ' ' A' ' 16' ' ' MET . 2.2 p -58.86 -47.38 89.62 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.553 0 O-C-N 121.475 -0.766 . . . . 0.0 110.999 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -67.89 -28.58 67.64 Favored 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 176.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . 0.535 ' HB3' ' O ' ' A' ' 18' ' ' ARG . 22.4 t90 -68.46 -38.71 81.34 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 107.853 -1.165 . . . . 0.0 107.853 176.102 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -70.34 -42.63 71.61 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 -177.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.94 -32.67 74.07 Favored 'General case' 0 N--CA 1.503 2.19 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 177.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -78.28 -30.22 48.33 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.689 -0.632 . . . . 0.0 110.224 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.6 mmmp? -53.13 -36.95 61.37 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.44 -0.787 . . . . 0.0 111.135 179.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 mp -67.53 -39.8 85.05 Favored 'General case' 0 N--CA 1.507 2.406 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 178.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 17.7 mm-40 -97.77 -79.16 0.47 Allowed 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 65.32 -71.62 0.08 Allowed 'General case' 0 N--CA 1.51 2.562 0 C-N-CA 123.576 0.751 . . . . 0.0 111.087 178.587 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.653 ' HA ' ' CZ ' ' A' ' 32' ' ' PHE . 4.3 p -66.78 -40.33 85.7 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.167 0 O-C-N 121.603 -0.685 . . . . 0.0 109.269 178.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -65.3 -28.61 69.44 Favored 'General case' 0 N--CA 1.504 2.263 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -61.64 -39.37 91.09 Favored 'General case' 0 N--CA 1.505 2.292 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 176.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.653 ' CZ ' ' HA ' ' A' ' 29' ' ' VAL . 30.3 p90 . . . . . 0 N--CA 1.501 2.091 0 O-C-N 121.729 -0.607 . . . . 0.0 110.335 177.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 . . . . . 0 N--CA 1.513 2.722 0 CA-C-O 121.259 0.552 . . . . 0.0 111.356 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.7 mp -68.35 -42.32 84.17 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.525 0 O-C-N 121.458 -0.776 . . . . 0.0 110.139 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.59 -50.25 73.37 Favored 'General case' 0 N--CA 1.511 2.62 0 O-C-N 121.725 -0.609 . . . . 0.0 111.713 -179.514 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.54 -42.93 81.92 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.552 -0.718 . . . . 0.0 111.018 -178.885 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 15.9 ptp -65.27 -25.82 67.82 Favored 'General case' 0 N--CA 1.512 2.645 0 CA-C-N 119.04 0.836 . . . . 0.0 110.003 178.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 51.8 t60 -77.12 -41.7 40.89 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 177.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -65.96 -46.91 76.41 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.985 -0.447 . . . . 0.0 110.234 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.438 ' HB3' ' NE ' ' A' ' 18' ' ' ARG . 17.7 mt -89.84 156.0 18.78 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.972 -0.455 . . . . 0.0 110.219 -179.214 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.55 -50.37 3.2 Favored Glycine 0 N--CA 1.513 3.78 0 N-CA-C 110.283 -1.127 . . . . 0.0 110.283 -179.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.4 ttpm? -57.31 -37.58 72.7 Favored 'General case' 0 N--CA 1.511 2.606 0 CA-C-N 119.179 1.49 . . . . 0.0 107.657 176.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -71.07 -42.28 69.62 Favored 'General case' 0 N--CA 1.497 1.925 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 177.031 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.525 ' CD1' ' HA ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -129.75 -90.8 0.47 Allowed 'General case' 0 N--CA 1.512 2.633 0 CA-C-O 118.51 -0.757 . . . . 0.0 109.906 178.42 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.649 ' HB3' ' CG ' ' A' ' 17' ' ' GLU . 7.9 t30 175.76 -86.62 0.0 OUTLIER 'General case' 0 N--CA 1.515 2.804 0 CA-C-N 120.016 1.28 . . . . 0.0 111.347 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -161.14 -60.57 0.05 Allowed 'General case' 0 N--CA 1.518 2.935 0 O-C-N 121.126 -0.983 . . . . 0.0 109.953 -178.11 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' MET . . . . . 0.578 ' HA ' HG13 ' A' ' 19' ' ' VAL . 13.3 tpp -70.71 -39.5 73.4 Favored 'General case' 0 N--CA 1.523 3.195 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 176.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.649 ' CG ' ' HB3' ' A' ' 14' ' ' ASN . 0.9 OUTLIER -62.01 -26.86 68.48 Favored 'General case' 0 N--CA 1.507 2.377 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 175.029 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.525 ' HA ' ' CD1' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -72.65 -48.26 40.83 Favored 'General case' 0 N--CA 1.511 2.581 0 CA-C-N 118.623 0.647 . . . . 0.0 109.914 178.296 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.578 HG13 ' HA ' ' A' ' 16' ' ' MET . 2.6 p -64.96 -41.95 93.47 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.32 0 O-C-N 121.416 -0.803 . . . . 0.0 110.054 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -69.96 -27.31 64.63 Favored 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 174.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . 0.511 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 28.8 t90 -70.97 -37.54 72.76 Favored 'General case' 0 N--CA 1.5 2.066 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 176.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -71.82 -43.78 65.04 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 119.768 -0.773 . . . . 0.0 109.258 -177.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -68.11 -38.62 82.47 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 177.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.434 ' HA ' ' HG2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -73.92 -23.18 59.5 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 121.786 -0.571 . . . . 0.0 110.705 179.753 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.39 -38.41 80.46 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.529 -0.732 . . . . 0.0 110.712 179.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.8 mp -70.22 -41.97 72.91 Favored 'General case' 0 N--CA 1.505 2.317 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 178.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.434 ' HG2' ' HA ' ' A' ' 24' ' ' LYS . 0.8 OUTLIER -102.73 44.35 1.02 Allowed 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.235 0.541 . . . . 0.0 109.702 178.699 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.07 -51.88 58.93 Favored 'General case' 0 N--CA 1.506 2.373 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.1 m -99.75 48.87 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.243 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 177.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 57.3 m80 -141.17 -52.69 0.46 Allowed 'General case' 0 N--CA 1.506 2.355 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -57.13 -32.5 66.41 Favored 'General case' 0 N--CA 1.511 2.592 0 C-N-CA 122.637 0.375 . . . . 0.0 110.681 177.488 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.424 ' CD1' ' C ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.159 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -179.062 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.51 2.557 0 CA-C-O 119.842 -0.123 . . . . 0.0 111.073 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.4 tt -66.47 -38.7 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 121.784 -0.572 . . . . 0.0 109.523 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.0 -41.75 77.37 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.573 -0.704 . . . . 0.0 109.119 178.159 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 11.9 mt -61.86 -50.88 70.48 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 122.084 -0.385 . . . . 0.0 110.271 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 15.0 ptt? -66.21 -27.36 67.92 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.84 -0.537 . . . . 0.0 111.079 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -77.95 -37.45 47.53 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.371 -0.831 . . . . 0.0 109.433 178.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -66.06 -47.69 73.47 Favored 'General case' 0 N--CA 1.51 2.55 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.569 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 21.1 mt -73.11 -41.84 63.58 Favored 'General case' 0 N--CA 1.507 2.411 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 178.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -67.69 -12.34 61.68 Favored Glycine 0 N--CA 1.504 3.17 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 177.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -57.91 -30.52 65.97 Favored 'General case' 0 N--CA 1.507 2.425 0 CA-C-N 119.592 1.696 . . . . 0.0 107.272 175.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.486 ' CD2' HD21 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -71.7 -46.62 58.17 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 108.069 -1.085 . . . . 0.0 108.069 176.774 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.544 HD22 ' HD2' ' A' ' 18' ' ' ARG . 2.0 pt? -132.9 -56.06 0.93 Allowed 'General case' 0 N--CA 1.514 2.75 0 CA-C-N 119.273 0.942 . . . . 0.0 111.953 178.281 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.474 ' N ' ' HG ' ' A' ' 13' ' ' LEU . 2.8 t30 176.34 160.95 0.34 Allowed 'General case' 0 N--CA 1.523 3.223 0 CA-C-N 119.829 1.195 . . . . 0.0 110.604 178.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 43.3 m -68.46 -52.69 29.75 Favored 'General case' 0 N--CA 1.514 2.731 0 O-C-N 121.345 -0.847 . . . . 0.0 111.163 -179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' MET . . . . . 0.466 ' HA ' HG13 ' A' ' 19' ' ' VAL . 4.9 ttp -92.05 -6.81 50.34 Favored 'General case' 0 N--CA 1.516 2.838 0 O-C-N 121.567 -0.708 . . . . 0.0 110.821 179.366 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.407 ' HG2' ' HB3' ' A' ' 14' ' ' ASN . 9.8 mm-40 -95.63 -28.53 14.78 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.152 -0.968 . . . . 0.0 108.67 178.029 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.569 ' HD3' ' HB3' ' A' ' 9' ' ' LEU . 0.5 OUTLIER -64.44 -52.35 58.5 Favored 'General case' 0 C--O 1.178 -2.705 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 177.232 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.466 HG13 ' HA ' ' A' ' 16' ' ' MET . 1.2 p -48.25 -50.45 11.34 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.616 0 C-N-CA 123.45 0.7 . . . . 0.0 111.983 178.464 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -65.58 -33.06 75.02 Favored 'General case' 0 C--N 1.296 -1.732 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 176.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . 0.466 ' HB2' HD13 ' A' ' 13' ' ' LEU . 5.0 t90 -69.16 -35.85 76.75 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.304 177.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 18' ' ' ARG . 4.9 mt -73.28 -43.21 61.41 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 -177.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -69.22 -28.55 66.46 Favored 'General case' 0 N--CA 1.5 2.03 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 177.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -90.96 -20.66 21.92 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.65 -0.657 . . . . 0.0 111.222 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.14 -35.72 77.84 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.724 -0.61 . . . . 0.0 111.388 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 mp -60.89 -31.79 71.27 Favored 'General case' 0 N--CA 1.506 2.358 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 177.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.77 -77.38 0.39 Allowed 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 46.14 34.34 2.07 Favored 'General case' 0 N--CA 1.525 3.277 0 CA-C-O 122.342 1.067 . . . . 0.0 109.685 -178.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.43 ' C ' ' ND1' ' A' ' 30' ' ' HIS . 0.9 OUTLIER -178.89 -47.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.473 0 N-CA-C 104.957 -2.238 . . . . 0.0 104.957 -176.676 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . 0.43 ' ND1' ' C ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER 44.05 45.28 6.64 Favored 'General case' 0 N--CA 1.521 3.109 0 CA-C-N 118.846 0.748 . . . . 0.0 109.781 175.668 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 78.01 24.15 0.71 Allowed 'General case' 0 N--CA 1.517 2.896 0 C-N-CA 123.476 0.711 . . . . 0.0 110.499 -178.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.0 p90 . . . . . 0 N--CA 1.51 2.529 0 O-C-N 121.384 -0.822 . . . . 0.0 109.544 178.457 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.507 2.403 0 CA-C-O 119.79 -0.148 . . . . 0.0 111.258 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.9 tt -63.84 -21.92 29.81 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.641 0 O-C-N 121.19 -0.944 . . . . 0.0 111.206 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -82.28 -55.0 4.79 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.282 -0.886 . . . . 0.0 108.988 178.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.3 pp -60.6 -34.67 74.56 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 122.055 -0.403 . . . . 0.0 110.457 179.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' MET . . . . . 0.439 ' HA ' HD21 ' A' ' 9' ' ' LEU . 21.5 mmt -62.99 -40.86 99.02 Favored 'General case' 0 N--CA 1.513 2.682 0 O-C-N 121.657 -0.652 . . . . 0.0 109.276 178.295 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -62.9 -33.71 75.88 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.849 -0.532 . . . . 0.0 110.002 178.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -64.24 -26.91 68.72 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.805 -0.559 . . . . 0.0 111.232 179.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.439 HD21 ' HA ' ' A' ' 6' ' ' MET . 2.0 mm? -61.5 -43.71 98.37 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.229 -0.92 . . . . 0.0 111.15 -179.436 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -72.2 -4.79 60.81 Favored Glycine 0 N--CA 1.513 3.776 0 C-N-CA 120.997 -0.62 . . . . 0.0 112.333 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.463 ' HG3' ' CH2' ' A' ' 21' ' ' TRP . 0.0 OUTLIER -117.3 -32.18 5.05 Favored 'General case' 0 N--CA 1.51 2.525 0 CA-C-N 119.232 1.516 . . . . 0.0 110.454 178.869 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.406 ' C ' ' CD2' ' A' ' 13' ' ' LEU . 10.6 m-70 -99.24 -23.96 15.01 Favored 'General case' 0 N--CA 1.512 2.657 0 O-C-N 121.467 -0.77 . . . . 0.0 110.918 -179.533 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.738 HD22 ' HA ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER 22.25 -100.8 0.01 OUTLIER 'General case' 0 N--CA 1.52 3.056 0 C-N-CA 125.246 1.418 . . . . 0.0 114.574 179.322 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.546 ' HB3' ' CG ' ' A' ' 17' ' ' GLU . 2.4 t30 -164.09 -80.07 0.03 OUTLIER 'General case' 0 N--CA 1.515 2.814 0 CA-C-N 121.393 1.906 . . . . 0.0 114.642 -176.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 54.7 m -146.04 -66.61 0.29 Allowed 'General case' 0 N--CA 1.525 3.322 0 CA-C-N 120.028 1.285 . . . . 0.0 110.149 -176.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' MET . . . . . 0.623 ' HA ' HG13 ' A' ' 19' ' ' VAL . 6.6 mtp -73.98 -37.49 64.46 Favored 'General case' 0 N--CA 1.52 3.05 0 N-CA-C 105.59 -2.004 . . . . 0.0 105.59 175.529 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.546 ' CG ' ' HB3' ' A' ' 14' ' ' ASN . 1.3 pm0 -70.64 -21.69 62.6 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 173.86 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.738 ' HA ' HD22 ' A' ' 13' ' ' LEU . 0.0 OUTLIER -81.67 -22.25 37.61 Favored 'General case' 0 N--CA 1.519 3.019 0 CA-C-N 118.76 0.709 . . . . 0.0 110.974 176.871 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.623 HG13 ' HA ' ' A' ' 16' ' ' MET . 6.1 p -88.03 -40.74 13.85 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.686 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 176.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -71.62 -20.99 61.9 Favored 'General case' 0 C--N 1.308 -1.231 0 N-CA-C 106.843 -1.539 . . . . 0.0 106.843 172.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . 0.602 ' HB3' ' C ' ' A' ' 18' ' ' ARG . 0.2 OUTLIER -61.0 -36.67 80.11 Favored 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 105.611 -1.996 . . . . 0.0 105.611 174.073 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.561 ' CD2' ' CD1' ' A' ' 21' ' ' TRP . 4.1 mm? -80.52 -30.78 37.21 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 118.032 -1.467 . . . . 0.0 109.779 179.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 36.9 mtt85 -61.51 -32.74 72.78 Favored 'General case' 0 N--CA 1.504 2.258 0 N-CA-C 107.451 -1.314 . . . . 0.0 107.451 174.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.79 -23.37 27.25 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 122.046 -0.409 . . . . 0.0 110.283 178.331 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.519 ' HG2' ' CZ3' ' A' ' 21' ' ' TRP . 0.1 OUTLIER -56.03 -47.46 77.8 Favored 'General case' 0 N--CA 1.513 2.708 0 CA-C-N 119.008 0.822 . . . . 0.0 109.218 179.032 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -69.89 -30.15 67.52 Favored 'General case' 0 N--CA 1.505 2.29 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 177.023 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -96.94 42.03 1.1 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.74 -0.6 . . . . 0.0 110.236 178.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.47 -58.88 1.83 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.175 -0.953 . . . . 0.0 108.772 178.472 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.0 t -118.54 -16.06 8.11 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.958 0 CA-C-O 117.389 -1.291 . . . . 0.0 112.28 179.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . 0.424 ' ND1' ' N ' ' A' ' 30' ' ' HIS . 6.5 p-80 -20.18 -51.51 0.01 OUTLIER 'General case' 1 N--CA 1.54 4.026 0 C-N-CA 124.721 1.209 . . . . 0.0 110.346 173.654 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.411 ' H ' ' CG ' ' A' ' 30' ' ' HIS . 0.1 OUTLIER -156.0 27.09 0.37 Allowed 'General case' 0 CA--C 1.579 2.095 0 C-N-CA 125.252 1.421 . . . . 0.0 107.47 174.179 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.537 3.907 0 C-N-CA 125.277 1.431 . . . . 0.0 112.578 178.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 . . . . . 0 N--CA 1.509 2.482 0 N-CA-C 110.352 -0.24 . . . . 0.0 110.352 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 41.6 mm -55.94 -41.17 66.47 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.774 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -67.86 -42.72 80.9 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.725 -0.609 . . . . 0.0 109.479 178.303 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.9 mt -57.36 -52.06 66.87 Favored 'General case' 0 N--CA 1.505 2.292 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 179.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 7.1 ptt? -68.02 -29.89 69.0 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.927 -0.483 . . . . 0.0 110.432 178.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 51.0 t60 -62.63 -29.9 70.96 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.683 -0.636 . . . . 0.0 110.81 179.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 26.3 m-80 -86.88 38.11 0.79 Allowed 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.379 -0.826 . . . . 0.0 111.496 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -130.38 -63.28 0.9 Allowed 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.074 -1.016 . . . . 0.0 108.61 178.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -74.79 -42.67 30.62 Favored Glycine 0 N--CA 1.506 3.348 0 N-CA-C 109.795 -1.322 . . . . 0.0 109.795 179.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -73.59 -32.39 64.09 Favored 'General case' 0 N--CA 1.507 2.382 0 CA-C-N 118.133 0.967 . . . . 0.0 108.836 177.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 58.9 t60 -63.46 -55.37 24.67 Favored 'General case' 0 N--CA 1.504 2.258 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 178.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.586 ' HG ' ' HG3' ' A' ' 18' ' ' ARG . 0.1 OUTLIER -82.09 153.92 25.84 Favored 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 -178.921 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 176.76 151.87 0.18 Allowed 'General case' 0 N--CA 1.512 2.635 0 O-C-N 121.782 -0.574 . . . . 0.0 110.648 -179.279 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 37.0 p 44.09 -83.83 0.01 OUTLIER 'General case' 0 N--CA 1.523 3.224 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 178.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' MET . . . . . 0.503 ' HA ' ' CG1' ' A' ' 19' ' ' VAL . 9.6 tpt -85.45 -33.76 21.81 Favored 'General case' 0 N--CA 1.513 2.685 0 CA-C-N 119.205 0.911 . . . . 0.0 109.979 -179.773 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.75 -31.48 57.13 Favored 'General case' 0 N--CA 1.506 2.35 0 N-CA-C 107.305 -1.369 . . . . 0.0 107.305 177.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.586 ' HG3' ' HG ' ' A' ' 13' ' ' LEU . 9.6 mtt-85 -74.57 -41.86 59.77 Favored 'General case' 0 N--CA 1.506 2.329 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 177.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.503 ' CG1' ' HA ' ' A' ' 16' ' ' MET . 9.1 p -66.02 -43.47 92.52 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.759 0 O-C-N 121.02 -1.05 . . . . 0.0 110.908 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -68.96 -25.46 64.56 Favored 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 176.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . 0.504 ' HB3' ' O ' ' A' ' 18' ' ' ARG . 21.4 t90 -70.2 -38.6 75.36 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 175.248 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -72.19 -41.41 67.01 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -178.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 21.1 ttp-105 -68.29 -32.71 73.06 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 177.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.36 -23.8 54.16 Favored 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.626 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.427 ' HE3' ' CH2' ' A' ' 21' ' ' TRP . 4.6 mmtp -60.1 -37.56 80.32 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.25 -0.906 . . . . 0.0 108.987 177.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.4 mp -80.5 -36.91 32.66 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 175.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.471 ' C ' ' CE1' ' A' ' 30' ' ' HIS . 1.4 mt-30 -91.81 59.61 3.72 Favored 'General case' 0 N--CA 1.488 1.446 0 CA-C-O 121.551 0.691 . . . . 0.0 110.004 178.411 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -108.47 -37.74 5.88 Favored 'General case' 0 N--CA 1.5 2.065 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.255 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.441 ' O ' ' C ' ' A' ' 30' ' ' HIS . 15.7 m -129.57 -40.39 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.517 2.908 0 CA-C-O 116.218 -1.849 . . . . 0.0 111.085 178.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . 0.471 ' CE1' ' C ' ' A' ' 27' ' ' GLN . 4.5 p-80 15.38 -102.12 0.0 OUTLIER 'General case' 1 N--CA 1.554 4.734 0 CA-C-N 121.081 1.764 . . . . 0.0 111.039 176.025 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -78.91 -49.48 12.78 Favored 'General case' 0 N--CA 1.502 2.169 0 N-CA-C 104.595 -2.372 . . . . 0.0 104.595 172.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 76.9 t80 . . . . . 0 N--CA 1.485 1.309 0 C-N-CA 126.028 1.731 . . . . 0.0 109.526 177.819 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.595 ' HB3' ' HB2' ' A' ' 5' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.873 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.7 tt -61.38 -36.87 75.81 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.538 0 O-C-N 122.097 -0.377 . . . . 0.0 111.091 -179.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -69.86 -40.23 75.88 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.527 -0.733 . . . . 0.0 109.547 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.595 ' HB2' ' HB3' ' A' ' 2' ' ' GLU . 0.3 OUTLIER -65.87 -51.38 59.24 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 122.084 -0.385 . . . . 0.0 110.284 -179.994 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 22.3 ptp -65.29 -29.81 70.6 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.77 -0.581 . . . . 0.0 110.616 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 76.1 t60 -74.32 -45.09 49.58 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.503 -0.748 . . . . 0.0 109.225 178.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 -60.53 -41.59 94.77 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.808 -0.557 . . . . 0.0 111.392 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 16.3 mt -88.34 -53.67 4.57 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.848 -0.533 . . . . 0.0 110.363 -178.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.512 ' HA2' HD21 ' A' ' 13' ' ' LEU . . . -57.96 -22.56 48.84 Favored Glycine 0 N--CA 1.514 3.887 0 CA-C-N 118.647 0.658 . . . . 0.0 111.817 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.8 ttpm? -63.69 -28.2 69.74 Favored 'General case' 0 N--CA 1.51 2.541 0 CA-C-N 119.079 1.44 . . . . 0.0 107.976 176.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 79.9 m-70 -100.69 -30.86 11.51 Favored 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 122.752 0.421 . . . . 0.0 111.076 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.554 ' HA ' ' HG3' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -139.5 -163.88 1.57 Allowed 'General case' 0 N--CA 1.517 2.921 0 O-C-N 121.248 -0.907 . . . . 0.0 111.746 -178.827 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 178.92 -46.12 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.796 0 O-C-N 120.823 -1.173 . . . . 0.0 112.846 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.3 m -135.74 -81.1 0.41 Allowed 'General case' 0 N--CA 1.51 2.528 0 CA-C-N 119.596 1.089 . . . . 0.0 109.723 -179.05 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' MET . . . . . 0.553 ' HA ' ' CG1' ' A' ' 19' ' ' VAL . 3.8 ttt -74.94 -36.8 62.12 Favored 'General case' 0 N--CA 1.516 2.831 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 177.482 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.554 ' HG3' ' HA ' ' A' ' 13' ' ' LEU . 2.2 pm0 -65.75 -32.61 74.25 Favored 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 176.262 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.533 ' O ' ' HB3' ' A' ' 21' ' ' TRP . 2.1 ttt-85 -74.37 -49.05 24.29 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.889 -0.507 . . . . 0.0 109.889 179.042 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.553 ' CG1' ' HA ' ' A' ' 16' ' ' MET . 3.7 p -59.12 -47.49 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.616 0 O-C-N 121.67 -0.644 . . . . 0.0 111.262 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -65.88 -27.58 68.32 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 175.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . 0.533 ' HB3' ' O ' ' A' ' 18' ' ' ARG . 13.1 t90 -67.32 -38.39 84.85 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 107.264 -1.384 . . . . 0.0 107.264 175.501 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 18' ' ' ARG . 6.0 mt -69.94 -41.9 73.94 Favored 'General case' 0 N--CA 1.494 1.747 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 -179.226 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 -62.65 -31.7 72.62 Favored 'General case' 0 N--CA 1.503 2.219 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.48 -31.86 53.96 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 179.122 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.2 mmtm -63.2 -35.99 82.14 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.677 -0.64 . . . . 0.0 110.084 179.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.6 mt -70.01 -35.68 74.53 Favored 'General case' 0 N--CA 1.504 2.275 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 175.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.581 ' HB3' ' CE1' ' A' ' 30' ' ' HIS . 43.7 mt-30 -82.0 -96.42 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 178.158 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 68.29 -59.54 0.44 Allowed 'General case' 0 N--CA 1.518 2.965 0 C-N-CA 123.911 0.884 . . . . 0.0 113.23 178.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.7 m -102.3 -33.35 3.36 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.618 0 CA-C-O 118.256 -0.878 . . . . 0.0 111.522 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . 0.581 ' CE1' ' HB3' ' A' ' 27' ' ' GLN . 7.6 p-80 -21.76 -51.11 0.02 OUTLIER 'General case' 0 N--CA 1.53 3.56 0 C-N-CA 124.717 1.207 . . . . 0.0 111.491 175.48 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 23.7 m-20 -143.47 12.06 1.72 Allowed 'General case' 0 CA--C 1.586 2.341 0 C-N-CA 124.378 1.071 . . . . 0.0 109.188 177.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 1 N--CA 1.541 4.096 0 CA-C-N 119.617 1.099 . . . . 0.0 112.374 178.27 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 . . . . . 0 N--CA 1.509 2.482 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.465 ' O ' ' HB2' ' A' ' 4' ' ' GLN . 2.1 mp -64.08 153.2 7.64 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.802 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 179.117 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.465 ' HB2' ' O ' ' A' ' 3' ' ' ILE . 3.1 mp0 77.76 -58.02 0.48 Allowed 'General case' 0 N--CA 1.524 3.234 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 -177.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.3 mp -60.7 -44.85 96.04 Favored 'General case' 0 N--CA 1.506 2.337 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 176.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.49 -32.35 68.14 Favored 'General case' 0 N--CA 1.502 2.151 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 177.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 58.4 m170 -56.67 -32.43 65.38 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 121.436 -0.79 . . . . 0.0 110.633 179.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.6 m-80 -93.44 -26.94 16.99 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.952 -0.467 . . . . 0.0 111.141 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 13.4 mt -109.65 -68.25 0.93 Allowed 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.323 -0.861 . . . . 0.0 111.397 -178.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -58.63 -49.47 76.86 Favored Glycine 0 N--CA 1.514 3.869 0 CA-C-N 118.592 0.633 . . . . 0.0 111.678 -178.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.4 ttmt -52.54 -45.87 66.52 Favored 'General case' 0 N--CA 1.514 2.759 0 CA-C-N 118.407 1.104 . . . . 0.0 109.742 179.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 77.0 t60 -67.37 -39.08 85.66 Favored 'General case' 0 N--CA 1.505 2.308 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 177.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.546 ' HB3' ' HD2' ' A' ' 18' ' ' ARG . 7.2 tp -69.01 153.82 43.14 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-O 122.048 0.928 . . . . 0.0 112.212 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.546 ' HB3' ' HG3' ' A' ' 17' ' ' GLU . 0.7 OUTLIER -86.7 166.25 15.45 Favored 'General case' 0 N--CA 1.509 2.503 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.336 179.612 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 47.4 m -55.73 -58.28 8.47 Favored 'General case' 0 N--CA 1.521 3.105 0 O-C-N 121.255 -0.903 . . . . 0.0 112.019 -179.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' MET . . . . . 0.558 ' HA ' HG11 ' A' ' 19' ' ' VAL . 2.1 ttt -72.85 -30.04 63.68 Favored 'General case' 0 N--CA 1.518 2.933 0 O-C-N 121.371 -0.83 . . . . 0.0 109.307 178.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.546 ' HG3' ' HB3' ' A' ' 14' ' ' ASN . 2.9 mm-40 -68.85 -25.82 64.84 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 177.088 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.546 ' HD2' ' HB3' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -77.87 -46.09 22.38 Favored 'General case' 0 C--O 1.186 -2.279 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.307 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.558 HG11 ' HA ' ' A' ' 16' ' ' MET . 7.0 p -62.31 -49.1 85.33 Favored 'Isoleucine or valine' 0 N--CA 1.519 2.985 0 O-C-N 121.446 -0.784 . . . . 0.0 112.335 -178.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.78 -25.99 67.81 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-O 121.552 0.691 . . . . 0.0 109.497 175.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . 0.509 ' HB3' ' O ' ' A' ' 18' ' ' ARG . 21.1 t90 -80.1 -41.83 24.79 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.459 179.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 18' ' ' ARG . 2.2 mt -65.88 -40.26 91.43 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 -177.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -66.47 -41.08 89.57 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 177.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.1 mtmm -65.6 -35.18 80.07 Favored 'General case' 0 N--CA 1.51 2.557 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 177.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.02 -41.38 86.73 Favored 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 178.524 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.8 mt -66.8 -31.75 72.57 Favored 'General case' 0 N--CA 1.505 2.288 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 177.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.5 ' HB3' ' ND1' ' A' ' 30' ' ' HIS . 19.2 mt-30 -69.64 -76.61 0.09 Allowed 'General case' 0 N--CA 1.487 1.39 0 CA-C-O 118.587 -0.72 . . . . 0.0 109.16 178.489 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.5 t70 42.45 85.05 0.02 OUTLIER 'General case' 0 N--CA 1.527 3.4 0 CA-C-N 119.002 0.819 . . . . 0.0 110.344 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.7 t 82.96 -51.86 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.525 3.303 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 -175.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . 0.5 ' ND1' ' HB3' ' A' ' 27' ' ' GLN . 20.8 p-80 28.68 82.36 0.02 OUTLIER 'General case' 0 N--CA 1.525 3.276 0 CA-C-N 119.039 0.836 . . . . 0.0 111.768 175.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 76.74 -52.13 0.58 Allowed 'General case' 0 N--CA 1.527 3.38 0 O-C-N 121.695 -0.628 . . . . 0.0 110.931 -178.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 2.3 t80 . . . . . 0 CA--C 1.541 0.609 0 CA-C-O 122.161 0.982 . . . . 0.0 111.594 -176.986 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SIN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.508 2.45 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 49.7 mm -122.81 -55.08 2.83 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.489 0 O-C-N 121.037 -1.039 . . . . 0.0 109.23 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -72.81 -49.72 28.7 Favored 'General case' 0 N--CA 1.506 2.361 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.6 mp -56.39 -47.88 78.04 Favored 'General case' 0 N--CA 1.507 2.379 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 14.6 mmt -61.55 -42.43 98.81 Favored 'General case' 0 N--CA 1.514 2.739 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 178.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 32.4 t60 -64.16 -34.55 78.33 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.838 -0.538 . . . . 0.0 110.146 178.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -61.0 -27.09 68.06 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.89 -0.506 . . . . 0.0 111.548 179.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -62.04 -53.83 50.01 Favored 'General case' 0 N--CA 1.511 2.622 0 CA-C-N 119.031 0.832 . . . . 0.0 109.492 179.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -71.86 -36.29 61.39 Favored Glycine 0 N--CA 1.505 3.256 0 N-CA-C 109.973 -1.251 . . . . 0.0 109.973 178.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.8 -21.38 66.04 Favored 'General case' 0 N--CA 1.507 2.406 0 CA-C-N 117.651 0.726 . . . . 0.0 110.568 178.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 83.7 t60 -81.22 -93.24 0.05 Allowed 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.492 -0.755 . . . . 0.0 109.225 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.517 ' HG ' ' HA ' ' A' ' 18' ' ' ARG . 0.4 OUTLIER 50.31 -155.11 0.12 Allowed 'General case' 0 N--CA 1.514 2.761 0 CA-C-N 119.198 0.908 . . . . 0.0 110.066 -179.261 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.487 ' HB3' ' CG ' ' A' ' 17' ' ' GLU . 10.3 t30 -164.52 79.17 0.37 Allowed 'General case' 0 N--CA 1.503 2.176 0 O-C-N 120.533 -1.354 . . . . 0.0 111.664 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.7 m 52.0 -78.12 0.01 OUTLIER 'General case' 0 N--CA 1.521 3.085 0 N-CA-C 115.271 1.582 . . . . 0.0 115.271 176.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' MET . . . . . 0.489 ' HA ' ' CG1' ' A' ' 19' ' ' VAL . 0.0 OUTLIER -76.65 -49.09 17.05 Favored 'General case' 0 N--CA 1.519 2.991 0 CA-C-N 119.129 0.877 . . . . 0.0 109.138 -178.497 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.521 ' O ' ' HB2' ' A' ' 21' ' ' TRP . 1.1 pm0 -62.09 -25.71 67.86 Favored 'General case' 0 N--CA 1.51 2.537 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 176.202 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.517 ' HA ' ' HG ' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -73.58 -50.49 20.98 Favored 'General case' 0 N--CA 1.501 2.084 0 CA-C-O 121.414 0.626 . . . . 0.0 109.374 177.535 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.489 ' CG1' ' HA ' ' A' ' 16' ' ' MET . 5.9 p -66.3 -48.53 80.72 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.629 0 O-C-N 121.67 -0.644 . . . . 0.0 112.291 -178.201 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.4 ' HG2' ' HA ' ' A' ' 17' ' ' GLU . 8.9 pt-20 -59.67 -27.18 66.17 Favored 'General case' 0 C--N 1.295 -1.763 0 CA-C-O 121.479 0.657 . . . . 0.0 109.292 176.406 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . 0.521 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 23.9 t90 -77.96 -44.87 25.51 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 178.472 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -64.62 -41.2 96.34 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 -179.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.32 -38.47 81.59 Favored 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 177.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.0 mttp -65.53 -34.83 79.17 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 121.864 -0.523 . . . . 0.0 109.885 178.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.46 ' HE3' ' CZ2' ' A' ' 21' ' ' TRP . 0.8 OUTLIER -61.11 -42.14 97.97 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 122.19 -0.319 . . . . 0.0 110.494 179.246 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.1 mp -71.6 -38.29 70.86 Favored 'General case' 0 N--CA 1.505 2.29 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.86 32.29 3.49 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.904 -0.498 . . . . 0.0 110.401 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.41 121.72 14.48 Favored 'General case' 0 N--CA 1.505 2.322 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.3 m 48.32 35.1 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.521 3.114 0 CA-C-O 121.69 0.757 . . . . 0.0 109.856 -176.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 8.9 m80 -133.61 62.16 1.66 Allowed 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -179.45 -52.17 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.441 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 -177.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 8.8 p90 -53.64 -41.66 66.98 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.888 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 1.4 t 171.84 90.46 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.515 2.818 0 N-CA-C 105.9 -1.889 . . . . 0.0 105.9 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -176.57 -71.49 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.429 -0.794 . . . . 0.0 109.845 -178.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.504 2.237 0 CA-C-O 117.776 -1.107 . . . . 0.0 110.008 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SIN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 . . . . . 0 N--CA 1.505 2.324 0 CA-C-O 119.201 -0.428 . . . . 0.0 111.124 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 44.1 mt -51.12 -45.81 30.93 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.117 0 CA-C-N 119.111 0.869 . . . . 0.0 109.918 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -57.64 -46.48 84.11 Favored 'General case' 0 N--CA 1.517 2.891 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 178.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.09 -43.03 95.83 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 33.1 mmt -63.32 -38.59 91.74 Favored 'General case' 0 N--CA 1.511 2.621 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.3 m80 -60.36 -39.08 85.91 Favored 'General case' 0 N--CA 1.506 2.357 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 178.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -61.28 -43.61 98.6 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.826 -0.546 . . . . 0.0 109.571 178.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -59.39 131.56 51.34 Favored 'General case' 0 N--CA 1.503 2.223 0 CA-C-O 121.221 0.534 . . . . 0.0 109.931 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.504 ' HA2' HD23 ' A' ' 13' ' ' LEU . . . 101.46 -47.12 1.21 Allowed Glycine 0 N--CA 1.501 2.996 0 N-CA-C 109.929 -1.268 . . . . 0.0 109.929 -178.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.33 -43.74 10.14 Favored 'General case' 0 N--CA 1.509 2.476 0 CA-C-N 117.948 0.874 . . . . 0.0 109.272 179.203 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 54.5 t60 -63.98 -57.81 8.59 Favored 'General case' 0 N--CA 1.507 2.375 0 CA-C-O 121.118 0.485 . . . . 0.0 109.932 179.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.654 ' HG ' ' HG3' ' A' ' 18' ' ' ARG . 0.3 OUTLIER -61.81 153.36 28.91 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.079 -177.792 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -172.31 -41.1 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.321 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 15.2 p -139.25 -72.33 0.39 Allowed 'General case' 0 N--CA 1.51 2.559 0 CA-C-N 119.333 0.97 . . . . 0.0 109.737 -179.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -79.42 -20.77 46.73 Favored 'General case' 0 N--CA 1.514 2.746 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 177.692 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.572 ' HB2' ' HA ' ' A' ' 13' ' ' LEU . 1.1 pm0 -89.47 -35.26 16.08 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 176.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.654 ' HG3' ' HG ' ' A' ' 13' ' ' LEU . 7.6 mtt180 -67.18 -41.52 85.76 Favored 'General case' 0 N--CA 1.505 2.278 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 177.096 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.1 p -61.64 -47.36 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.709 0 O-C-N 121.314 -0.866 . . . . 0.0 111.645 -179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -67.17 -28.33 68.02 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 176.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . 0.445 ' HB3' ' O ' ' A' ' 18' ' ' ARG . 11.8 t90 -70.16 -37.41 75.2 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 176.317 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -71.35 -42.46 68.47 Favored 'General case' 0 N--CA 1.485 1.298 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 -177.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -67.87 -29.47 68.59 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 176.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.11 -8.92 47.45 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.526 -0.733 . . . . 0.0 110.774 178.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.68 -39.11 84.48 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.252 -0.905 . . . . 0.0 109.137 178.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.5 mp -71.71 -33.26 68.62 Favored 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 106.511 -1.663 . . . . 0.0 106.511 175.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.411 ' CB ' ' HB3' ' A' ' 30' ' ' HIS . 17.0 mt-30 -95.95 33.42 1.7 Allowed 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.441 178.488 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -73.45 110.14 7.51 Favored 'General case' 0 N--CA 1.503 2.193 0 N-CA-C 105.792 -1.929 . . . . 0.0 105.792 178.391 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.415 ' CG1' ' HA ' ' A' ' 32' ' ' PHE . 6.4 t 68.96 34.78 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.514 2.731 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 -173.688 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . 0.42 ' CE1' HG22 ' A' ' 33' ' ' VAL . 0.0 OUTLIER -44.11 92.55 0.01 OUTLIER 'General case' 0 N--CA 1.533 3.714 0 N-CA-C 106.287 -1.746 . . . . 0.0 106.287 175.275 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 21.4 m-80 76.66 -65.62 0.29 Allowed 'General case' 0 N--CA 1.521 3.119 0 N-CA-C 103.061 -2.94 . . . . 0.0 103.061 -171.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.415 ' HA ' ' CG1' ' A' ' 29' ' ' VAL . 80.7 t80 -180.0 -94.77 0.0 OUTLIER 'General case' 0 C--O 1.204 -1.328 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 174.032 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.42 HG22 ' CE1' ' A' ' 30' ' ' HIS . 16.8 m 24.18 48.36 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.532 3.647 0 C-N-CA 124.968 1.307 . . . . 0.0 112.715 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -149.35 23.2 0.92 Allowed 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.556 -0.715 . . . . 0.0 112.129 -177.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.508 2.429 0 CA-C-O 117.633 -1.175 . . . . 0.0 110.195 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SIN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 . . . . . 0 N--CA 1.514 2.757 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 49.7 mt -73.42 -41.68 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 121.083 -1.01 . . . . 0.0 109.701 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -69.37 -44.74 70.94 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.768 -0.582 . . . . 0.0 109.475 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.55 -47.7 84.37 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 122.06 -0.4 . . . . 0.0 110.348 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.526 ' HA ' HD22 ' A' ' 9' ' ' LEU . 0.2 OUTLIER -67.82 -28.46 67.59 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.741 -0.6 . . . . 0.0 110.612 178.792 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 -75.43 -11.11 59.97 Favored 'General case' 0 N--CA 1.511 2.605 0 CA-C-N 118.835 0.743 . . . . 0.0 111.671 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.8 m-80 -98.95 17.38 19.75 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.198 -0.938 . . . . 0.0 111.023 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.526 HD22 ' HA ' ' A' ' 6' ' ' MET . 0.5 OUTLIER -80.51 80.64 6.92 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 120.945 -1.097 . . . . 0.0 111.143 -179.214 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 70.69 45.6 51.79 Favored Glycine 0 N--CA 1.515 3.917 0 N-CA-C 104.634 -3.387 . . . . 0.0 104.634 -174.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.06 31.66 21.52 Favored 'General case' 0 N--CA 1.508 2.447 0 N-CA-C 105.079 -2.193 . . . . 0.0 105.079 -171.538 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.461 ' HA ' ' O ' ' A' ' 9' ' ' LEU . 47.6 t-80 27.0 63.98 0.08 Allowed 'General case' 0 N--CA 1.505 2.278 0 CA-C-O 124.007 1.861 . . . . 0.0 111.121 -175.636 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.579 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.0 OUTLIER -49.88 -22.94 1.66 Allowed 'General case' 0 CA--C 1.567 1.611 0 CA-C-N 111.921 -2.4 . . . . 0.0 114.396 -179.783 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.529 ' HB3' ' HB2' ' A' ' 17' ' ' GLU . 35.6 t30 130.31 161.86 0.0 OUTLIER 'General case' 1 N--CA 1.544 4.233 0 C-N-CA 125.1 1.36 . . . . 0.0 108.498 -178.992 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 8.0 t -59.8 -54.06 50.67 Favored 'General case' 0 N--CA 1.518 2.972 0 O-C-N 120.742 -1.224 . . . . 0.0 111.277 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' MET . . . . . 0.417 ' HA ' ' CG1' ' A' ' 19' ' ' VAL . 0.2 OUTLIER -76.18 -18.14 59.22 Favored 'General case' 0 N--CA 1.517 2.908 0 O-C-N 121.41 -0.807 . . . . 0.0 109.801 178.523 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.529 ' HB2' ' HB3' ' A' ' 14' ' ' ASN . 1.1 mm-40 -77.84 -36.44 50.03 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 176.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.489 ' CA ' HD22 ' A' ' 13' ' ' LEU . 0.4 OUTLIER -64.39 -48.28 76.05 Favored 'General case' 0 C--O 1.184 -2.366 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 179.695 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.417 ' CG1' ' HA ' ' A' ' 16' ' ' MET . 3.4 p -57.16 -46.93 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.278 0 O-C-N 121.846 -0.534 . . . . 0.0 111.733 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -71.81 -28.41 63.57 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 176.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . 0.472 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 14.6 t90 -68.67 -37.06 79.32 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 176.7 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -72.69 -42.66 64.0 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 -178.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -66.35 -27.35 67.81 Favored 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 177.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.5 mtpp -85.92 -35.11 20.71 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.382 -0.823 . . . . 0.0 110.122 179.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -54.73 -41.5 70.44 Favored 'General case' 0 N--CA 1.51 2.529 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -179.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.5 pp -60.82 -34.78 75.07 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 122.054 -0.404 . . . . 0.0 110.321 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.94 -26.14 25.69 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.746 -0.597 . . . . 0.0 110.061 178.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -62.51 -51.93 65.48 Favored 'General case' 0 N--CA 1.513 2.712 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 10.9 p -67.13 -23.08 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.323 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 177.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -97.13 50.03 1.07 Allowed 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 176.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -156.9 -49.28 0.07 Allowed 'General case' 0 N--CA 1.505 2.288 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -178.246 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.485 ' O ' ' CG ' ' A' ' 32' ' ' PHE . 1.1 p90 -67.08 81.0 0.12 Allowed 'General case' 0 N--CA 1.499 1.981 0 CA-C-O 122.412 1.101 . . . . 0.0 110.028 -179.132 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 31.4 m 42.4 47.1 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.524 3.238 0 O-C-N 121.225 -0.922 . . . . 0.0 110.989 -178.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -86.3 87.86 7.51 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.492 0.663 . . . . 0.0 109.244 -179.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.5 mp . . . . . 0 N--CA 1.504 2.264 0 CA-C-O 118.712 -0.661 . . . . 0.0 109.867 -179.491 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SIN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.507 2.393 0 CA-C-O 121.423 0.63 . . . . 0.0 110.471 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.1 tp -128.82 -38.14 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.506 2.358 0 O-C-N 121.463 -0.773 . . . . 0.0 110.797 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -74.36 -44.26 53.04 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.281 -0.887 . . . . 0.0 109.673 179.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.3 mt -59.79 -53.2 60.78 Favored 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -62.77 -32.65 73.85 Favored 'General case' 0 N--CA 1.512 2.667 0 O-C-N 122.078 -0.389 . . . . 0.0 110.793 179.112 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -60.42 -37.9 82.32 Favored 'General case' 0 N--CA 1.509 2.502 0 O-C-N 121.527 -0.733 . . . . 0.0 110.039 178.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.613 ' HA ' ' CB ' ' A' ' 12' ' ' HIS . 30.2 m-80 -80.53 41.35 0.54 Allowed 'General case' 0 N--CA 1.508 2.464 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -178.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.465 ' O ' ' CD1' ' A' ' 13' ' ' LEU . 3.0 mm? -123.71 175.4 6.88 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 174.631 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.42 ' HA3' ' CD1' ' A' ' 21' ' ' TRP . . . 61.64 41.43 99.59 Favored Glycine 1 N--CA 1.521 4.329 1 N-CA-C 102.5 -4.24 . . . . 0.0 102.5 -171.066 . . . . . . . . 4 3 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.9 mtmp? 87.2 -61.65 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 104.699 -2.334 . . . . 0.0 104.699 -170.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.613 ' CB ' ' HA ' ' A' ' 8' ' ' ASN . 0.3 OUTLIER 153.83 -21.37 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.562 0 C-N-CA 126.426 1.891 . . . . 0.0 109.483 -178.107 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.64 ' HB2' ' HG3' ' A' ' 17' ' ' GLU . 0.0 OUTLIER 33.21 -154.57 0.0 OUTLIER 'General case' 0 N--CA 1.515 2.78 0 C-N-CA 125.791 1.636 . . . . 0.0 115.307 176.661 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -172.03 -47.8 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.463 0 O-C-N 120.995 -1.066 . . . . 0.0 113.074 -179.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.6 p -144.85 -78.91 0.19 Allowed 'General case' 0 N--CA 1.514 2.763 0 CA-C-N 119.794 1.179 . . . . 0.0 110.351 -179.047 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' MET . . . . . 0.503 ' HA ' HG13 ' A' ' 19' ' ' VAL . 2.1 mmt -68.29 -23.92 64.8 Favored 'General case' 0 N--CA 1.518 2.971 0 CA-C-N 119.044 0.838 . . . . 0.0 109.645 178.278 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.64 ' HG3' ' HB2' ' A' ' 13' ' ' LEU . 1.0 OUTLIER -89.59 -23.83 21.86 Favored 'General case' 0 N--CA 1.501 2.115 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 175.542 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.564 ' HG3' ' CD2' ' A' ' 13' ' ' LEU . 9.1 ttt85 -71.33 -46.3 60.95 Favored 'General case' 0 N--CA 1.51 2.547 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 176.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.503 HG13 ' HA ' ' A' ' 16' ' ' MET . 2.2 p -58.86 -47.38 89.62 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.553 0 O-C-N 121.475 -0.766 . . . . 0.0 110.999 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -67.89 -28.58 67.64 Favored 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 176.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . 0.535 ' HB3' ' O ' ' A' ' 18' ' ' ARG . 22.4 t90 -68.46 -38.71 81.34 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 107.853 -1.165 . . . . 0.0 107.853 176.102 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -70.34 -42.63 71.61 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 -177.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.94 -32.67 74.07 Favored 'General case' 0 N--CA 1.503 2.19 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 177.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -78.28 -30.22 48.33 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.689 -0.632 . . . . 0.0 110.224 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.6 mmmp? -53.13 -36.95 61.37 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.44 -0.787 . . . . 0.0 111.135 179.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 mp -67.53 -39.8 85.05 Favored 'General case' 0 N--CA 1.507 2.406 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 178.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 17.7 mm-40 -97.77 -79.16 0.47 Allowed 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 65.32 -71.62 0.08 Allowed 'General case' 0 N--CA 1.51 2.562 0 C-N-CA 123.576 0.751 . . . . 0.0 111.087 178.587 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.653 ' HA ' ' CZ ' ' A' ' 32' ' ' PHE . 4.3 p -66.78 -40.33 85.7 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.167 0 O-C-N 121.603 -0.685 . . . . 0.0 109.269 178.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -65.3 -28.61 69.44 Favored 'General case' 0 N--CA 1.504 2.263 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -61.64 -39.37 91.09 Favored 'General case' 0 N--CA 1.505 2.292 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 176.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.653 ' CZ ' ' HA ' ' A' ' 29' ' ' VAL . 30.3 p90 -99.33 38.17 1.45 Allowed 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.729 -0.607 . . . . 0.0 110.335 177.329 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 38.5 t 74.08 -63.6 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.516 2.833 0 C-N-CA 123.455 0.702 . . . . 0.0 110.382 179.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.404 ' HB1' ' O ' ' A' ' 29' ' ' VAL . . . 77.57 -62.51 0.38 Allowed 'General case' 0 N--CA 1.512 2.671 0 C-N-CA 123.133 0.573 . . . . 0.0 110.081 -179.275 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.502 2.144 0 CA-C-O 118.767 -0.635 . . . . 0.0 109.579 179.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SIN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 . . . . . 0 N--CA 1.513 2.722 0 CA-C-O 121.259 0.552 . . . . 0.0 111.356 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.7 mp -68.35 -42.32 84.17 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.525 0 O-C-N 121.458 -0.776 . . . . 0.0 110.139 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.59 -50.25 73.37 Favored 'General case' 0 N--CA 1.511 2.62 0 O-C-N 121.725 -0.609 . . . . 0.0 111.713 -179.514 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.54 -42.93 81.92 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.552 -0.718 . . . . 0.0 111.018 -178.885 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 15.9 ptp -65.27 -25.82 67.82 Favored 'General case' 0 N--CA 1.512 2.645 0 CA-C-N 119.04 0.836 . . . . 0.0 110.003 178.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 51.8 t60 -77.12 -41.7 40.89 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 177.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -65.96 -46.91 76.41 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.985 -0.447 . . . . 0.0 110.234 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.438 ' HB3' ' NE ' ' A' ' 18' ' ' ARG . 17.7 mt -89.84 156.0 18.78 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.972 -0.455 . . . . 0.0 110.219 -179.214 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.55 -50.37 3.2 Favored Glycine 0 N--CA 1.513 3.78 0 N-CA-C 110.283 -1.127 . . . . 0.0 110.283 -179.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.4 ttpm? -57.31 -37.58 72.7 Favored 'General case' 0 N--CA 1.511 2.606 0 CA-C-N 119.179 1.49 . . . . 0.0 107.657 176.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -71.07 -42.28 69.62 Favored 'General case' 0 N--CA 1.497 1.925 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 177.031 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.525 ' CD1' ' HA ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -129.75 -90.8 0.47 Allowed 'General case' 0 N--CA 1.512 2.633 0 CA-C-O 118.51 -0.757 . . . . 0.0 109.906 178.42 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.649 ' HB3' ' CG ' ' A' ' 17' ' ' GLU . 7.9 t30 175.76 -86.62 0.0 OUTLIER 'General case' 0 N--CA 1.515 2.804 0 CA-C-N 120.016 1.28 . . . . 0.0 111.347 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -161.14 -60.57 0.05 Allowed 'General case' 0 N--CA 1.518 2.935 0 O-C-N 121.126 -0.983 . . . . 0.0 109.953 -178.11 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' MET . . . . . 0.578 ' HA ' HG13 ' A' ' 19' ' ' VAL . 13.3 tpp -70.71 -39.5 73.4 Favored 'General case' 0 N--CA 1.523 3.195 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 176.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.649 ' CG ' ' HB3' ' A' ' 14' ' ' ASN . 0.9 OUTLIER -62.01 -26.86 68.48 Favored 'General case' 0 N--CA 1.507 2.377 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 175.029 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.525 ' HA ' ' CD1' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -72.65 -48.26 40.83 Favored 'General case' 0 N--CA 1.511 2.581 0 CA-C-N 118.623 0.647 . . . . 0.0 109.914 178.296 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.578 HG13 ' HA ' ' A' ' 16' ' ' MET . 2.6 p -64.96 -41.95 93.47 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.32 0 O-C-N 121.416 -0.803 . . . . 0.0 110.054 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -69.96 -27.31 64.63 Favored 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 174.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . 0.511 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 28.8 t90 -70.97 -37.54 72.76 Favored 'General case' 0 N--CA 1.5 2.066 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 176.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -71.82 -43.78 65.04 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 119.768 -0.773 . . . . 0.0 109.258 -177.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -68.11 -38.62 82.47 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 177.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.434 ' HA ' ' HG2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -73.92 -23.18 59.5 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 121.786 -0.571 . . . . 0.0 110.705 179.753 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.39 -38.41 80.46 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.529 -0.732 . . . . 0.0 110.712 179.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.8 mp -70.22 -41.97 72.91 Favored 'General case' 0 N--CA 1.505 2.317 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 178.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.434 ' HG2' ' HA ' ' A' ' 24' ' ' LYS . 0.8 OUTLIER -102.73 44.35 1.02 Allowed 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.235 0.541 . . . . 0.0 109.702 178.699 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.07 -51.88 58.93 Favored 'General case' 0 N--CA 1.506 2.373 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.1 m -99.75 48.87 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.243 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 177.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . 0.435 ' HA ' ' HB1' ' A' ' 34' ' ' ALA . 57.3 m80 -141.17 -52.69 0.46 Allowed 'General case' 0 N--CA 1.506 2.355 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -57.13 -32.5 66.41 Favored 'General case' 0 N--CA 1.511 2.592 0 C-N-CA 122.637 0.375 . . . . 0.0 110.681 177.488 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.424 ' CD1' ' C ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -80.19 21.79 0.57 Allowed 'General case' 0 N--CA 1.502 2.159 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -179.062 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 21.2 t 69.28 80.94 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.5 0 O-C-N 121.354 -0.841 . . . . 0.0 108.84 -179.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.435 ' HB1' ' HA ' ' A' ' 30' ' ' HIS . . . -91.83 -50.49 5.7 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.854 -0.529 . . . . 0.0 109.641 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.0 tp . . . . . 0 N--CA 1.501 2.107 0 CA-C-O 118.735 -0.65 . . . . 0.0 109.808 179.614 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SIN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.51 2.557 0 CA-C-O 119.842 -0.123 . . . . 0.0 111.073 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.4 tt -66.47 -38.7 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 121.784 -0.572 . . . . 0.0 109.523 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.0 -41.75 77.37 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.573 -0.704 . . . . 0.0 109.119 178.159 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 11.9 mt -61.86 -50.88 70.48 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 122.084 -0.385 . . . . 0.0 110.271 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 15.0 ptt? -66.21 -27.36 67.92 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.84 -0.537 . . . . 0.0 111.079 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -77.95 -37.45 47.53 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.371 -0.831 . . . . 0.0 109.433 178.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -66.06 -47.69 73.47 Favored 'General case' 0 N--CA 1.51 2.55 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.569 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 21.1 mt -73.11 -41.84 63.58 Favored 'General case' 0 N--CA 1.507 2.411 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 178.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -67.69 -12.34 61.68 Favored Glycine 0 N--CA 1.504 3.17 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 177.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -57.91 -30.52 65.97 Favored 'General case' 0 N--CA 1.507 2.425 0 CA-C-N 119.592 1.696 . . . . 0.0 107.272 175.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.486 ' CD2' HD21 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -71.7 -46.62 58.17 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 108.069 -1.085 . . . . 0.0 108.069 176.774 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.544 HD22 ' HD2' ' A' ' 18' ' ' ARG . 2.0 pt? -132.9 -56.06 0.93 Allowed 'General case' 0 N--CA 1.514 2.75 0 CA-C-N 119.273 0.942 . . . . 0.0 111.953 178.281 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.474 ' N ' ' HG ' ' A' ' 13' ' ' LEU . 2.8 t30 176.34 160.95 0.34 Allowed 'General case' 0 N--CA 1.523 3.223 0 CA-C-N 119.829 1.195 . . . . 0.0 110.604 178.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 43.3 m -68.46 -52.69 29.75 Favored 'General case' 0 N--CA 1.514 2.731 0 O-C-N 121.345 -0.847 . . . . 0.0 111.163 -179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' MET . . . . . 0.466 ' HA ' HG13 ' A' ' 19' ' ' VAL . 4.9 ttp -92.05 -6.81 50.34 Favored 'General case' 0 N--CA 1.516 2.838 0 O-C-N 121.567 -0.708 . . . . 0.0 110.821 179.366 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.407 ' HG2' ' HB3' ' A' ' 14' ' ' ASN . 9.8 mm-40 -95.63 -28.53 14.78 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.152 -0.968 . . . . 0.0 108.67 178.029 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.569 ' HD3' ' HB3' ' A' ' 9' ' ' LEU . 0.5 OUTLIER -64.44 -52.35 58.5 Favored 'General case' 0 C--O 1.178 -2.705 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 177.232 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.466 HG13 ' HA ' ' A' ' 16' ' ' MET . 1.2 p -48.25 -50.45 11.34 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.616 0 C-N-CA 123.45 0.7 . . . . 0.0 111.983 178.464 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -65.58 -33.06 75.02 Favored 'General case' 0 C--N 1.296 -1.732 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 176.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . 0.466 ' HB2' HD13 ' A' ' 13' ' ' LEU . 5.0 t90 -69.16 -35.85 76.75 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.304 177.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 18' ' ' ARG . 4.9 mt -73.28 -43.21 61.41 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 -177.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -69.22 -28.55 66.46 Favored 'General case' 0 N--CA 1.5 2.03 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 177.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -90.96 -20.66 21.92 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.65 -0.657 . . . . 0.0 111.222 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.14 -35.72 77.84 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.724 -0.61 . . . . 0.0 111.388 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 mp -60.89 -31.79 71.27 Favored 'General case' 0 N--CA 1.506 2.358 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 177.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.77 -77.38 0.39 Allowed 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 46.14 34.34 2.07 Favored 'General case' 0 N--CA 1.525 3.277 0 CA-C-O 122.342 1.067 . . . . 0.0 109.685 -178.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.43 ' C ' ' ND1' ' A' ' 30' ' ' HIS . 0.9 OUTLIER -178.89 -47.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.473 0 N-CA-C 104.957 -2.238 . . . . 0.0 104.957 -176.676 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . 0.43 ' ND1' ' C ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER 44.05 45.28 6.64 Favored 'General case' 0 N--CA 1.521 3.109 0 CA-C-N 118.846 0.748 . . . . 0.0 109.781 175.668 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 78.01 24.15 0.71 Allowed 'General case' 0 N--CA 1.517 2.896 0 C-N-CA 123.476 0.711 . . . . 0.0 110.499 -178.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.0 p90 -166.46 -142.06 0.05 OUTLIER 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.384 -0.822 . . . . 0.0 109.544 178.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 54.2 t -133.04 107.5 11.69 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.251 0 O-C-N 120.566 -1.334 . . . . 0.0 108.646 -179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.426 ' CB ' ' HE1' ' A' ' 30' ' ' HIS . . . -148.97 116.67 6.24 Favored 'General case' 0 N--CA 1.505 2.303 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.0 tp . . . . . 0 N--CA 1.508 2.47 0 CA-C-O 117.806 -1.093 . . . . 0.0 110.662 -179.84 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SIN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.507 2.403 0 CA-C-O 119.79 -0.148 . . . . 0.0 111.258 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.9 tt -63.84 -21.92 29.81 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.641 0 O-C-N 121.19 -0.944 . . . . 0.0 111.206 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -82.28 -55.0 4.79 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.282 -0.886 . . . . 0.0 108.988 178.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.3 pp -60.6 -34.67 74.56 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 122.055 -0.403 . . . . 0.0 110.457 179.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.439 ' HA ' HD21 ' A' ' 9' ' ' LEU . 21.5 mmt -62.99 -40.86 99.02 Favored 'General case' 0 N--CA 1.513 2.682 0 O-C-N 121.657 -0.652 . . . . 0.0 109.276 178.295 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -62.9 -33.71 75.88 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.849 -0.532 . . . . 0.0 110.002 178.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -64.24 -26.91 68.72 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.805 -0.559 . . . . 0.0 111.232 179.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.439 HD21 ' HA ' ' A' ' 6' ' ' MET . 2.0 mm? -61.5 -43.71 98.37 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.229 -0.92 . . . . 0.0 111.15 -179.436 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -72.2 -4.79 60.81 Favored Glycine 0 N--CA 1.513 3.776 0 C-N-CA 120.997 -0.62 . . . . 0.0 112.333 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.463 ' HG3' ' CH2' ' A' ' 21' ' ' TRP . 0.0 OUTLIER -117.3 -32.18 5.05 Favored 'General case' 0 N--CA 1.51 2.525 0 CA-C-N 119.232 1.516 . . . . 0.0 110.454 178.869 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.406 ' C ' ' CD2' ' A' ' 13' ' ' LEU . 10.6 m-70 -99.24 -23.96 15.01 Favored 'General case' 0 N--CA 1.512 2.657 0 O-C-N 121.467 -0.77 . . . . 0.0 110.918 -179.533 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.738 HD22 ' HA ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER 22.25 -100.8 0.01 OUTLIER 'General case' 0 N--CA 1.52 3.056 0 C-N-CA 125.246 1.418 . . . . 0.0 114.574 179.322 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.546 ' HB3' ' CG ' ' A' ' 17' ' ' GLU . 2.4 t30 -164.09 -80.07 0.03 OUTLIER 'General case' 0 N--CA 1.515 2.814 0 CA-C-N 121.393 1.906 . . . . 0.0 114.642 -176.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 54.7 m -146.04 -66.61 0.29 Allowed 'General case' 0 N--CA 1.525 3.322 0 CA-C-N 120.028 1.285 . . . . 0.0 110.149 -176.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' MET . . . . . 0.623 ' HA ' HG13 ' A' ' 19' ' ' VAL . 6.6 mtp -73.98 -37.49 64.46 Favored 'General case' 0 N--CA 1.52 3.05 0 N-CA-C 105.59 -2.004 . . . . 0.0 105.59 175.529 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.546 ' CG ' ' HB3' ' A' ' 14' ' ' ASN . 1.3 pm0 -70.64 -21.69 62.6 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 173.86 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.738 ' HA ' HD22 ' A' ' 13' ' ' LEU . 0.0 OUTLIER -81.67 -22.25 37.61 Favored 'General case' 0 N--CA 1.519 3.019 0 CA-C-N 118.76 0.709 . . . . 0.0 110.974 176.871 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.623 HG13 ' HA ' ' A' ' 16' ' ' MET . 6.1 p -88.03 -40.74 13.85 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.686 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 176.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -71.62 -20.99 61.9 Favored 'General case' 0 C--N 1.308 -1.231 0 N-CA-C 106.843 -1.539 . . . . 0.0 106.843 172.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . 0.602 ' HB3' ' C ' ' A' ' 18' ' ' ARG . 0.2 OUTLIER -61.0 -36.67 80.11 Favored 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 105.611 -1.996 . . . . 0.0 105.611 174.073 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.561 ' CD2' ' CD1' ' A' ' 21' ' ' TRP . 4.1 mm? -80.52 -30.78 37.21 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 118.032 -1.467 . . . . 0.0 109.779 179.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 36.9 mtt85 -61.51 -32.74 72.78 Favored 'General case' 0 N--CA 1.504 2.258 0 N-CA-C 107.451 -1.314 . . . . 0.0 107.451 174.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.79 -23.37 27.25 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 122.046 -0.409 . . . . 0.0 110.283 178.331 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.519 ' HG2' ' CZ3' ' A' ' 21' ' ' TRP . 0.1 OUTLIER -56.03 -47.46 77.8 Favored 'General case' 0 N--CA 1.513 2.708 0 CA-C-N 119.008 0.822 . . . . 0.0 109.218 179.032 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -69.89 -30.15 67.52 Favored 'General case' 0 N--CA 1.505 2.29 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 177.023 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -96.94 42.03 1.1 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.74 -0.6 . . . . 0.0 110.236 178.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.47 -58.88 1.83 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.175 -0.953 . . . . 0.0 108.772 178.472 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.0 t -118.54 -16.06 8.11 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.958 0 CA-C-O 117.389 -1.291 . . . . 0.0 112.28 179.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . 0.424 ' ND1' ' N ' ' A' ' 30' ' ' HIS . 6.5 p-80 -20.18 -51.51 0.01 OUTLIER 'General case' 1 N--CA 1.54 4.026 0 C-N-CA 124.721 1.209 . . . . 0.0 110.346 173.654 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.525 ' HB2' ' HB2' ' A' ' 34' ' ' ALA . 0.1 OUTLIER -156.0 27.09 0.37 Allowed 'General case' 0 CA--C 1.579 2.095 0 C-N-CA 125.252 1.421 . . . . 0.0 107.47 174.179 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 44.47 94.65 0.01 OUTLIER 'General case' 0 N--CA 1.537 3.907 0 C-N-CA 125.277 1.431 . . . . 0.0 112.578 178.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 17.4 m 37.41 52.64 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.526 3.343 0 CA-C-O 121.769 0.795 . . . . 0.0 110.6 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.525 ' HB2' ' HB2' ' A' ' 31' ' ' ASN . . . -128.3 -153.05 0.54 Allowed 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.888 -0.507 . . . . 0.0 109.7 -177.695 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.7 tt . . . . . 0 N--CA 1.503 2.198 0 O-C-N 121.41 -0.806 . . . . 0.0 109.78 -179.956 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SIN . . . . . 0.453 ' H21' ' HB2' ' A' ' 4' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 . . . . . 0 N--CA 1.509 2.482 0 N-CA-C 110.352 -0.24 . . . . 0.0 110.352 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 41.6 mm -55.94 -41.17 66.47 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.774 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.453 ' HB2' ' H21' ' A' ' 1' ' ' SIN . 1.4 mm-40 -67.86 -42.72 80.9 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.725 -0.609 . . . . 0.0 109.479 178.303 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.9 mt -57.36 -52.06 66.87 Favored 'General case' 0 N--CA 1.505 2.292 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 179.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 7.1 ptt? -68.02 -29.89 69.0 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.927 -0.483 . . . . 0.0 110.432 178.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 51.0 t60 -62.63 -29.9 70.96 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.683 -0.636 . . . . 0.0 110.81 179.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 26.3 m-80 -86.88 38.11 0.79 Allowed 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.379 -0.826 . . . . 0.0 111.496 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -130.38 -63.28 0.9 Allowed 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.074 -1.016 . . . . 0.0 108.61 178.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -74.79 -42.67 30.62 Favored Glycine 0 N--CA 1.506 3.348 0 N-CA-C 109.795 -1.322 . . . . 0.0 109.795 179.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -73.59 -32.39 64.09 Favored 'General case' 0 N--CA 1.507 2.382 0 CA-C-N 118.133 0.967 . . . . 0.0 108.836 177.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 58.9 t60 -63.46 -55.37 24.67 Favored 'General case' 0 N--CA 1.504 2.258 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 178.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.586 ' HG ' ' HG3' ' A' ' 18' ' ' ARG . 0.1 OUTLIER -82.09 153.92 25.84 Favored 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 -178.921 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 176.76 151.87 0.18 Allowed 'General case' 0 N--CA 1.512 2.635 0 O-C-N 121.782 -0.574 . . . . 0.0 110.648 -179.279 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 37.0 p 44.09 -83.83 0.01 OUTLIER 'General case' 0 N--CA 1.523 3.224 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 178.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' MET . . . . . 0.503 ' HA ' ' CG1' ' A' ' 19' ' ' VAL . 9.6 tpt -85.45 -33.76 21.81 Favored 'General case' 0 N--CA 1.513 2.685 0 CA-C-N 119.205 0.911 . . . . 0.0 109.979 -179.773 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.75 -31.48 57.13 Favored 'General case' 0 N--CA 1.506 2.35 0 N-CA-C 107.305 -1.369 . . . . 0.0 107.305 177.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.586 ' HG3' ' HG ' ' A' ' 13' ' ' LEU . 9.6 mtt-85 -74.57 -41.86 59.77 Favored 'General case' 0 N--CA 1.506 2.329 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 177.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.503 ' CG1' ' HA ' ' A' ' 16' ' ' MET . 9.1 p -66.02 -43.47 92.52 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.759 0 O-C-N 121.02 -1.05 . . . . 0.0 110.908 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -68.96 -25.46 64.56 Favored 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 176.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . 0.504 ' HB3' ' O ' ' A' ' 18' ' ' ARG . 21.4 t90 -70.2 -38.6 75.36 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 175.248 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -72.19 -41.41 67.01 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -178.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 21.1 ttp-105 -68.29 -32.71 73.06 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 177.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.36 -23.8 54.16 Favored 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.626 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.427 ' HE3' ' CH2' ' A' ' 21' ' ' TRP . 4.6 mmtp -60.1 -37.56 80.32 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.25 -0.906 . . . . 0.0 108.987 177.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.4 mp -80.5 -36.91 32.66 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 175.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.471 ' C ' ' CE1' ' A' ' 30' ' ' HIS . 1.4 mt-30 -91.81 59.61 3.72 Favored 'General case' 0 N--CA 1.488 1.446 0 CA-C-O 121.551 0.691 . . . . 0.0 110.004 178.411 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -108.47 -37.74 5.88 Favored 'General case' 0 N--CA 1.5 2.065 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.255 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.441 ' O ' ' C ' ' A' ' 30' ' ' HIS . 15.7 m -129.57 -40.39 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.517 2.908 0 CA-C-O 116.218 -1.849 . . . . 0.0 111.085 178.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . 0.471 ' CE1' ' C ' ' A' ' 27' ' ' GLN . 4.5 p-80 15.38 -102.12 0.0 OUTLIER 'General case' 1 N--CA 1.554 4.734 0 CA-C-N 121.081 1.764 . . . . 0.0 111.039 176.025 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -78.91 -49.48 12.78 Favored 'General case' 0 N--CA 1.502 2.169 0 N-CA-C 104.595 -2.372 . . . . 0.0 104.595 172.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 76.9 t80 146.42 -32.1 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 126.028 1.731 . . . . 0.0 109.526 177.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 7.2 p -55.85 89.12 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.524 3.251 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 179.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -137.34 111.53 8.45 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.112 -173.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.4 mm? . . . . . 0 N--CA 1.501 2.102 0 CA-C-O 118.747 -0.644 . . . . 0.0 109.342 179.262 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SIN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.595 ' HB3' ' HB2' ' A' ' 5' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.873 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.7 tt -61.38 -36.87 75.81 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.538 0 O-C-N 122.097 -0.377 . . . . 0.0 111.091 -179.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -69.86 -40.23 75.88 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.527 -0.733 . . . . 0.0 109.547 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.595 ' HB2' ' HB3' ' A' ' 2' ' ' GLU . 0.3 OUTLIER -65.87 -51.38 59.24 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 122.084 -0.385 . . . . 0.0 110.284 -179.994 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 22.3 ptp -65.29 -29.81 70.6 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.77 -0.581 . . . . 0.0 110.616 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 76.1 t60 -74.32 -45.09 49.58 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.503 -0.748 . . . . 0.0 109.225 178.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 -60.53 -41.59 94.77 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.808 -0.557 . . . . 0.0 111.392 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 16.3 mt -88.34 -53.67 4.57 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.848 -0.533 . . . . 0.0 110.363 -178.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.512 ' HA2' HD21 ' A' ' 13' ' ' LEU . . . -57.96 -22.56 48.84 Favored Glycine 0 N--CA 1.514 3.887 0 CA-C-N 118.647 0.658 . . . . 0.0 111.817 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.8 ttpm? -63.69 -28.2 69.74 Favored 'General case' 0 N--CA 1.51 2.541 0 CA-C-N 119.079 1.44 . . . . 0.0 107.976 176.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 79.9 m-70 -100.69 -30.86 11.51 Favored 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 122.752 0.421 . . . . 0.0 111.076 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.554 ' HA ' ' HG3' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -139.5 -163.88 1.57 Allowed 'General case' 0 N--CA 1.517 2.921 0 O-C-N 121.248 -0.907 . . . . 0.0 111.746 -178.827 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 178.92 -46.12 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.796 0 O-C-N 120.823 -1.173 . . . . 0.0 112.846 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 68.3 m -135.74 -81.1 0.41 Allowed 'General case' 0 N--CA 1.51 2.528 0 CA-C-N 119.596 1.089 . . . . 0.0 109.723 -179.05 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' MET . . . . . 0.553 ' HA ' ' CG1' ' A' ' 19' ' ' VAL . 3.8 ttt -74.94 -36.8 62.12 Favored 'General case' 0 N--CA 1.516 2.831 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 177.482 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.554 ' HG3' ' HA ' ' A' ' 13' ' ' LEU . 2.2 pm0 -65.75 -32.61 74.25 Favored 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 176.262 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.533 ' O ' ' HB3' ' A' ' 21' ' ' TRP . 2.1 ttt-85 -74.37 -49.05 24.29 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.889 -0.507 . . . . 0.0 109.889 179.042 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.553 ' CG1' ' HA ' ' A' ' 16' ' ' MET . 3.7 p -59.12 -47.49 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.616 0 O-C-N 121.67 -0.644 . . . . 0.0 111.262 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -65.88 -27.58 68.32 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 175.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . 0.533 ' HB3' ' O ' ' A' ' 18' ' ' ARG . 13.1 t90 -67.32 -38.39 84.85 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 107.264 -1.384 . . . . 0.0 107.264 175.501 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 18' ' ' ARG . 6.0 mt -69.94 -41.9 73.94 Favored 'General case' 0 N--CA 1.494 1.747 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 -179.226 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 -62.65 -31.7 72.62 Favored 'General case' 0 N--CA 1.503 2.219 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.48 -31.86 53.96 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 179.122 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.2 mmtm -63.2 -35.99 82.14 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.677 -0.64 . . . . 0.0 110.084 179.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.6 mt -70.01 -35.68 74.53 Favored 'General case' 0 N--CA 1.504 2.275 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 175.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.581 ' HB3' ' CE1' ' A' ' 30' ' ' HIS . 43.7 mt-30 -82.0 -96.42 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 178.158 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 68.29 -59.54 0.44 Allowed 'General case' 0 N--CA 1.518 2.965 0 C-N-CA 123.911 0.884 . . . . 0.0 113.23 178.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.7 m -102.3 -33.35 3.36 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.618 0 CA-C-O 118.256 -0.878 . . . . 0.0 111.522 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . 0.581 ' CE1' ' HB3' ' A' ' 27' ' ' GLN . 7.6 p-80 -21.76 -51.11 0.02 OUTLIER 'General case' 0 N--CA 1.53 3.56 0 C-N-CA 124.717 1.207 . . . . 0.0 111.491 175.48 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.593 ' HB2' ' HB1' ' A' ' 34' ' ' ALA . 23.7 m-20 -143.47 12.06 1.72 Allowed 'General case' 0 CA--C 1.586 2.341 0 C-N-CA 124.378 1.071 . . . . 0.0 109.188 177.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 47.31 86.65 0.02 OUTLIER 'General case' 1 N--CA 1.541 4.096 0 CA-C-N 119.617 1.099 . . . . 0.0 112.374 178.27 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 10.4 t 49.18 55.7 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.521 3.102 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 179.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.593 ' HB1' ' HB2' ' A' ' 31' ' ' ASN . . . -126.45 -62.99 1.12 Allowed 'General case' 0 N--CA 1.493 1.711 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.299 -176.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.503 2.191 0 CA-C-O 118.547 -0.74 . . . . 0.0 109.794 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SIN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 . . . . . 0 N--CA 1.509 2.482 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.465 ' O ' ' HB2' ' A' ' 4' ' ' GLN . 2.1 mp -64.08 153.2 7.64 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.802 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 179.117 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.465 ' HB2' ' O ' ' A' ' 3' ' ' ILE . 3.1 mp0 77.76 -58.02 0.48 Allowed 'General case' 0 N--CA 1.524 3.234 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 -177.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.3 mp -60.7 -44.85 96.04 Favored 'General case' 0 N--CA 1.506 2.337 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 176.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.49 -32.35 68.14 Favored 'General case' 0 N--CA 1.502 2.151 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 177.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 58.4 m170 -56.67 -32.43 65.38 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 121.436 -0.79 . . . . 0.0 110.633 179.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.6 m-80 -93.44 -26.94 16.99 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.952 -0.467 . . . . 0.0 111.141 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 13.4 mt -109.65 -68.25 0.93 Allowed 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.323 -0.861 . . . . 0.0 111.397 -178.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -58.63 -49.47 76.86 Favored Glycine 0 N--CA 1.514 3.869 0 CA-C-N 118.592 0.633 . . . . 0.0 111.678 -178.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.4 ttmt -52.54 -45.87 66.52 Favored 'General case' 0 N--CA 1.514 2.759 0 CA-C-N 118.407 1.104 . . . . 0.0 109.742 179.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 77.0 t60 -67.37 -39.08 85.66 Favored 'General case' 0 N--CA 1.505 2.308 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 177.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.546 ' HB3' ' HD2' ' A' ' 18' ' ' ARG . 7.2 tp -69.01 153.82 43.14 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-O 122.048 0.928 . . . . 0.0 112.212 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.546 ' HB3' ' HG3' ' A' ' 17' ' ' GLU . 0.7 OUTLIER -86.7 166.25 15.45 Favored 'General case' 0 N--CA 1.509 2.503 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.336 179.612 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 47.4 m -55.73 -58.28 8.47 Favored 'General case' 0 N--CA 1.521 3.105 0 O-C-N 121.255 -0.903 . . . . 0.0 112.019 -179.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' MET . . . . . 0.558 ' HA ' HG11 ' A' ' 19' ' ' VAL . 2.1 ttt -72.85 -30.04 63.68 Favored 'General case' 0 N--CA 1.518 2.933 0 O-C-N 121.371 -0.83 . . . . 0.0 109.307 178.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.546 ' HG3' ' HB3' ' A' ' 14' ' ' ASN . 2.9 mm-40 -68.85 -25.82 64.84 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 177.088 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.546 ' HD2' ' HB3' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -77.87 -46.09 22.38 Favored 'General case' 0 C--O 1.186 -2.279 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.307 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.558 HG11 ' HA ' ' A' ' 16' ' ' MET . 7.0 p -62.31 -49.1 85.33 Favored 'Isoleucine or valine' 0 N--CA 1.519 2.985 0 O-C-N 121.446 -0.784 . . . . 0.0 112.335 -178.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.78 -25.99 67.81 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-O 121.552 0.691 . . . . 0.0 109.497 175.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . 0.509 ' HB3' ' O ' ' A' ' 18' ' ' ARG . 21.1 t90 -80.1 -41.83 24.79 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.459 179.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 18' ' ' ARG . 2.2 mt -65.88 -40.26 91.43 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 -177.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -66.47 -41.08 89.57 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 177.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.1 mtmm -65.6 -35.18 80.07 Favored 'General case' 0 N--CA 1.51 2.557 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 177.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.02 -41.38 86.73 Favored 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 178.524 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.8 mt -66.8 -31.75 72.57 Favored 'General case' 0 N--CA 1.505 2.288 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 177.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.5 ' HB3' ' ND1' ' A' ' 30' ' ' HIS . 19.2 mt-30 -69.64 -76.61 0.09 Allowed 'General case' 0 N--CA 1.487 1.39 0 CA-C-O 118.587 -0.72 . . . . 0.0 109.16 178.489 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.5 t70 42.45 85.05 0.02 OUTLIER 'General case' 0 N--CA 1.527 3.4 0 CA-C-N 119.002 0.819 . . . . 0.0 110.344 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.7 t 82.96 -51.86 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.525 3.303 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 -175.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . 0.5 ' ND1' ' HB3' ' A' ' 27' ' ' GLN . 20.8 p-80 28.68 82.36 0.02 OUTLIER 'General case' 0 N--CA 1.525 3.276 0 CA-C-N 119.039 0.836 . . . . 0.0 111.768 175.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 76.74 -52.13 0.58 Allowed 'General case' 0 N--CA 1.527 3.38 0 O-C-N 121.695 -0.628 . . . . 0.0 110.931 -178.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 2.3 t80 68.52 50.09 0.72 Allowed 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 122.161 0.982 . . . . 0.0 111.594 -176.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 15.5 m -111.83 43.44 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.031 0 N-CA-C 105.622 -1.992 . . . . 0.0 105.622 175.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -111.21 -60.04 1.89 Allowed 'General case' 0 N--CA 1.492 1.635 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.94 -177.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.504 2.239 0 CA-C-O 117.729 -1.129 . . . . 0.0 109.961 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.508 2.45 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 49.7 mm -122.81 -55.08 2.83 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.489 0 O-C-N 121.037 -1.039 . . . . 0.0 109.23 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -72.81 -49.72 28.7 Favored 'General case' 0 N--CA 1.506 2.361 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.6 mp -56.39 -47.88 78.04 Favored 'General case' 0 N--CA 1.507 2.379 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' MET . . . . . 0.402 ' HA ' HD23 ' A' ' 9' ' ' LEU . 14.6 mmt -61.55 -42.43 98.81 Favored 'General case' 0 N--CA 1.514 2.739 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 32.4 t60 -64.16 -34.55 78.33 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.838 -0.538 . . . . 0.0 110.146 178.609 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -61.0 -27.09 68.06 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.89 -0.506 . . . . 0.0 111.548 179.493 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.476 HD13 ' HA ' ' A' ' 9' ' ' LEU . 2.7 mm? -62.04 -53.83 50.01 Favored 'General case' 0 N--CA 1.511 2.622 0 CA-C-N 119.031 0.832 . . . . 0.0 109.492 179.755 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -71.86 -36.29 61.39 Favored Glycine 0 N--CA 1.505 3.256 0 N-CA-C 109.973 -1.251 . . . . 0.0 109.973 178.638 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.8 -21.38 66.04 Favored 'General case' 0 N--CA 1.507 2.406 0 CA-C-N 117.651 0.726 . . . . 0.0 110.568 178.72 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 83.7 t60 -81.22 -93.24 0.05 Allowed 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.492 -0.755 . . . . 0.0 109.225 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.546 ' HG ' ' HA ' ' A' ' 18' ' ' ARG . 0.4 OUTLIER 50.31 -155.11 0.12 Allowed 'General case' 0 N--CA 1.514 2.761 0 CA-C-N 119.198 0.908 . . . . 0.0 110.066 -179.261 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.49 ' HB3' ' CG ' ' A' ' 17' ' ' GLU . 10.3 t30 -164.52 79.17 0.37 Allowed 'General case' 0 N--CA 1.503 2.176 0 O-C-N 120.533 -1.354 . . . . 0.0 111.664 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.509 ' O ' HG12 ' A' ' 19' ' ' VAL . 70.7 m 52.0 -78.12 0.01 OUTLIER 'General case' 0 N--CA 1.521 3.085 0 N-CA-C 115.271 1.582 . . . . 0.0 115.271 176.552 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.534 ' HA ' HG12 ' A' ' 19' ' ' VAL . 0.0 OUTLIER -76.65 -49.09 17.05 Favored 'General case' 0 N--CA 1.519 2.991 0 CA-C-N 119.129 0.877 . . . . 0.0 109.138 -178.497 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.566 ' O ' ' HB2' ' A' ' 21' ' ' TRP . 1.1 pm0 -62.09 -25.71 67.86 Favored 'General case' 0 N--CA 1.51 2.537 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 176.202 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.546 ' HA ' ' HG ' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -73.58 -50.49 20.98 Favored 'General case' 0 N--CA 1.501 2.084 0 CA-C-O 121.414 0.626 . . . . 0.0 109.374 177.535 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.534 HG12 ' HA ' ' A' ' 16' ' ' MET . 5.9 p -66.3 -48.53 80.72 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.629 0 O-C-N 121.67 -0.644 . . . . 0.0 112.291 -178.201 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -59.67 -27.18 66.17 Favored 'General case' 0 C--N 1.295 -1.763 0 CA-C-O 121.479 0.657 . . . . 0.0 109.292 176.406 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' TRP . . . . . 0.566 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 23.9 t90 -77.96 -44.87 25.51 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 178.472 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.507 HD13 ' HA ' ' A' ' 22' ' ' LEU . 1.7 mm? -64.62 -41.2 96.34 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 -179.106 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.32 -38.47 81.59 Favored 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 177.526 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.0 mttp -65.53 -34.83 79.17 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 121.864 -0.523 . . . . 0.0 109.885 178.528 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.487 ' HE3' ' CZ2' ' A' ' 21' ' ' TRP . 0.8 OUTLIER -61.11 -42.14 97.97 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 122.19 -0.319 . . . . 0.0 110.494 179.246 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.1 mp -71.6 -38.29 70.86 Favored 'General case' 0 N--CA 1.505 2.29 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.056 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.86 32.29 3.49 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.904 -0.498 . . . . 0.0 110.401 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.41 121.72 14.48 Favored 'General case' 0 N--CA 1.505 2.322 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.3 m 48.32 35.1 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.521 3.114 0 CA-C-O 121.69 0.757 . . . . 0.0 109.856 -176.272 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 8.9 m80 -133.61 62.16 1.66 Allowed 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -179.45 -52.17 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.441 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 -177.7 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 8.8 p90 . . . . . 0 N--CA 1.5 2.034 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.888 179.97 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 . . . . . 0 N--CA 1.505 2.324 0 CA-C-O 119.201 -0.428 . . . . 0.0 111.124 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 44.1 mt -51.12 -45.81 30.93 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.117 0 CA-C-N 119.111 0.869 . . . . 0.0 109.918 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.43 ' HG3' HD12 ' A' ' 5' ' ' LEU . 2.3 pt20 -57.64 -46.48 84.11 Favored 'General case' 0 N--CA 1.517 2.891 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 178.546 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.43 HD12 ' HG3' ' A' ' 4' ' ' GLN . 0.6 OUTLIER -60.09 -43.03 95.83 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.208 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 33.1 mmt -63.32 -38.59 91.74 Favored 'General case' 0 N--CA 1.511 2.621 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.208 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.3 m80 -60.36 -39.08 85.91 Favored 'General case' 0 N--CA 1.506 2.357 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 178.364 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -61.28 -43.61 98.6 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.826 -0.546 . . . . 0.0 109.571 178.224 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.424 ' HA ' HD13 ' A' ' 9' ' ' LEU . 2.7 mm? -59.39 131.56 51.34 Favored 'General case' 0 N--CA 1.503 2.223 0 CA-C-O 121.221 0.534 . . . . 0.0 109.931 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.605 ' H ' HD22 ' A' ' 13' ' ' LEU . . . 101.46 -47.12 1.21 Allowed Glycine 0 N--CA 1.501 2.996 0 N-CA-C 109.929 -1.268 . . . . 0.0 109.929 -178.987 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.33 -43.74 10.14 Favored 'General case' 0 N--CA 1.509 2.476 0 CA-C-N 117.948 0.874 . . . . 0.0 109.272 179.203 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 54.5 t60 -63.98 -57.81 8.59 Favored 'General case' 0 N--CA 1.507 2.375 0 CA-C-O 121.118 0.485 . . . . 0.0 109.932 179.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.703 ' HG ' ' HG3' ' A' ' 18' ' ' ARG . 0.3 OUTLIER -61.81 153.36 28.91 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.079 -177.792 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -172.31 -41.1 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.321 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 15.2 p -139.25 -72.33 0.39 Allowed 'General case' 0 N--CA 1.51 2.559 0 CA-C-N 119.333 0.97 . . . . 0.0 109.737 -179.241 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -79.42 -20.77 46.73 Favored 'General case' 0 N--CA 1.514 2.746 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 177.692 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.583 ' CG ' ' HA ' ' A' ' 13' ' ' LEU . 1.1 pm0 -89.47 -35.26 16.08 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 176.898 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.703 ' HG3' ' HG ' ' A' ' 13' ' ' LEU . 7.6 mtt180 -67.18 -41.52 85.76 Favored 'General case' 0 N--CA 1.505 2.278 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 177.096 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.408 HG13 ' N ' ' A' ' 20' ' ' GLU . 7.1 p -61.64 -47.36 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.709 0 O-C-N 121.314 -0.866 . . . . 0.0 111.645 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.408 ' N ' HG13 ' A' ' 19' ' ' VAL . 4.8 mt-10 -67.17 -28.33 68.02 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 176.272 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' TRP . . . . . 0.469 ' HB3' ' O ' ' A' ' 18' ' ' ARG . 11.8 t90 -70.16 -37.41 75.2 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 176.317 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.485 HD13 ' HA ' ' A' ' 22' ' ' LEU . 2.2 mm? -71.35 -42.46 68.47 Favored 'General case' 0 N--CA 1.485 1.298 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 -177.752 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -67.87 -29.47 68.59 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 176.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.11 -8.92 47.45 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.526 -0.733 . . . . 0.0 110.774 178.842 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.68 -39.11 84.48 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.252 -0.905 . . . . 0.0 109.137 178.947 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.5 mp -71.71 -33.26 68.62 Favored 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 106.511 -1.663 . . . . 0.0 106.511 175.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.418 ' CB ' ' HB3' ' A' ' 30' ' ' HIS . 17.0 mt-30 -95.95 33.42 1.7 Allowed 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.441 178.488 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -73.45 110.14 7.51 Favored 'General case' 0 N--CA 1.503 2.193 0 N-CA-C 105.792 -1.929 . . . . 0.0 105.792 178.391 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.44 HG13 ' CD1' ' A' ' 32' ' ' PHE . 6.4 t 68.96 34.78 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.514 2.731 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 -173.688 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.418 ' HB3' ' CB ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -44.11 92.55 0.01 OUTLIER 'General case' 0 N--CA 1.533 3.714 0 N-CA-C 106.287 -1.746 . . . . 0.0 106.287 175.275 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 21.4 m-80 76.66 -65.62 0.29 Allowed 'General case' 0 N--CA 1.521 3.119 0 N-CA-C 103.061 -2.94 . . . . 0.0 103.061 -171.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.44 ' CD1' HG13 ' A' ' 29' ' ' VAL . 80.7 t80 . . . . . 0 C--O 1.204 -1.328 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 174.032 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 . . . . . 0 N--CA 1.514 2.757 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 49.7 mt -73.42 -41.68 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 121.083 -1.01 . . . . 0.0 109.701 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -69.37 -44.74 70.94 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.768 -0.582 . . . . 0.0 109.475 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.55 -47.7 84.37 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 122.06 -0.4 . . . . 0.0 110.348 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' MET . . . . . 0.505 ' HA ' HD23 ' A' ' 9' ' ' LEU . 0.2 OUTLIER -67.82 -28.46 67.59 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.741 -0.6 . . . . 0.0 110.612 178.792 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -75.43 -11.11 59.97 Favored 'General case' 0 N--CA 1.511 2.605 0 CA-C-N 118.835 0.743 . . . . 0.0 111.671 179.103 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.8 m-80 -98.95 17.38 19.75 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.198 -0.938 . . . . 0.0 111.023 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.505 HD23 ' HA ' ' A' ' 6' ' ' MET . 0.5 OUTLIER -80.51 80.64 6.92 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 120.945 -1.097 . . . . 0.0 111.143 -179.214 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.466 ' O ' HD13 ' A' ' 13' ' ' LEU . . . 70.69 45.6 51.79 Favored Glycine 0 N--CA 1.515 3.917 0 N-CA-C 104.634 -3.387 . . . . 0.0 104.634 -174.353 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.06 31.66 21.52 Favored 'General case' 0 N--CA 1.508 2.447 0 N-CA-C 105.079 -2.193 . . . . 0.0 105.079 -171.538 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.422 ' HB2' ' H ' ' A' ' 9' ' ' LEU . 47.6 t-80 27.0 63.98 0.08 Allowed 'General case' 0 N--CA 1.505 2.278 0 CA-C-O 124.007 1.861 . . . . 0.0 111.121 -175.636 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.618 HD22 ' N ' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -49.88 -22.94 1.66 Allowed 'General case' 0 CA--C 1.567 1.611 0 CA-C-N 111.921 -2.4 . . . . 0.0 114.396 -179.783 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.531 ' HB3' ' HB2' ' A' ' 17' ' ' GLU . 35.6 t30 130.31 161.86 0.0 OUTLIER 'General case' 1 N--CA 1.544 4.233 0 C-N-CA 125.1 1.36 . . . . 0.0 108.498 -178.992 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 8.0 t -59.8 -54.06 50.67 Favored 'General case' 0 N--CA 1.518 2.972 0 O-C-N 120.742 -1.224 . . . . 0.0 111.277 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -76.18 -18.14 59.22 Favored 'General case' 0 N--CA 1.517 2.908 0 O-C-N 121.41 -0.807 . . . . 0.0 109.801 178.523 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.531 ' HB2' ' HB3' ' A' ' 14' ' ' ASN . 1.1 mm-40 -77.84 -36.44 50.03 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 176.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.486 ' O ' HD23 ' A' ' 22' ' ' LEU . 0.4 OUTLIER -64.39 -48.28 76.05 Favored 'General case' 0 C--O 1.184 -2.366 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 179.695 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 3.4 p -57.16 -46.93 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.278 0 O-C-N 121.846 -0.534 . . . . 0.0 111.733 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -71.81 -28.41 63.57 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 176.012 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' TRP . . . . . 0.515 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 14.6 t90 -68.67 -37.06 79.32 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 176.7 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.486 HD23 ' O ' ' A' ' 18' ' ' ARG . 2.8 mm? -72.69 -42.66 64.0 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 -178.306 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -66.35 -27.35 67.81 Favored 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 177.12 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.415 ' O ' ' HG3' ' A' ' 27' ' ' GLN . 1.5 mtpp -85.92 -35.11 20.71 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.382 -0.823 . . . . 0.0 110.122 179.151 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -54.73 -41.5 70.44 Favored 'General case' 0 N--CA 1.51 2.529 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -179.172 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.5 pp -60.82 -34.78 75.07 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 122.054 -0.404 . . . . 0.0 110.321 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.415 ' HG3' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -85.94 -26.14 25.69 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.746 -0.597 . . . . 0.0 110.061 178.726 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -62.51 -51.93 65.48 Favored 'General case' 0 N--CA 1.513 2.712 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.28 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 10.9 p -67.13 -23.08 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.323 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 177.089 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -97.13 50.03 1.07 Allowed 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 176.695 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -156.9 -49.28 0.07 Allowed 'General case' 0 N--CA 1.505 2.288 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -178.246 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.485 ' O ' ' CG ' ' A' ' 32' ' ' PHE . 1.1 p90 . . . . . 0 N--CA 1.499 1.981 0 CA-C-O 122.412 1.101 . . . . 0.0 110.028 -179.132 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.507 2.393 0 CA-C-O 121.423 0.63 . . . . 0.0 110.471 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.1 tp -128.82 -38.14 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.506 2.358 0 O-C-N 121.463 -0.773 . . . . 0.0 110.797 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -74.36 -44.26 53.04 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.281 -0.887 . . . . 0.0 109.673 179.422 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.3 mt -59.79 -53.2 60.78 Favored 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -62.77 -32.65 73.85 Favored 'General case' 0 N--CA 1.512 2.667 0 O-C-N 122.078 -0.389 . . . . 0.0 110.793 179.112 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -60.42 -37.9 82.32 Favored 'General case' 0 N--CA 1.509 2.502 0 O-C-N 121.527 -0.733 . . . . 0.0 110.039 178.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.601 ' HA ' ' CB ' ' A' ' 12' ' ' HIS . 30.2 m-80 -80.53 41.35 0.54 Allowed 'General case' 0 N--CA 1.508 2.464 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -178.963 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.508 HD22 ' C ' ' A' ' 8' ' ' ASN . 3.0 mm? -123.71 175.4 6.88 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 174.631 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.443 ' HA3' ' CD1' ' A' ' 21' ' ' TRP . . . 61.64 41.43 99.59 Favored Glycine 1 N--CA 1.521 4.329 1 N-CA-C 102.5 -4.24 . . . . 0.0 102.5 -171.066 . . . . . . . . 4 3 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.9 mtmp? 87.2 -61.65 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 104.699 -2.334 . . . . 0.0 104.699 -170.343 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.82 ' C ' HD13 ' A' ' 13' ' ' LEU . 0.8 OUTLIER 153.83 -21.37 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.562 0 C-N-CA 126.426 1.891 . . . . 0.0 109.483 -178.107 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.82 HD13 ' C ' ' A' ' 12' ' ' HIS . 0.0 OUTLIER 33.21 -154.57 0.0 OUTLIER 'General case' 0 N--CA 1.515 2.78 0 C-N-CA 125.791 1.636 . . . . 0.0 115.307 176.661 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -172.03 -47.8 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.463 0 O-C-N 120.995 -1.066 . . . . 0.0 113.074 -179.358 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.645 ' O ' HG12 ' A' ' 19' ' ' VAL . 34.6 p -144.85 -78.91 0.19 Allowed 'General case' 0 N--CA 1.514 2.763 0 CA-C-N 119.794 1.179 . . . . 0.0 110.351 -179.047 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 2.1 mmt -68.29 -23.92 64.8 Favored 'General case' 0 N--CA 1.518 2.971 0 CA-C-N 119.044 0.838 . . . . 0.0 109.645 178.278 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.684 ' HG3' ' HB2' ' A' ' 13' ' ' LEU . 1.0 OUTLIER -89.59 -23.83 21.86 Favored 'General case' 0 N--CA 1.501 2.115 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 175.542 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.627 ' HG3' HD21 ' A' ' 13' ' ' LEU . 9.1 ttt85 -71.33 -46.3 60.95 Favored 'General case' 0 N--CA 1.51 2.547 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 176.695 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.645 HG12 ' O ' ' A' ' 15' ' ' SER . 2.2 p -58.86 -47.38 89.62 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.553 0 O-C-N 121.475 -0.766 . . . . 0.0 110.999 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -67.89 -28.58 67.64 Favored 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 176.04 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' TRP . . . . . 0.558 ' HB3' ' O ' ' A' ' 18' ' ' ARG . 22.4 t90 -68.46 -38.71 81.34 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 107.853 -1.165 . . . . 0.0 107.853 176.102 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.472 HD13 ' HA ' ' A' ' 22' ' ' LEU . 2.2 mm? -70.34 -42.63 71.61 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 -177.899 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.94 -32.67 74.07 Favored 'General case' 0 N--CA 1.503 2.19 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 177.577 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -78.28 -30.22 48.33 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.689 -0.632 . . . . 0.0 110.224 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.6 mmmp? -53.13 -36.95 61.37 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.44 -0.787 . . . . 0.0 111.135 179.476 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 mp -67.53 -39.8 85.05 Favored 'General case' 0 N--CA 1.507 2.406 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 178.616 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.403 ' HB3' ' HB2' ' A' ' 30' ' ' HIS . 17.7 mm-40 -97.77 -79.16 0.47 Allowed 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 179.656 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 65.32 -71.62 0.08 Allowed 'General case' 0 N--CA 1.51 2.562 0 C-N-CA 123.576 0.751 . . . . 0.0 111.087 178.587 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.677 ' HA ' ' CZ ' ' A' ' 32' ' ' PHE . 4.3 p -66.78 -40.33 85.7 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.167 0 O-C-N 121.603 -0.685 . . . . 0.0 109.269 178.506 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.403 ' HB2' ' HB3' ' A' ' 27' ' ' GLN . 95.5 m-70 -65.3 -28.61 69.44 Favored 'General case' 0 N--CA 1.504 2.263 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.073 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -61.64 -39.37 91.09 Favored 'General case' 0 N--CA 1.505 2.292 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 176.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.677 ' CZ ' ' HA ' ' A' ' 29' ' ' VAL . 30.3 p90 . . . . . 0 N--CA 1.501 2.091 0 O-C-N 121.729 -0.607 . . . . 0.0 110.335 177.329 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 . . . . . 0 N--CA 1.513 2.722 0 CA-C-O 121.259 0.552 . . . . 0.0 111.356 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.7 mp -68.35 -42.32 84.17 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.525 0 O-C-N 121.458 -0.776 . . . . 0.0 110.139 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.59 -50.25 73.37 Favored 'General case' 0 N--CA 1.511 2.62 0 O-C-N 121.725 -0.609 . . . . 0.0 111.713 -179.514 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.54 -42.93 81.92 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.552 -0.718 . . . . 0.0 111.018 -178.885 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 15.9 ptp -65.27 -25.82 67.82 Favored 'General case' 0 N--CA 1.512 2.645 0 CA-C-N 119.04 0.836 . . . . 0.0 110.003 178.407 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.6 t-80 -77.12 -41.7 40.89 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 177.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -65.96 -46.91 76.41 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.985 -0.447 . . . . 0.0 110.234 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.457 ' HB3' ' NE ' ' A' ' 18' ' ' ARG . 17.7 mt -89.84 156.0 18.78 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.972 -0.455 . . . . 0.0 110.219 -179.214 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.55 -50.37 3.2 Favored Glycine 0 N--CA 1.513 3.78 0 N-CA-C 110.283 -1.127 . . . . 0.0 110.283 -179.54 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.4 ttpm? -57.31 -37.58 72.7 Favored 'General case' 0 N--CA 1.511 2.606 0 CA-C-N 119.179 1.49 . . . . 0.0 107.657 176.804 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -71.07 -42.28 69.62 Favored 'General case' 0 N--CA 1.497 1.925 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 177.031 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.541 ' CD1' ' HA ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -129.75 -90.8 0.47 Allowed 'General case' 0 N--CA 1.512 2.633 0 CA-C-O 118.51 -0.757 . . . . 0.0 109.906 178.42 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.664 ' HB3' ' CG ' ' A' ' 17' ' ' GLU . 7.9 t30 175.76 -86.62 0.0 OUTLIER 'General case' 0 N--CA 1.515 2.804 0 CA-C-N 120.016 1.28 . . . . 0.0 111.347 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -161.14 -60.57 0.05 Allowed 'General case' 0 N--CA 1.518 2.935 0 O-C-N 121.126 -0.983 . . . . 0.0 109.953 -178.11 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.521 ' HA ' HG12 ' A' ' 19' ' ' VAL . 13.3 tpp -70.71 -39.5 73.4 Favored 'General case' 0 N--CA 1.523 3.195 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 176.608 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.664 ' CG ' ' HB3' ' A' ' 14' ' ' ASN . 0.9 OUTLIER -62.01 -26.86 68.48 Favored 'General case' 0 N--CA 1.507 2.377 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 175.029 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.541 ' HA ' ' CD1' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -72.65 -48.26 40.83 Favored 'General case' 0 N--CA 1.511 2.581 0 CA-C-N 118.623 0.647 . . . . 0.0 109.914 178.296 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.521 HG12 ' HA ' ' A' ' 16' ' ' MET . 2.6 p -64.96 -41.95 93.47 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.32 0 O-C-N 121.416 -0.803 . . . . 0.0 110.054 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -69.96 -27.31 64.63 Favored 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 174.842 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' TRP . . . . . 0.559 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 28.8 t90 -70.97 -37.54 72.76 Favored 'General case' 0 N--CA 1.5 2.066 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 176.611 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.499 ' HA ' HD13 ' A' ' 22' ' ' LEU . 1.9 mm? -71.82 -43.78 65.04 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 119.768 -0.773 . . . . 0.0 109.258 -177.845 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -68.11 -38.62 82.47 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 177.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.466 ' HA ' ' HG2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -73.92 -23.18 59.5 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 121.786 -0.571 . . . . 0.0 110.705 179.753 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.39 -38.41 80.46 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.529 -0.732 . . . . 0.0 110.712 179.389 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.8 mp -70.22 -41.97 72.91 Favored 'General case' 0 N--CA 1.505 2.317 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 178.653 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.466 ' HG2' ' HA ' ' A' ' 24' ' ' LYS . 3.7 pt20 -102.73 44.35 1.02 Allowed 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.235 0.541 . . . . 0.0 109.702 178.699 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.07 -51.88 58.93 Favored 'General case' 0 N--CA 1.506 2.373 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.1 m -99.75 48.87 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.243 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 177.381 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.402 ' HB2' ' HB2' ' A' ' 27' ' ' GLN . 57.3 m80 -141.17 -52.69 0.46 Allowed 'General case' 0 N--CA 1.506 2.355 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.13 -32.5 66.41 Favored 'General case' 0 N--CA 1.511 2.592 0 C-N-CA 122.637 0.375 . . . . 0.0 110.681 177.488 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.424 ' CD1' ' C ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.159 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -179.062 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.51 2.557 0 CA-C-O 119.842 -0.123 . . . . 0.0 111.073 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.4 tt -66.47 -38.7 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 121.784 -0.572 . . . . 0.0 109.523 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.0 -41.75 77.37 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.573 -0.704 . . . . 0.0 109.119 178.159 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 11.9 mt -61.86 -50.88 70.48 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 122.084 -0.385 . . . . 0.0 110.271 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 15.0 ptt? -66.21 -27.36 67.92 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.84 -0.537 . . . . 0.0 111.079 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -77.95 -37.45 47.53 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.371 -0.831 . . . . 0.0 109.433 178.564 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -66.06 -47.69 73.47 Favored 'General case' 0 N--CA 1.51 2.55 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.788 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.608 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 21.1 mt -73.11 -41.84 63.58 Favored 'General case' 0 N--CA 1.507 2.411 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 178.915 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -67.69 -12.34 61.68 Favored Glycine 0 N--CA 1.504 3.17 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 177.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -57.91 -30.52 65.97 Favored 'General case' 0 N--CA 1.507 2.425 0 CA-C-N 119.592 1.696 . . . . 0.0 107.272 175.702 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -71.7 -46.62 58.17 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 108.069 -1.085 . . . . 0.0 108.069 176.774 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.619 HD21 ' HA ' ' A' ' 18' ' ' ARG . 2.0 pt? -132.9 -56.06 0.93 Allowed 'General case' 0 N--CA 1.514 2.75 0 CA-C-N 119.273 0.942 . . . . 0.0 111.953 178.281 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.496 ' N ' ' HG ' ' A' ' 13' ' ' LEU . 2.8 t30 176.34 160.95 0.34 Allowed 'General case' 0 N--CA 1.523 3.223 0 CA-C-N 119.829 1.195 . . . . 0.0 110.604 178.553 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 43.3 m -68.46 -52.69 29.75 Favored 'General case' 0 N--CA 1.514 2.731 0 O-C-N 121.345 -0.847 . . . . 0.0 111.163 -179.703 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 4.9 ttp -92.05 -6.81 50.34 Favored 'General case' 0 N--CA 1.516 2.838 0 O-C-N 121.567 -0.708 . . . . 0.0 110.821 179.366 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.428 ' CG ' ' HB3' ' A' ' 14' ' ' ASN . 9.8 mm-40 -95.63 -28.53 14.78 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.152 -0.968 . . . . 0.0 108.67 178.029 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.619 ' HA ' HD21 ' A' ' 13' ' ' LEU . 0.5 OUTLIER -64.44 -52.35 58.5 Favored 'General case' 0 C--O 1.178 -2.705 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 177.232 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 1.2 p -48.25 -50.45 11.34 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.616 0 C-N-CA 123.45 0.7 . . . . 0.0 111.983 178.464 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -65.58 -33.06 75.02 Favored 'General case' 0 C--N 1.296 -1.732 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 176.594 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' TRP . . . . . 0.586 ' HB2' HD11 ' A' ' 13' ' ' LEU . 5.0 t90 -69.16 -35.85 76.75 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.304 177.365 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.544 HD21 ' HG3' ' A' ' 18' ' ' ARG . 4.9 mt -73.28 -43.21 61.41 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 -177.599 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -69.22 -28.55 66.46 Favored 'General case' 0 N--CA 1.5 2.03 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 177.748 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -90.96 -20.66 21.92 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.65 -0.657 . . . . 0.0 111.222 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.14 -35.72 77.84 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.724 -0.61 . . . . 0.0 111.388 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 mp -60.89 -31.79 71.27 Favored 'General case' 0 N--CA 1.506 2.358 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 177.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.41 ' HB3' ' CD2' ' A' ' 30' ' ' HIS . 0.0 OUTLIER -89.77 -77.38 0.39 Allowed 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.646 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.586 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.1 OUTLIER 46.14 34.34 2.07 Favored 'General case' 0 N--CA 1.525 3.277 0 CA-C-O 122.342 1.067 . . . . 0.0 109.685 -178.145 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.639 HG22 ' O ' ' A' ' 32' ' ' PHE . 0.9 OUTLIER -178.89 -47.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.473 0 N-CA-C 104.957 -2.238 . . . . 0.0 104.957 -176.676 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.43 ' ND1' ' C ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER 44.05 45.28 6.64 Favored 'General case' 0 N--CA 1.521 3.109 0 CA-C-N 118.846 0.748 . . . . 0.0 109.781 175.668 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 78.01 24.15 0.71 Allowed 'General case' 0 N--CA 1.517 2.896 0 C-N-CA 123.476 0.711 . . . . 0.0 110.499 -178.878 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.639 ' O ' HG22 ' A' ' 29' ' ' VAL . 39.0 p90 . . . . . 0 N--CA 1.51 2.529 0 O-C-N 121.384 -0.822 . . . . 0.0 109.544 178.457 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.473 ' HA ' HD21 ' A' ' 5' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.507 2.403 0 CA-C-O 119.79 -0.148 . . . . 0.0 111.258 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.9 tt -63.84 -21.92 29.81 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.641 0 O-C-N 121.19 -0.944 . . . . 0.0 111.206 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -82.28 -55.0 4.79 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.282 -0.886 . . . . 0.0 108.988 178.61 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.473 HD21 ' HA ' ' A' ' 2' ' ' GLU . 2.3 pp -60.6 -34.67 74.56 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 122.055 -0.403 . . . . 0.0 110.457 179.42 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' MET . . . . . 0.502 ' HA ' HD23 ' A' ' 9' ' ' LEU . 21.5 mmt -62.99 -40.86 99.02 Favored 'General case' 0 N--CA 1.513 2.682 0 O-C-N 121.657 -0.652 . . . . 0.0 109.276 178.295 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -62.9 -33.71 75.88 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.849 -0.532 . . . . 0.0 110.002 178.195 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -64.24 -26.91 68.72 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.805 -0.559 . . . . 0.0 111.232 179.139 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.506 ' HA ' HD13 ' A' ' 9' ' ' LEU . 2.0 mm? -61.5 -43.71 98.37 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.229 -0.92 . . . . 0.0 111.15 -179.436 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -72.2 -4.79 60.81 Favored Glycine 0 N--CA 1.513 3.776 0 C-N-CA 120.997 -0.62 . . . . 0.0 112.333 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.477 ' HG3' ' CH2' ' A' ' 21' ' ' TRP . 0.0 OUTLIER -117.3 -32.18 5.05 Favored 'General case' 0 N--CA 1.51 2.525 0 CA-C-N 119.232 1.516 . . . . 0.0 110.454 178.869 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.937 ' C ' HD22 ' A' ' 13' ' ' LEU . 3.8 m80 -99.24 -23.96 15.01 Favored 'General case' 0 N--CA 1.512 2.657 0 O-C-N 121.467 -0.77 . . . . 0.0 110.918 -179.533 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.937 HD22 ' C ' ' A' ' 12' ' ' HIS . 0.0 OUTLIER 22.25 -100.8 0.01 OUTLIER 'General case' 0 N--CA 1.52 3.056 0 C-N-CA 125.246 1.418 . . . . 0.0 114.574 179.322 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.54 ' HB3' ' CG ' ' A' ' 17' ' ' GLU . 2.4 t30 -164.09 -80.07 0.03 OUTLIER 'General case' 0 N--CA 1.515 2.814 0 CA-C-N 121.393 1.906 . . . . 0.0 114.642 -176.669 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 54.7 m -146.04 -66.61 0.29 Allowed 'General case' 0 N--CA 1.525 3.322 0 CA-C-N 120.028 1.285 . . . . 0.0 110.149 -176.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.53 ' HA ' HG12 ' A' ' 19' ' ' VAL . 6.6 mtp -73.98 -37.49 64.46 Favored 'General case' 0 N--CA 1.52 3.05 0 N-CA-C 105.59 -2.004 . . . . 0.0 105.59 175.529 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.54 ' CG ' ' HB3' ' A' ' 14' ' ' ASN . 1.3 pm0 -70.64 -21.69 62.6 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 173.86 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.935 ' HG2' HD23 ' A' ' 13' ' ' LEU . 0.0 OUTLIER -81.67 -22.25 37.61 Favored 'General case' 0 N--CA 1.519 3.019 0 CA-C-N 118.76 0.709 . . . . 0.0 110.974 176.871 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.53 HG12 ' HA ' ' A' ' 16' ' ' MET . 6.1 p -88.03 -40.74 13.85 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.686 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 176.569 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -71.62 -20.99 61.9 Favored 'General case' 0 C--N 1.308 -1.231 0 N-CA-C 106.843 -1.539 . . . . 0.0 106.843 172.052 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' TRP . . . . . 0.66 ' HB3' ' HA ' ' A' ' 18' ' ' ARG . 0.2 OUTLIER -61.0 -36.67 80.11 Favored 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 105.611 -1.996 . . . . 0.0 105.611 174.073 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.561 ' CD2' ' CD1' ' A' ' 21' ' ' TRP . 4.1 mm? -80.52 -30.78 37.21 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 118.032 -1.467 . . . . 0.0 109.779 179.361 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 36.9 mtt85 -61.51 -32.74 72.78 Favored 'General case' 0 N--CA 1.504 2.258 0 N-CA-C 107.451 -1.314 . . . . 0.0 107.451 174.443 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.79 -23.37 27.25 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 122.046 -0.409 . . . . 0.0 110.283 178.331 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.545 ' HG2' ' CZ3' ' A' ' 21' ' ' TRP . 0.1 OUTLIER -56.03 -47.46 77.8 Favored 'General case' 0 N--CA 1.513 2.708 0 CA-C-N 119.008 0.822 . . . . 0.0 109.218 179.032 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -69.89 -30.15 67.52 Favored 'General case' 0 N--CA 1.505 2.29 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 177.023 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -96.94 42.03 1.1 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.74 -0.6 . . . . 0.0 110.236 178.616 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.47 -58.88 1.83 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.175 -0.953 . . . . 0.0 108.772 178.472 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.0 t -118.54 -16.06 8.11 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.958 0 CA-C-O 117.389 -1.291 . . . . 0.0 112.28 179.69 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.441 ' CG ' ' H ' ' A' ' 31' ' ' ASN . 6.5 p-80 -20.18 -51.51 0.01 OUTLIER 'General case' 1 N--CA 1.54 4.026 0 C-N-CA 124.721 1.209 . . . . 0.0 110.346 173.654 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.441 ' H ' ' CG ' ' A' ' 30' ' ' HIS . 0.0 OUTLIER -156.0 27.09 0.37 Allowed 'General case' 0 CA--C 1.579 2.095 0 C-N-CA 125.252 1.421 . . . . 0.0 107.47 174.179 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.537 3.907 0 C-N-CA 125.277 1.431 . . . . 0.0 112.578 178.194 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 . . . . . 0 N--CA 1.509 2.482 0 N-CA-C 110.352 -0.24 . . . . 0.0 110.352 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.402 HG23 ' HE2' ' A' ' 6' ' ' MET . 41.6 mm -55.94 -41.17 66.47 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.774 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -67.86 -42.72 80.9 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.725 -0.609 . . . . 0.0 109.479 178.303 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.9 mt -57.36 -52.06 66.87 Favored 'General case' 0 N--CA 1.505 2.292 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 179.278 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' MET . . . . . 0.402 ' HE2' HG23 ' A' ' 3' ' ' ILE . 7.1 ptt? -68.02 -29.89 69.0 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.927 -0.483 . . . . 0.0 110.432 178.482 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 51.0 t60 -62.63 -29.9 70.96 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.683 -0.636 . . . . 0.0 110.81 179.196 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.491 ' C ' HD22 ' A' ' 9' ' ' LEU . 26.3 m-80 -86.88 38.11 0.79 Allowed 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.379 -0.826 . . . . 0.0 111.496 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.516 HD13 ' HA ' ' A' ' 9' ' ' LEU . 2.1 mm? -130.38 -63.28 0.9 Allowed 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.074 -1.016 . . . . 0.0 108.61 178.67 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -74.79 -42.67 30.62 Favored Glycine 0 N--CA 1.506 3.348 0 N-CA-C 109.795 -1.322 . . . . 0.0 109.795 179.155 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -73.59 -32.39 64.09 Favored 'General case' 0 N--CA 1.507 2.382 0 CA-C-N 118.133 0.967 . . . . 0.0 108.836 177.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 58.9 t60 -63.46 -55.37 24.67 Favored 'General case' 0 N--CA 1.504 2.258 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 178.654 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.633 ' HG ' ' HG3' ' A' ' 18' ' ' ARG . 0.1 OUTLIER -82.09 153.92 25.84 Favored 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 -178.921 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 176.76 151.87 0.18 Allowed 'General case' 0 N--CA 1.512 2.635 0 O-C-N 121.782 -0.574 . . . . 0.0 110.648 -179.279 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 37.0 p 44.09 -83.83 0.01 OUTLIER 'General case' 0 N--CA 1.523 3.224 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 178.532 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.602 ' HA ' HG12 ' A' ' 19' ' ' VAL . 9.6 tpt -85.45 -33.76 21.81 Favored 'General case' 0 N--CA 1.513 2.685 0 CA-C-N 119.205 0.911 . . . . 0.0 109.979 -179.773 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.431 ' HB2' ' HA ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -76.75 -31.48 57.13 Favored 'General case' 0 N--CA 1.506 2.35 0 N-CA-C 107.305 -1.369 . . . . 0.0 107.305 177.383 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.633 ' HG3' ' HG ' ' A' ' 13' ' ' LEU . 9.6 mtt-85 -74.57 -41.86 59.77 Favored 'General case' 0 N--CA 1.506 2.329 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 177.704 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.602 HG12 ' HA ' ' A' ' 16' ' ' MET . 9.1 p -66.02 -43.47 92.52 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.759 0 O-C-N 121.02 -1.05 . . . . 0.0 110.908 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -68.96 -25.46 64.56 Favored 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 176.121 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' TRP . . . . . 0.529 ' HB3' ' O ' ' A' ' 18' ' ' ARG . 21.4 t90 -70.2 -38.6 75.36 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 175.248 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.469 ' HA ' HD13 ' A' ' 22' ' ' LEU . 2.1 mm? -72.19 -41.41 67.01 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -178.564 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 21.1 ttp-105 -68.29 -32.71 73.06 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 177.494 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.36 -23.8 54.16 Favored 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.626 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.451 ' HE3' ' CH2' ' A' ' 21' ' ' TRP . 4.6 mmtp -60.1 -37.56 80.32 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.25 -0.906 . . . . 0.0 108.987 177.834 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.4 mp -80.5 -36.91 32.66 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 175.183 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.471 ' C ' ' CE1' ' A' ' 30' ' ' HIS . 1.4 mt-30 -91.81 59.61 3.72 Favored 'General case' 0 N--CA 1.488 1.446 0 CA-C-O 121.551 0.691 . . . . 0.0 110.004 178.411 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -108.47 -37.74 5.88 Favored 'General case' 0 N--CA 1.5 2.065 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.255 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.441 ' O ' ' C ' ' A' ' 30' ' ' HIS . 15.7 m -129.57 -40.39 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.517 2.908 0 CA-C-O 116.218 -1.849 . . . . 0.0 111.085 178.653 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.471 ' CE1' ' C ' ' A' ' 27' ' ' GLN . 4.5 p-80 15.38 -102.12 0.0 OUTLIER 'General case' 1 N--CA 1.554 4.734 0 CA-C-N 121.081 1.764 . . . . 0.0 111.039 176.025 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -78.91 -49.48 12.78 Favored 'General case' 0 N--CA 1.502 2.169 0 N-CA-C 104.595 -2.372 . . . . 0.0 104.595 172.824 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 76.9 t80 . . . . . 0 N--CA 1.485 1.309 0 C-N-CA 126.028 1.731 . . . . 0.0 109.526 177.819 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.635 ' HB3' ' HB2' ' A' ' 5' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.873 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.7 tt -61.38 -36.87 75.81 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.538 0 O-C-N 122.097 -0.377 . . . . 0.0 111.091 -179.371 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -69.86 -40.23 75.88 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.527 -0.733 . . . . 0.0 109.547 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.635 ' HB2' ' HB3' ' A' ' 2' ' ' GLU . 0.3 OUTLIER -65.87 -51.38 59.24 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 122.084 -0.385 . . . . 0.0 110.284 -179.994 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 22.3 ptp -65.29 -29.81 70.6 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.77 -0.581 . . . . 0.0 110.616 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 76.1 t60 -74.32 -45.09 49.58 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.503 -0.748 . . . . 0.0 109.225 178.724 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 -60.53 -41.59 94.77 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.808 -0.557 . . . . 0.0 111.392 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.62 HD22 ' CH2' ' A' ' 21' ' ' TRP . 16.3 mt -88.34 -53.67 4.57 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.848 -0.533 . . . . 0.0 110.363 -178.888 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.501 ' HA2' HD22 ' A' ' 13' ' ' LEU . . . -57.96 -22.56 48.84 Favored Glycine 0 N--CA 1.514 3.887 0 CA-C-N 118.647 0.658 . . . . 0.0 111.817 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.8 ttpm? -63.69 -28.2 69.74 Favored 'General case' 0 N--CA 1.51 2.541 0 CA-C-N 119.079 1.44 . . . . 0.0 107.976 176.173 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 79.9 m-70 -100.69 -30.86 11.51 Favored 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 122.752 0.421 . . . . 0.0 111.076 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.584 ' HA ' ' HG3' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -139.5 -163.88 1.57 Allowed 'General case' 0 N--CA 1.517 2.921 0 O-C-N 121.248 -0.907 . . . . 0.0 111.746 -178.827 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 178.92 -46.12 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.796 0 O-C-N 120.823 -1.173 . . . . 0.0 112.846 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.476 ' O ' HG12 ' A' ' 19' ' ' VAL . 68.3 m -135.74 -81.1 0.41 Allowed 'General case' 0 N--CA 1.51 2.528 0 CA-C-N 119.596 1.089 . . . . 0.0 109.723 -179.05 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.531 ' HA ' ' CG1' ' A' ' 19' ' ' VAL . 3.8 ttt -74.94 -36.8 62.12 Favored 'General case' 0 N--CA 1.516 2.831 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 177.482 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.584 ' HG3' ' HA ' ' A' ' 13' ' ' LEU . 2.2 pm0 -65.75 -32.61 74.25 Favored 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 176.262 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.573 ' O ' ' HB3' ' A' ' 21' ' ' TRP . 2.1 ttt-85 -74.37 -49.05 24.29 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.889 -0.507 . . . . 0.0 109.889 179.042 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.531 ' CG1' ' HA ' ' A' ' 16' ' ' MET . 3.7 p -59.12 -47.49 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.616 0 O-C-N 121.67 -0.644 . . . . 0.0 111.262 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -65.88 -27.58 68.32 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 175.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' TRP . . . . . 0.62 ' CH2' HD22 ' A' ' 9' ' ' LEU . 13.1 t90 -67.32 -38.39 84.85 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 107.264 -1.384 . . . . 0.0 107.264 175.501 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 18' ' ' ARG . 6.0 mt -69.94 -41.9 73.94 Favored 'General case' 0 N--CA 1.494 1.747 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 -179.226 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 -62.65 -31.7 72.62 Favored 'General case' 0 N--CA 1.503 2.219 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.761 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.48 -31.86 53.96 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 179.122 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.2 mmtm -63.2 -35.99 82.14 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.677 -0.64 . . . . 0.0 110.084 179.036 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.6 mt -70.01 -35.68 74.53 Favored 'General case' 0 N--CA 1.504 2.275 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 175.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.6 ' HB3' ' CE1' ' A' ' 30' ' ' HIS . 43.7 mt-30 -82.0 -96.42 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 178.158 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.4 ' O ' ' HA ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER 68.29 -59.54 0.44 Allowed 'General case' 0 N--CA 1.518 2.965 0 C-N-CA 123.911 0.884 . . . . 0.0 113.23 178.779 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.7 m -102.3 -33.35 3.36 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.618 0 CA-C-O 118.256 -0.878 . . . . 0.0 111.522 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.6 ' CE1' ' HB3' ' A' ' 27' ' ' GLN . 7.6 p-80 -21.76 -51.11 0.02 OUTLIER 'General case' 0 N--CA 1.53 3.56 0 C-N-CA 124.717 1.207 . . . . 0.0 111.491 175.48 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.404 ' H ' ' CG ' ' A' ' 30' ' ' HIS . 8.0 m120 -143.47 12.06 1.72 Allowed 'General case' 0 CA--C 1.586 2.341 0 C-N-CA 124.378 1.071 . . . . 0.0 109.188 177.73 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.4 ' HA ' ' O ' ' A' ' 28' ' ' ASP . 0.1 OUTLIER . . . . . 1 N--CA 1.541 4.096 0 CA-C-N 119.617 1.099 . . . . 0.0 112.374 178.27 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 . . . . . 0 N--CA 1.509 2.482 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.478 ' O ' ' HB2' ' A' ' 4' ' ' GLN . 2.1 mp -64.08 153.2 7.64 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.802 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 179.117 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.478 ' HB2' ' O ' ' A' ' 3' ' ' ILE . 3.1 mp0 77.76 -58.02 0.48 Allowed 'General case' 0 N--CA 1.524 3.234 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 -177.564 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.3 mp -60.7 -44.85 96.04 Favored 'General case' 0 N--CA 1.506 2.337 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 176.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.49 -32.35 68.14 Favored 'General case' 0 N--CA 1.502 2.151 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 177.824 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 58.4 m170 -56.67 -32.43 65.38 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 121.436 -0.79 . . . . 0.0 110.633 179.038 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.6 m-80 -93.44 -26.94 16.99 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.952 -0.467 . . . . 0.0 111.141 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 13.4 mt -109.65 -68.25 0.93 Allowed 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.323 -0.861 . . . . 0.0 111.397 -178.176 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -58.63 -49.47 76.86 Favored Glycine 0 N--CA 1.514 3.869 0 CA-C-N 118.592 0.633 . . . . 0.0 111.678 -178.662 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.4 ttmt -52.54 -45.87 66.52 Favored 'General case' 0 N--CA 1.514 2.759 0 CA-C-N 118.407 1.104 . . . . 0.0 109.742 179.346 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 77.0 t60 -67.37 -39.08 85.66 Favored 'General case' 0 N--CA 1.505 2.308 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 177.577 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.69 HD23 ' HA ' ' A' ' 18' ' ' ARG . 7.2 tp -69.01 153.82 43.14 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-O 122.048 0.928 . . . . 0.0 112.212 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.559 ' HB3' ' HG3' ' A' ' 17' ' ' GLU . 0.7 OUTLIER -86.7 166.25 15.45 Favored 'General case' 0 N--CA 1.509 2.503 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.336 179.612 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 47.4 m -55.73 -58.28 8.47 Favored 'General case' 0 N--CA 1.521 3.105 0 O-C-N 121.255 -0.903 . . . . 0.0 112.019 -179.123 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.62 ' HA ' HG12 ' A' ' 19' ' ' VAL . 2.1 ttt -72.85 -30.04 63.68 Favored 'General case' 0 N--CA 1.518 2.933 0 O-C-N 121.371 -0.83 . . . . 0.0 109.307 178.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.559 ' HG3' ' HB3' ' A' ' 14' ' ' ASN . 2.9 mm-40 -68.85 -25.82 64.84 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 177.088 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.69 ' HA ' HD23 ' A' ' 13' ' ' LEU . 0.2 OUTLIER -77.87 -46.09 22.38 Favored 'General case' 0 C--O 1.186 -2.279 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.307 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.62 HG12 ' HA ' ' A' ' 16' ' ' MET . 7.0 p -62.31 -49.1 85.33 Favored 'Isoleucine or valine' 0 N--CA 1.519 2.985 0 O-C-N 121.446 -0.784 . . . . 0.0 112.335 -178.769 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.78 -25.99 67.81 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-O 121.552 0.691 . . . . 0.0 109.497 175.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' TRP . . . . . 0.528 ' HB3' ' O ' ' A' ' 18' ' ' ARG . 21.1 t90 -80.1 -41.83 24.79 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.459 179.24 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 18' ' ' ARG . 2.2 mt -65.88 -40.26 91.43 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 -177.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -66.47 -41.08 89.57 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 177.226 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.1 mtmm -65.6 -35.18 80.07 Favored 'General case' 0 N--CA 1.51 2.557 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 177.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.02 -41.38 86.73 Favored 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 178.524 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.8 mt -66.8 -31.75 72.57 Favored 'General case' 0 N--CA 1.505 2.288 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 177.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.511 ' HB3' ' ND1' ' A' ' 30' ' ' HIS . 19.2 mt-30 -69.64 -76.61 0.09 Allowed 'General case' 0 N--CA 1.487 1.39 0 CA-C-O 118.587 -0.72 . . . . 0.0 109.16 178.489 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.5 t70 42.45 85.05 0.02 OUTLIER 'General case' 0 N--CA 1.527 3.4 0 CA-C-N 119.002 0.819 . . . . 0.0 110.344 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.7 t 82.96 -51.86 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.525 3.303 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 -175.719 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.511 ' ND1' ' HB3' ' A' ' 27' ' ' GLN . 20.8 p-80 28.68 82.36 0.02 OUTLIER 'General case' 0 N--CA 1.525 3.276 0 CA-C-N 119.039 0.836 . . . . 0.0 111.768 175.156 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 76.74 -52.13 0.58 Allowed 'General case' 0 N--CA 1.527 3.38 0 O-C-N 121.695 -0.628 . . . . 0.0 110.931 -178.486 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 2.3 t80 . . . . . 0 CA--C 1.541 0.609 0 CA-C-O 122.161 0.982 . . . . 0.0 111.594 -176.986 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SIN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.508 2.45 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 49.7 mm -122.81 -55.08 2.83 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.489 0 O-C-N 121.037 -1.039 . . . . 0.0 109.23 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -72.81 -49.72 28.7 Favored 'General case' 0 N--CA 1.506 2.361 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.6 mp -56.39 -47.88 78.04 Favored 'General case' 0 N--CA 1.507 2.379 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.402 ' HA ' HD23 ' A' ' 9' ' ' LEU . 14.6 mmt -61.55 -42.43 98.81 Favored 'General case' 0 N--CA 1.514 2.739 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 32.4 t60 -64.16 -34.55 78.33 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.838 -0.538 . . . . 0.0 110.146 178.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -61.0 -27.09 68.06 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.89 -0.506 . . . . 0.0 111.548 179.493 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.476 HD13 ' HA ' ' A' ' 9' ' ' LEU . 2.7 mm? -62.04 -53.83 50.01 Favored 'General case' 0 N--CA 1.511 2.622 0 CA-C-N 119.031 0.832 . . . . 0.0 109.492 179.755 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -71.86 -36.29 61.39 Favored Glycine 0 N--CA 1.505 3.256 0 N-CA-C 109.973 -1.251 . . . . 0.0 109.973 178.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.8 -21.38 66.04 Favored 'General case' 0 N--CA 1.507 2.406 0 CA-C-N 117.651 0.726 . . . . 0.0 110.568 178.72 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 83.7 t60 -81.22 -93.24 0.05 Allowed 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.492 -0.755 . . . . 0.0 109.225 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.546 ' HG ' ' HA ' ' A' ' 18' ' ' ARG . 0.4 OUTLIER 50.31 -155.11 0.12 Allowed 'General case' 0 N--CA 1.514 2.761 0 CA-C-N 119.198 0.908 . . . . 0.0 110.066 -179.261 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.49 ' HB3' ' CG ' ' A' ' 17' ' ' GLU . 10.3 t30 -164.52 79.17 0.37 Allowed 'General case' 0 N--CA 1.503 2.176 0 O-C-N 120.533 -1.354 . . . . 0.0 111.664 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.509 ' O ' HG12 ' A' ' 19' ' ' VAL . 70.7 m 52.0 -78.12 0.01 OUTLIER 'General case' 0 N--CA 1.521 3.085 0 N-CA-C 115.271 1.582 . . . . 0.0 115.271 176.552 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.534 ' HA ' HG12 ' A' ' 19' ' ' VAL . 0.0 OUTLIER -76.65 -49.09 17.05 Favored 'General case' 0 N--CA 1.519 2.991 0 CA-C-N 119.129 0.877 . . . . 0.0 109.138 -178.497 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.566 ' O ' ' HB2' ' A' ' 21' ' ' TRP . 1.1 pm0 -62.09 -25.71 67.86 Favored 'General case' 0 N--CA 1.51 2.537 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 176.202 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.546 ' HA ' ' HG ' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -73.58 -50.49 20.98 Favored 'General case' 0 N--CA 1.501 2.084 0 CA-C-O 121.414 0.626 . . . . 0.0 109.374 177.535 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.534 HG12 ' HA ' ' A' ' 16' ' ' MET . 5.9 p -66.3 -48.53 80.72 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.629 0 O-C-N 121.67 -0.644 . . . . 0.0 112.291 -178.201 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -59.67 -27.18 66.17 Favored 'General case' 0 C--N 1.295 -1.763 0 CA-C-O 121.479 0.657 . . . . 0.0 109.292 176.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' TRP . . . . . 0.566 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 23.9 t90 -77.96 -44.87 25.51 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 178.472 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.507 HD13 ' HA ' ' A' ' 22' ' ' LEU . 1.7 mm? -64.62 -41.2 96.34 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 -179.106 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.32 -38.47 81.59 Favored 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 177.526 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.0 mttp -65.53 -34.83 79.17 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 121.864 -0.523 . . . . 0.0 109.885 178.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.487 ' HE3' ' CZ2' ' A' ' 21' ' ' TRP . 0.8 OUTLIER -61.11 -42.14 97.97 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 122.19 -0.319 . . . . 0.0 110.494 179.246 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.1 mp -71.6 -38.29 70.86 Favored 'General case' 0 N--CA 1.505 2.29 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.056 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.86 32.29 3.49 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.904 -0.498 . . . . 0.0 110.401 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.41 121.72 14.48 Favored 'General case' 0 N--CA 1.505 2.322 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.3 m 48.32 35.1 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.521 3.114 0 CA-C-O 121.69 0.757 . . . . 0.0 109.856 -176.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 8.9 m80 -133.61 62.16 1.66 Allowed 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -179.45 -52.17 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.441 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 -177.7 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.663 ' O ' HG23 ' A' ' 33' ' ' VAL . 8.8 p90 -53.64 -41.66 66.98 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.888 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.663 HG23 ' O ' ' A' ' 32' ' ' PHE . 1.4 t 171.84 90.46 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.515 2.818 0 N-CA-C 105.9 -1.889 . . . . 0.0 105.9 179.259 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -176.57 -71.49 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.429 -0.794 . . . . 0.0 109.845 -178.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.504 2.237 0 CA-C-O 117.776 -1.107 . . . . 0.0 110.008 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SIN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 . . . . . 0 N--CA 1.505 2.324 0 CA-C-O 119.201 -0.428 . . . . 0.0 111.124 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 44.1 mt -51.12 -45.81 30.93 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.117 0 CA-C-N 119.111 0.869 . . . . 0.0 109.918 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.43 ' HG3' HD12 ' A' ' 5' ' ' LEU . 6.4 pt20 -57.64 -46.48 84.11 Favored 'General case' 0 N--CA 1.517 2.891 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 178.546 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.43 HD12 ' HG3' ' A' ' 4' ' ' GLN . 0.6 OUTLIER -60.09 -43.03 95.83 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.208 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 33.1 mmt -63.32 -38.59 91.74 Favored 'General case' 0 N--CA 1.511 2.621 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.208 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.3 m80 -60.36 -39.08 85.91 Favored 'General case' 0 N--CA 1.506 2.357 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 178.364 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -61.28 -43.61 98.6 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.826 -0.546 . . . . 0.0 109.571 178.224 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.424 ' HA ' HD13 ' A' ' 9' ' ' LEU . 2.7 mm? -59.39 131.56 51.34 Favored 'General case' 0 N--CA 1.503 2.223 0 CA-C-O 121.221 0.534 . . . . 0.0 109.931 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.605 ' H ' HD22 ' A' ' 13' ' ' LEU . . . 101.46 -47.12 1.21 Allowed Glycine 0 N--CA 1.501 2.996 0 N-CA-C 109.929 -1.268 . . . . 0.0 109.929 -178.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.33 -43.74 10.14 Favored 'General case' 0 N--CA 1.509 2.476 0 CA-C-N 117.948 0.874 . . . . 0.0 109.272 179.203 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 54.5 t60 -63.98 -57.81 8.59 Favored 'General case' 0 N--CA 1.507 2.375 0 CA-C-O 121.118 0.485 . . . . 0.0 109.932 179.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.703 ' HG ' ' HG3' ' A' ' 18' ' ' ARG . 0.3 OUTLIER -61.81 153.36 28.91 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.079 -177.792 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -172.31 -41.1 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.321 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 15.2 p -139.25 -72.33 0.39 Allowed 'General case' 0 N--CA 1.51 2.559 0 CA-C-N 119.333 0.97 . . . . 0.0 109.737 -179.241 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -79.42 -20.77 46.73 Favored 'General case' 0 N--CA 1.514 2.746 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 177.692 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.583 ' CG ' ' HA ' ' A' ' 13' ' ' LEU . 1.1 pm0 -89.47 -35.26 16.08 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 176.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.703 ' HG3' ' HG ' ' A' ' 13' ' ' LEU . 7.6 mtt180 -67.18 -41.52 85.76 Favored 'General case' 0 N--CA 1.505 2.278 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 177.096 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.408 HG13 ' N ' ' A' ' 20' ' ' GLU . 7.1 p -61.64 -47.36 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.709 0 O-C-N 121.314 -0.866 . . . . 0.0 111.645 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.408 ' N ' HG13 ' A' ' 19' ' ' VAL . 4.8 mt-10 -67.17 -28.33 68.02 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 176.272 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' TRP . . . . . 0.469 ' HB3' ' O ' ' A' ' 18' ' ' ARG . 11.8 t90 -70.16 -37.41 75.2 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 176.317 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.485 HD13 ' HA ' ' A' ' 22' ' ' LEU . 2.2 mm? -71.35 -42.46 68.47 Favored 'General case' 0 N--CA 1.485 1.298 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 -177.752 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -67.87 -29.47 68.59 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 176.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.11 -8.92 47.45 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.526 -0.733 . . . . 0.0 110.774 178.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.68 -39.11 84.48 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.252 -0.905 . . . . 0.0 109.137 178.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.5 mp -71.71 -33.26 68.62 Favored 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 106.511 -1.663 . . . . 0.0 106.511 175.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.418 ' CB ' ' HB3' ' A' ' 30' ' ' HIS . 17.0 mt-30 -95.95 33.42 1.7 Allowed 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.441 178.488 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -73.45 110.14 7.51 Favored 'General case' 0 N--CA 1.503 2.193 0 N-CA-C 105.792 -1.929 . . . . 0.0 105.792 178.391 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.44 HG13 ' CD1' ' A' ' 32' ' ' PHE . 6.4 t 68.96 34.78 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.514 2.731 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 -173.688 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.582 ' CE1' ' HB2' ' A' ' 34' ' ' ALA . 0.0 OUTLIER -44.11 92.55 0.01 OUTLIER 'General case' 0 N--CA 1.533 3.714 0 N-CA-C 106.287 -1.746 . . . . 0.0 106.287 175.275 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 21.4 m-80 76.66 -65.62 0.29 Allowed 'General case' 0 N--CA 1.521 3.119 0 N-CA-C 103.061 -2.94 . . . . 0.0 103.061 -171.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.44 ' CD1' HG13 ' A' ' 29' ' ' VAL . 80.7 t80 -180.0 -94.77 0.0 OUTLIER 'General case' 0 C--O 1.204 -1.328 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 174.032 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.51 HG23 ' CE1' ' A' ' 30' ' ' HIS . 16.8 m 24.18 48.36 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.532 3.647 0 C-N-CA 124.968 1.307 . . . . 0.0 112.715 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.582 ' HB2' ' CE1' ' A' ' 30' ' ' HIS . . . -149.35 23.2 0.92 Allowed 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.556 -0.715 . . . . 0.0 112.129 -177.322 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.508 2.429 0 CA-C-O 117.633 -1.175 . . . . 0.0 110.195 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SIN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 . . . . . 0 N--CA 1.514 2.757 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 49.7 mt -73.42 -41.68 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 121.083 -1.01 . . . . 0.0 109.701 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -69.37 -44.74 70.94 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.768 -0.582 . . . . 0.0 109.475 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.55 -47.7 84.37 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 122.06 -0.4 . . . . 0.0 110.348 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.505 ' HA ' HD23 ' A' ' 9' ' ' LEU . 0.2 OUTLIER -67.82 -28.46 67.59 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.741 -0.6 . . . . 0.0 110.612 178.792 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -75.43 -11.11 59.97 Favored 'General case' 0 N--CA 1.511 2.605 0 CA-C-N 118.835 0.743 . . . . 0.0 111.671 179.103 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.8 m-80 -98.95 17.38 19.75 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.198 -0.938 . . . . 0.0 111.023 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.505 HD23 ' HA ' ' A' ' 6' ' ' MET . 0.5 OUTLIER -80.51 80.64 6.92 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 120.945 -1.097 . . . . 0.0 111.143 -179.214 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.466 ' O ' HD13 ' A' ' 13' ' ' LEU . . . 70.69 45.6 51.79 Favored Glycine 0 N--CA 1.515 3.917 0 N-CA-C 104.634 -3.387 . . . . 0.0 104.634 -174.353 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.06 31.66 21.52 Favored 'General case' 0 N--CA 1.508 2.447 0 N-CA-C 105.079 -2.193 . . . . 0.0 105.079 -171.538 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.422 ' HB2' ' H ' ' A' ' 9' ' ' LEU . 47.6 t-80 27.0 63.98 0.08 Allowed 'General case' 0 N--CA 1.505 2.278 0 CA-C-O 124.007 1.861 . . . . 0.0 111.121 -175.636 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.618 HD22 ' N ' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -49.88 -22.94 1.66 Allowed 'General case' 0 CA--C 1.567 1.611 0 CA-C-N 111.921 -2.4 . . . . 0.0 114.396 -179.783 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.531 ' HB3' ' HB2' ' A' ' 17' ' ' GLU . 35.6 t30 130.31 161.86 0.0 OUTLIER 'General case' 1 N--CA 1.544 4.233 0 C-N-CA 125.1 1.36 . . . . 0.0 108.498 -178.992 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 8.0 t -59.8 -54.06 50.67 Favored 'General case' 0 N--CA 1.518 2.972 0 O-C-N 120.742 -1.224 . . . . 0.0 111.277 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -76.18 -18.14 59.22 Favored 'General case' 0 N--CA 1.517 2.908 0 O-C-N 121.41 -0.807 . . . . 0.0 109.801 178.523 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.531 ' HB2' ' HB3' ' A' ' 14' ' ' ASN . 1.1 mm-40 -77.84 -36.44 50.03 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 176.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.486 ' O ' HD23 ' A' ' 22' ' ' LEU . 0.4 OUTLIER -64.39 -48.28 76.05 Favored 'General case' 0 C--O 1.184 -2.366 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 179.695 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 3.4 p -57.16 -46.93 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.278 0 O-C-N 121.846 -0.534 . . . . 0.0 111.733 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -71.81 -28.41 63.57 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 176.012 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' TRP . . . . . 0.515 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 14.6 t90 -68.67 -37.06 79.32 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 176.7 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.486 HD23 ' O ' ' A' ' 18' ' ' ARG . 2.8 mm? -72.69 -42.66 64.0 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 -178.306 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -66.35 -27.35 67.81 Favored 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 177.12 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.415 ' O ' ' HG3' ' A' ' 27' ' ' GLN . 1.5 mtpp -85.92 -35.11 20.71 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.382 -0.823 . . . . 0.0 110.122 179.151 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -54.73 -41.5 70.44 Favored 'General case' 0 N--CA 1.51 2.529 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -179.172 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.5 pp -60.82 -34.78 75.07 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 122.054 -0.404 . . . . 0.0 110.321 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.415 ' HG3' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -85.94 -26.14 25.69 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.746 -0.597 . . . . 0.0 110.061 178.726 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -62.51 -51.93 65.48 Favored 'General case' 0 N--CA 1.513 2.712 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.28 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 10.9 p -67.13 -23.08 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.323 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 177.089 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -97.13 50.03 1.07 Allowed 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 176.695 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -156.9 -49.28 0.07 Allowed 'General case' 0 N--CA 1.505 2.288 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -178.246 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.485 ' O ' ' CG ' ' A' ' 32' ' ' PHE . 1.1 p90 -67.08 81.0 0.12 Allowed 'General case' 0 N--CA 1.499 1.981 0 CA-C-O 122.412 1.101 . . . . 0.0 110.028 -179.132 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 31.4 m 42.4 47.1 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.524 3.238 0 O-C-N 121.225 -0.922 . . . . 0.0 110.989 -178.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -86.3 87.86 7.51 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.492 0.663 . . . . 0.0 109.244 -179.487 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.5 mp . . . . . 0 N--CA 1.504 2.264 0 CA-C-O 118.712 -0.661 . . . . 0.0 109.867 -179.491 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SIN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.507 2.393 0 CA-C-O 121.423 0.63 . . . . 0.0 110.471 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.1 tp -128.82 -38.14 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.506 2.358 0 O-C-N 121.463 -0.773 . . . . 0.0 110.797 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -74.36 -44.26 53.04 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.281 -0.887 . . . . 0.0 109.673 179.422 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.3 mt -59.79 -53.2 60.78 Favored 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -62.77 -32.65 73.85 Favored 'General case' 0 N--CA 1.512 2.667 0 O-C-N 122.078 -0.389 . . . . 0.0 110.793 179.112 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -60.42 -37.9 82.32 Favored 'General case' 0 N--CA 1.509 2.502 0 O-C-N 121.527 -0.733 . . . . 0.0 110.039 178.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.601 ' HA ' ' CB ' ' A' ' 12' ' ' HIS . 30.2 m-80 -80.53 41.35 0.54 Allowed 'General case' 0 N--CA 1.508 2.464 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -178.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.508 HD22 ' C ' ' A' ' 8' ' ' ASN . 3.0 mm? -123.71 175.4 6.88 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 174.631 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.443 ' HA3' ' CD1' ' A' ' 21' ' ' TRP . . . 61.64 41.43 99.59 Favored Glycine 1 N--CA 1.521 4.329 1 N-CA-C 102.5 -4.24 . . . . 0.0 102.5 -171.066 . . . . . . . . 4 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.9 mtmp? 87.2 -61.65 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 104.699 -2.334 . . . . 0.0 104.699 -170.343 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.82 ' C ' HD13 ' A' ' 13' ' ' LEU . 0.8 OUTLIER 153.83 -21.37 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.562 0 C-N-CA 126.426 1.891 . . . . 0.0 109.483 -178.107 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.82 HD13 ' C ' ' A' ' 12' ' ' HIS . 0.0 OUTLIER 33.21 -154.57 0.0 OUTLIER 'General case' 0 N--CA 1.515 2.78 0 C-N-CA 125.791 1.636 . . . . 0.0 115.307 176.661 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -172.03 -47.8 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.463 0 O-C-N 120.995 -1.066 . . . . 0.0 113.074 -179.358 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.645 ' O ' HG12 ' A' ' 19' ' ' VAL . 34.6 p -144.85 -78.91 0.19 Allowed 'General case' 0 N--CA 1.514 2.763 0 CA-C-N 119.794 1.179 . . . . 0.0 110.351 -179.047 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 2.1 mmt -68.29 -23.92 64.8 Favored 'General case' 0 N--CA 1.518 2.971 0 CA-C-N 119.044 0.838 . . . . 0.0 109.645 178.278 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.684 ' HG3' ' HB2' ' A' ' 13' ' ' LEU . 1.0 OUTLIER -89.59 -23.83 21.86 Favored 'General case' 0 N--CA 1.501 2.115 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 175.542 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.627 ' HG3' HD21 ' A' ' 13' ' ' LEU . 9.1 ttt85 -71.33 -46.3 60.95 Favored 'General case' 0 N--CA 1.51 2.547 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 176.695 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.645 HG12 ' O ' ' A' ' 15' ' ' SER . 2.2 p -58.86 -47.38 89.62 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.553 0 O-C-N 121.475 -0.766 . . . . 0.0 110.999 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -67.89 -28.58 67.64 Favored 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 176.04 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' TRP . . . . . 0.558 ' HB3' ' O ' ' A' ' 18' ' ' ARG . 22.4 t90 -68.46 -38.71 81.34 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 107.853 -1.165 . . . . 0.0 107.853 176.102 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.472 HD13 ' HA ' ' A' ' 22' ' ' LEU . 2.2 mm? -70.34 -42.63 71.61 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 -177.899 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.94 -32.67 74.07 Favored 'General case' 0 N--CA 1.503 2.19 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 177.577 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -78.28 -30.22 48.33 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.689 -0.632 . . . . 0.0 110.224 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.6 mmmp? -53.13 -36.95 61.37 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.44 -0.787 . . . . 0.0 111.135 179.476 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 mp -67.53 -39.8 85.05 Favored 'General case' 0 N--CA 1.507 2.406 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 178.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.403 ' HB3' ' HB2' ' A' ' 30' ' ' HIS . 17.7 mm-40 -97.77 -79.16 0.47 Allowed 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 179.656 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 65.32 -71.62 0.08 Allowed 'General case' 0 N--CA 1.51 2.562 0 C-N-CA 123.576 0.751 . . . . 0.0 111.087 178.587 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.806 HG22 ' HB2' ' A' ' 34' ' ' ALA . 4.3 p -66.78 -40.33 85.7 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.167 0 O-C-N 121.603 -0.685 . . . . 0.0 109.269 178.506 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.403 ' HB2' ' HB3' ' A' ' 27' ' ' GLN . 95.5 m-70 -65.3 -28.61 69.44 Favored 'General case' 0 N--CA 1.504 2.263 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.073 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -61.64 -39.37 91.09 Favored 'General case' 0 N--CA 1.505 2.292 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 176.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.677 ' CZ ' ' HA ' ' A' ' 29' ' ' VAL . 30.3 p90 -99.33 38.17 1.45 Allowed 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.729 -0.607 . . . . 0.0 110.335 177.329 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.454 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 38.5 t 74.08 -63.6 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.516 2.833 0 C-N-CA 123.455 0.702 . . . . 0.0 110.382 179.326 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.806 ' HB2' HG22 ' A' ' 29' ' ' VAL . . . 77.57 -62.51 0.38 Allowed 'General case' 0 N--CA 1.512 2.671 0 C-N-CA 123.133 0.573 . . . . 0.0 110.081 -179.275 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.502 2.144 0 CA-C-O 118.767 -0.635 . . . . 0.0 109.579 179.344 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SIN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 . . . . . 0 N--CA 1.513 2.722 0 CA-C-O 121.259 0.552 . . . . 0.0 111.356 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.7 mp -68.35 -42.32 84.17 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.525 0 O-C-N 121.458 -0.776 . . . . 0.0 110.139 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.59 -50.25 73.37 Favored 'General case' 0 N--CA 1.511 2.62 0 O-C-N 121.725 -0.609 . . . . 0.0 111.713 -179.514 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.54 -42.93 81.92 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.552 -0.718 . . . . 0.0 111.018 -178.885 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 15.9 ptp -65.27 -25.82 67.82 Favored 'General case' 0 N--CA 1.512 2.645 0 CA-C-N 119.04 0.836 . . . . 0.0 110.003 178.407 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.6 t-80 -77.12 -41.7 40.89 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 177.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -65.96 -46.91 76.41 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.985 -0.447 . . . . 0.0 110.234 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.457 ' HB3' ' NE ' ' A' ' 18' ' ' ARG . 17.7 mt -89.84 156.0 18.78 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.972 -0.455 . . . . 0.0 110.219 -179.214 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.55 -50.37 3.2 Favored Glycine 0 N--CA 1.513 3.78 0 N-CA-C 110.283 -1.127 . . . . 0.0 110.283 -179.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.4 ttpm? -57.31 -37.58 72.7 Favored 'General case' 0 N--CA 1.511 2.606 0 CA-C-N 119.179 1.49 . . . . 0.0 107.657 176.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -71.07 -42.28 69.62 Favored 'General case' 0 N--CA 1.497 1.925 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 177.031 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.541 ' CD1' ' HA ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -129.75 -90.8 0.47 Allowed 'General case' 0 N--CA 1.512 2.633 0 CA-C-O 118.51 -0.757 . . . . 0.0 109.906 178.42 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.664 ' HB3' ' CG ' ' A' ' 17' ' ' GLU . 7.9 t30 175.76 -86.62 0.0 OUTLIER 'General case' 0 N--CA 1.515 2.804 0 CA-C-N 120.016 1.28 . . . . 0.0 111.347 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -161.14 -60.57 0.05 Allowed 'General case' 0 N--CA 1.518 2.935 0 O-C-N 121.126 -0.983 . . . . 0.0 109.953 -178.11 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.521 ' HA ' HG12 ' A' ' 19' ' ' VAL . 13.3 tpp -70.71 -39.5 73.4 Favored 'General case' 0 N--CA 1.523 3.195 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 176.608 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.664 ' CG ' ' HB3' ' A' ' 14' ' ' ASN . 0.9 OUTLIER -62.01 -26.86 68.48 Favored 'General case' 0 N--CA 1.507 2.377 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 175.029 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.541 ' HA ' ' CD1' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -72.65 -48.26 40.83 Favored 'General case' 0 N--CA 1.511 2.581 0 CA-C-N 118.623 0.647 . . . . 0.0 109.914 178.296 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.521 HG12 ' HA ' ' A' ' 16' ' ' MET . 2.6 p -64.96 -41.95 93.47 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.32 0 O-C-N 121.416 -0.803 . . . . 0.0 110.054 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -69.96 -27.31 64.63 Favored 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 174.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' TRP . . . . . 0.559 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 28.8 t90 -70.97 -37.54 72.76 Favored 'General case' 0 N--CA 1.5 2.066 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 176.611 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.499 ' HA ' HD13 ' A' ' 22' ' ' LEU . 1.9 mm? -71.82 -43.78 65.04 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 119.768 -0.773 . . . . 0.0 109.258 -177.845 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -68.11 -38.62 82.47 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 177.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.466 ' HA ' ' HG2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -73.92 -23.18 59.5 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 121.786 -0.571 . . . . 0.0 110.705 179.753 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.39 -38.41 80.46 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.529 -0.732 . . . . 0.0 110.712 179.389 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.8 mp -70.22 -41.97 72.91 Favored 'General case' 0 N--CA 1.505 2.317 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 178.653 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.466 ' HG2' ' HA ' ' A' ' 24' ' ' LYS . 3.7 pt20 -102.73 44.35 1.02 Allowed 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.235 0.541 . . . . 0.0 109.702 178.699 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.07 -51.88 58.93 Favored 'General case' 0 N--CA 1.506 2.373 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.437 ' O ' ' HB2' ' A' ' 34' ' ' ALA . 16.1 m -99.75 48.87 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.243 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 177.381 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.402 ' HB2' ' HB2' ' A' ' 27' ' ' GLN . 57.3 m80 -141.17 -52.69 0.46 Allowed 'General case' 0 N--CA 1.506 2.355 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.13 -32.5 66.41 Favored 'General case' 0 N--CA 1.511 2.592 0 C-N-CA 122.637 0.375 . . . . 0.0 110.681 177.488 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.552 ' HE1' ' HB2' ' A' ' 34' ' ' ALA . 0.0 OUTLIER -80.19 21.79 0.57 Allowed 'General case' 0 N--CA 1.502 2.159 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -179.062 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 21.2 t 69.28 80.94 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.5 0 O-C-N 121.354 -0.841 . . . . 0.0 108.84 -179.121 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.552 ' HB2' ' HE1' ' A' ' 32' ' ' PHE . . . -91.83 -50.49 5.7 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.854 -0.529 . . . . 0.0 109.641 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.0 tp . . . . . 0 N--CA 1.501 2.107 0 CA-C-O 118.735 -0.65 . . . . 0.0 109.808 179.614 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SIN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.51 2.557 0 CA-C-O 119.842 -0.123 . . . . 0.0 111.073 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.4 tt -66.47 -38.7 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 121.784 -0.572 . . . . 0.0 109.523 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.0 -41.75 77.37 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.573 -0.704 . . . . 0.0 109.119 178.159 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 11.9 mt -61.86 -50.88 70.48 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 122.084 -0.385 . . . . 0.0 110.271 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 15.0 ptt? -66.21 -27.36 67.92 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.84 -0.537 . . . . 0.0 111.079 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -77.95 -37.45 47.53 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.371 -0.831 . . . . 0.0 109.433 178.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -66.06 -47.69 73.47 Favored 'General case' 0 N--CA 1.51 2.55 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.608 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 21.1 mt -73.11 -41.84 63.58 Favored 'General case' 0 N--CA 1.507 2.411 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 178.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -67.69 -12.34 61.68 Favored Glycine 0 N--CA 1.504 3.17 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 177.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -57.91 -30.52 65.97 Favored 'General case' 0 N--CA 1.507 2.425 0 CA-C-N 119.592 1.696 . . . . 0.0 107.272 175.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -71.7 -46.62 58.17 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 108.069 -1.085 . . . . 0.0 108.069 176.774 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.619 HD21 ' HA ' ' A' ' 18' ' ' ARG . 2.0 pt? -132.9 -56.06 0.93 Allowed 'General case' 0 N--CA 1.514 2.75 0 CA-C-N 119.273 0.942 . . . . 0.0 111.953 178.281 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.496 ' N ' ' HG ' ' A' ' 13' ' ' LEU . 2.8 t30 176.34 160.95 0.34 Allowed 'General case' 0 N--CA 1.523 3.223 0 CA-C-N 119.829 1.195 . . . . 0.0 110.604 178.553 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 43.3 m -68.46 -52.69 29.75 Favored 'General case' 0 N--CA 1.514 2.731 0 O-C-N 121.345 -0.847 . . . . 0.0 111.163 -179.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 4.9 ttp -92.05 -6.81 50.34 Favored 'General case' 0 N--CA 1.516 2.838 0 O-C-N 121.567 -0.708 . . . . 0.0 110.821 179.366 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.428 ' CG ' ' HB3' ' A' ' 14' ' ' ASN . 9.8 mm-40 -95.63 -28.53 14.78 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.152 -0.968 . . . . 0.0 108.67 178.029 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.619 ' HA ' HD21 ' A' ' 13' ' ' LEU . 0.5 OUTLIER -64.44 -52.35 58.5 Favored 'General case' 0 C--O 1.178 -2.705 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 177.232 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 1.2 p -48.25 -50.45 11.34 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.616 0 C-N-CA 123.45 0.7 . . . . 0.0 111.983 178.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -65.58 -33.06 75.02 Favored 'General case' 0 C--N 1.296 -1.732 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 176.594 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' TRP . . . . . 0.586 ' HB2' HD11 ' A' ' 13' ' ' LEU . 5.0 t90 -69.16 -35.85 76.75 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.304 177.365 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.544 HD21 ' HG3' ' A' ' 18' ' ' ARG . 4.9 mt -73.28 -43.21 61.41 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 -177.599 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -69.22 -28.55 66.46 Favored 'General case' 0 N--CA 1.5 2.03 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 177.748 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -90.96 -20.66 21.92 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.65 -0.657 . . . . 0.0 111.222 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.14 -35.72 77.84 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.724 -0.61 . . . . 0.0 111.388 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 mp -60.89 -31.79 71.27 Favored 'General case' 0 N--CA 1.506 2.358 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 177.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.41 ' HB3' ' CD2' ' A' ' 30' ' ' HIS . 0.0 OUTLIER -89.77 -77.38 0.39 Allowed 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.646 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.586 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.1 OUTLIER 46.14 34.34 2.07 Favored 'General case' 0 N--CA 1.525 3.277 0 CA-C-O 122.342 1.067 . . . . 0.0 109.685 -178.145 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.639 HG22 ' O ' ' A' ' 32' ' ' PHE . 0.9 OUTLIER -178.89 -47.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.473 0 N-CA-C 104.957 -2.238 . . . . 0.0 104.957 -176.676 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.97 ' HE1' ' HB3' ' A' ' 34' ' ' ALA . 0.0 OUTLIER 44.05 45.28 6.64 Favored 'General case' 0 N--CA 1.521 3.109 0 CA-C-N 118.846 0.748 . . . . 0.0 109.781 175.668 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 78.01 24.15 0.71 Allowed 'General case' 0 N--CA 1.517 2.896 0 C-N-CA 123.476 0.711 . . . . 0.0 110.499 -178.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.639 ' O ' HG22 ' A' ' 29' ' ' VAL . 39.0 p90 -166.46 -142.06 0.05 OUTLIER 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.384 -0.822 . . . . 0.0 109.544 178.457 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 54.2 t -133.04 107.5 11.69 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.251 0 O-C-N 120.566 -1.334 . . . . 0.0 108.646 -179.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.97 ' HB3' ' HE1' ' A' ' 30' ' ' HIS . . . -148.97 116.67 6.24 Favored 'General case' 0 N--CA 1.505 2.303 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.0 tp . . . . . 0 N--CA 1.508 2.47 0 CA-C-O 117.806 -1.093 . . . . 0.0 110.662 -179.84 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SIN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.473 ' HA ' HD21 ' A' ' 5' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.507 2.403 0 CA-C-O 119.79 -0.148 . . . . 0.0 111.258 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.9 tt -63.84 -21.92 29.81 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.641 0 O-C-N 121.19 -0.944 . . . . 0.0 111.206 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -82.28 -55.0 4.79 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.282 -0.886 . . . . 0.0 108.988 178.61 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.473 HD21 ' HA ' ' A' ' 2' ' ' GLU . 2.3 pp -60.6 -34.67 74.56 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 122.055 -0.403 . . . . 0.0 110.457 179.42 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.502 ' HA ' HD23 ' A' ' 9' ' ' LEU . 21.5 mmt -62.99 -40.86 99.02 Favored 'General case' 0 N--CA 1.513 2.682 0 O-C-N 121.657 -0.652 . . . . 0.0 109.276 178.295 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -62.9 -33.71 75.88 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.849 -0.532 . . . . 0.0 110.002 178.195 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -64.24 -26.91 68.72 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.805 -0.559 . . . . 0.0 111.232 179.139 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.506 ' HA ' HD13 ' A' ' 9' ' ' LEU . 2.0 mm? -61.5 -43.71 98.37 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.229 -0.92 . . . . 0.0 111.15 -179.436 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -72.2 -4.79 60.81 Favored Glycine 0 N--CA 1.513 3.776 0 C-N-CA 120.997 -0.62 . . . . 0.0 112.333 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.477 ' HG3' ' CH2' ' A' ' 21' ' ' TRP . 0.0 OUTLIER -117.3 -32.18 5.05 Favored 'General case' 0 N--CA 1.51 2.525 0 CA-C-N 119.232 1.516 . . . . 0.0 110.454 178.869 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.937 ' C ' HD22 ' A' ' 13' ' ' LEU . 3.8 m80 -99.24 -23.96 15.01 Favored 'General case' 0 N--CA 1.512 2.657 0 O-C-N 121.467 -0.77 . . . . 0.0 110.918 -179.533 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.937 HD22 ' C ' ' A' ' 12' ' ' HIS . 0.0 OUTLIER 22.25 -100.8 0.01 OUTLIER 'General case' 0 N--CA 1.52 3.056 0 C-N-CA 125.246 1.418 . . . . 0.0 114.574 179.322 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.54 ' HB3' ' CG ' ' A' ' 17' ' ' GLU . 2.4 t30 -164.09 -80.07 0.03 OUTLIER 'General case' 0 N--CA 1.515 2.814 0 CA-C-N 121.393 1.906 . . . . 0.0 114.642 -176.669 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 54.7 m -146.04 -66.61 0.29 Allowed 'General case' 0 N--CA 1.525 3.322 0 CA-C-N 120.028 1.285 . . . . 0.0 110.149 -176.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.53 ' HA ' HG12 ' A' ' 19' ' ' VAL . 6.6 mtp -73.98 -37.49 64.46 Favored 'General case' 0 N--CA 1.52 3.05 0 N-CA-C 105.59 -2.004 . . . . 0.0 105.59 175.529 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.54 ' CG ' ' HB3' ' A' ' 14' ' ' ASN . 1.3 pm0 -70.64 -21.69 62.6 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 173.86 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.935 ' HG2' HD23 ' A' ' 13' ' ' LEU . 0.0 OUTLIER -81.67 -22.25 37.61 Favored 'General case' 0 N--CA 1.519 3.019 0 CA-C-N 118.76 0.709 . . . . 0.0 110.974 176.871 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.53 HG12 ' HA ' ' A' ' 16' ' ' MET . 6.1 p -88.03 -40.74 13.85 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.686 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 176.569 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -71.62 -20.99 61.9 Favored 'General case' 0 C--N 1.308 -1.231 0 N-CA-C 106.843 -1.539 . . . . 0.0 106.843 172.052 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' TRP . . . . . 0.66 ' HB3' ' HA ' ' A' ' 18' ' ' ARG . 0.2 OUTLIER -61.0 -36.67 80.11 Favored 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 105.611 -1.996 . . . . 0.0 105.611 174.073 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.561 ' CD2' ' CD1' ' A' ' 21' ' ' TRP . 4.1 mm? -80.52 -30.78 37.21 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 118.032 -1.467 . . . . 0.0 109.779 179.361 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 36.9 mtt85 -61.51 -32.74 72.78 Favored 'General case' 0 N--CA 1.504 2.258 0 N-CA-C 107.451 -1.314 . . . . 0.0 107.451 174.443 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.79 -23.37 27.25 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 122.046 -0.409 . . . . 0.0 110.283 178.331 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.545 ' HG2' ' CZ3' ' A' ' 21' ' ' TRP . 0.1 OUTLIER -56.03 -47.46 77.8 Favored 'General case' 0 N--CA 1.513 2.708 0 CA-C-N 119.008 0.822 . . . . 0.0 109.218 179.032 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -69.89 -30.15 67.52 Favored 'General case' 0 N--CA 1.505 2.29 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 177.023 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -96.94 42.03 1.1 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.74 -0.6 . . . . 0.0 110.236 178.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.47 -58.88 1.83 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.175 -0.953 . . . . 0.0 108.772 178.472 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.0 t -118.54 -16.06 8.11 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.958 0 CA-C-O 117.389 -1.291 . . . . 0.0 112.28 179.69 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.441 ' CG ' ' H ' ' A' ' 31' ' ' ASN . 6.5 p-80 -20.18 -51.51 0.01 OUTLIER 'General case' 1 N--CA 1.54 4.026 0 C-N-CA 124.721 1.209 . . . . 0.0 110.346 173.654 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.537 ' HB2' ' HB3' ' A' ' 34' ' ' ALA . 0.0 OUTLIER -156.0 27.09 0.37 Allowed 'General case' 0 CA--C 1.579 2.095 0 C-N-CA 125.252 1.421 . . . . 0.0 107.47 174.179 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 44.47 94.65 0.01 OUTLIER 'General case' 0 N--CA 1.537 3.907 0 C-N-CA 125.277 1.431 . . . . 0.0 112.578 178.194 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 17.4 m 37.41 52.64 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.526 3.343 0 CA-C-O 121.769 0.795 . . . . 0.0 110.6 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.537 ' HB3' ' HB2' ' A' ' 31' ' ' ASN . . . -128.3 -153.05 0.54 Allowed 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.888 -0.507 . . . . 0.0 109.7 -177.695 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.7 tt . . . . . 0 N--CA 1.503 2.198 0 O-C-N 121.41 -0.806 . . . . 0.0 109.78 -179.956 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SIN . . . . . 0.463 ' H22' ' HB2' ' A' ' 4' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 . . . . . 0 N--CA 1.509 2.482 0 N-CA-C 110.352 -0.24 . . . . 0.0 110.352 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.402 HG23 ' HE2' ' A' ' 6' ' ' MET . 41.6 mm -55.94 -41.17 66.47 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.774 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.463 ' HB2' ' H22' ' A' ' 1' ' ' SIN . 1.4 mm-40 -67.86 -42.72 80.9 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.725 -0.609 . . . . 0.0 109.479 178.303 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.9 mt -57.36 -52.06 66.87 Favored 'General case' 0 N--CA 1.505 2.292 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 179.278 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.402 ' HE2' HG23 ' A' ' 3' ' ' ILE . 7.1 ptt? -68.02 -29.89 69.0 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.927 -0.483 . . . . 0.0 110.432 178.482 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 51.0 t60 -62.63 -29.9 70.96 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.683 -0.636 . . . . 0.0 110.81 179.196 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.491 ' C ' HD22 ' A' ' 9' ' ' LEU . 26.3 m-80 -86.88 38.11 0.79 Allowed 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.379 -0.826 . . . . 0.0 111.496 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.516 HD13 ' HA ' ' A' ' 9' ' ' LEU . 2.1 mm? -130.38 -63.28 0.9 Allowed 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.074 -1.016 . . . . 0.0 108.61 178.67 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -74.79 -42.67 30.62 Favored Glycine 0 N--CA 1.506 3.348 0 N-CA-C 109.795 -1.322 . . . . 0.0 109.795 179.155 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -73.59 -32.39 64.09 Favored 'General case' 0 N--CA 1.507 2.382 0 CA-C-N 118.133 0.967 . . . . 0.0 108.836 177.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 58.9 t60 -63.46 -55.37 24.67 Favored 'General case' 0 N--CA 1.504 2.258 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 178.654 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.633 ' HG ' ' HG3' ' A' ' 18' ' ' ARG . 0.1 OUTLIER -82.09 153.92 25.84 Favored 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 -178.921 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 176.76 151.87 0.18 Allowed 'General case' 0 N--CA 1.512 2.635 0 O-C-N 121.782 -0.574 . . . . 0.0 110.648 -179.279 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 37.0 p 44.09 -83.83 0.01 OUTLIER 'General case' 0 N--CA 1.523 3.224 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 178.532 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.602 ' HA ' HG12 ' A' ' 19' ' ' VAL . 9.6 tpt -85.45 -33.76 21.81 Favored 'General case' 0 N--CA 1.513 2.685 0 CA-C-N 119.205 0.911 . . . . 0.0 109.979 -179.773 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.431 ' HB2' ' HA ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -76.75 -31.48 57.13 Favored 'General case' 0 N--CA 1.506 2.35 0 N-CA-C 107.305 -1.369 . . . . 0.0 107.305 177.383 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.633 ' HG3' ' HG ' ' A' ' 13' ' ' LEU . 9.6 mtt-85 -74.57 -41.86 59.77 Favored 'General case' 0 N--CA 1.506 2.329 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 177.704 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.602 HG12 ' HA ' ' A' ' 16' ' ' MET . 9.1 p -66.02 -43.47 92.52 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.759 0 O-C-N 121.02 -1.05 . . . . 0.0 110.908 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -68.96 -25.46 64.56 Favored 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 176.121 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' TRP . . . . . 0.529 ' HB3' ' O ' ' A' ' 18' ' ' ARG . 21.4 t90 -70.2 -38.6 75.36 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 175.248 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.469 HD13 ' HA ' ' A' ' 22' ' ' LEU . 2.1 mm? -72.19 -41.41 67.01 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -178.564 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 21.1 ttp-105 -68.29 -32.71 73.06 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 177.494 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.36 -23.8 54.16 Favored 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.626 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.451 ' HE3' ' CH2' ' A' ' 21' ' ' TRP . 4.6 mmtp -60.1 -37.56 80.32 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.25 -0.906 . . . . 0.0 108.987 177.834 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.4 mp -80.5 -36.91 32.66 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 175.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.471 ' C ' ' CE1' ' A' ' 30' ' ' HIS . 1.4 mt-30 -91.81 59.61 3.72 Favored 'General case' 0 N--CA 1.488 1.446 0 CA-C-O 121.551 0.691 . . . . 0.0 110.004 178.411 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -108.47 -37.74 5.88 Favored 'General case' 0 N--CA 1.5 2.065 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.255 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.441 ' O ' ' C ' ' A' ' 30' ' ' HIS . 15.7 m -129.57 -40.39 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.517 2.908 0 CA-C-O 116.218 -1.849 . . . . 0.0 111.085 178.653 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.601 ' CE1' ' HB2' ' A' ' 34' ' ' ALA . 4.5 p-80 15.38 -102.12 0.0 OUTLIER 'General case' 1 N--CA 1.554 4.734 0 CA-C-N 121.081 1.764 . . . . 0.0 111.039 176.025 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -78.91 -49.48 12.78 Favored 'General case' 0 N--CA 1.502 2.169 0 N-CA-C 104.595 -2.372 . . . . 0.0 104.595 172.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 76.9 t80 146.42 -32.1 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 126.028 1.731 . . . . 0.0 109.526 177.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.477 HG13 ' O ' ' A' ' 33' ' ' VAL . 7.2 p -55.85 89.12 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.524 3.251 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 179.578 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.601 ' HB2' ' CE1' ' A' ' 30' ' ' HIS . . . -137.34 111.53 8.45 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.112 -173.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.447 HD13 ' HA ' ' A' ' 35' ' ' LEU . 2.4 mm? . . . . . 0 N--CA 1.501 2.102 0 CA-C-O 118.747 -0.644 . . . . 0.0 109.342 179.262 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SIN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.635 ' HB3' ' HB2' ' A' ' 5' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.873 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.7 tt -61.38 -36.87 75.81 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.538 0 O-C-N 122.097 -0.377 . . . . 0.0 111.091 -179.371 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -69.86 -40.23 75.88 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.527 -0.733 . . . . 0.0 109.547 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.635 ' HB2' ' HB3' ' A' ' 2' ' ' GLU . 0.3 OUTLIER -65.87 -51.38 59.24 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 122.084 -0.385 . . . . 0.0 110.284 -179.994 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 22.3 ptp -65.29 -29.81 70.6 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.77 -0.581 . . . . 0.0 110.616 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 76.1 t60 -74.32 -45.09 49.58 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.503 -0.748 . . . . 0.0 109.225 178.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 -60.53 -41.59 94.77 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.808 -0.557 . . . . 0.0 111.392 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.62 HD22 ' CH2' ' A' ' 21' ' ' TRP . 16.3 mt -88.34 -53.67 4.57 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.848 -0.533 . . . . 0.0 110.363 -178.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.501 ' HA2' HD22 ' A' ' 13' ' ' LEU . . . -57.96 -22.56 48.84 Favored Glycine 0 N--CA 1.514 3.887 0 CA-C-N 118.647 0.658 . . . . 0.0 111.817 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.8 ttpm? -63.69 -28.2 69.74 Favored 'General case' 0 N--CA 1.51 2.541 0 CA-C-N 119.079 1.44 . . . . 0.0 107.976 176.173 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 79.9 m-70 -100.69 -30.86 11.51 Favored 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 122.752 0.421 . . . . 0.0 111.076 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.584 ' HA ' ' HG3' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -139.5 -163.88 1.57 Allowed 'General case' 0 N--CA 1.517 2.921 0 O-C-N 121.248 -0.907 . . . . 0.0 111.746 -178.827 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 178.92 -46.12 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.796 0 O-C-N 120.823 -1.173 . . . . 0.0 112.846 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.476 ' O ' HG12 ' A' ' 19' ' ' VAL . 68.3 m -135.74 -81.1 0.41 Allowed 'General case' 0 N--CA 1.51 2.528 0 CA-C-N 119.596 1.089 . . . . 0.0 109.723 -179.05 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.531 ' HA ' ' CG1' ' A' ' 19' ' ' VAL . 3.8 ttt -74.94 -36.8 62.12 Favored 'General case' 0 N--CA 1.516 2.831 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 177.482 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.584 ' HG3' ' HA ' ' A' ' 13' ' ' LEU . 2.2 pm0 -65.75 -32.61 74.25 Favored 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 176.262 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.573 ' O ' ' HB3' ' A' ' 21' ' ' TRP . 2.1 ttt-85 -74.37 -49.05 24.29 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.889 -0.507 . . . . 0.0 109.889 179.042 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.531 ' CG1' ' HA ' ' A' ' 16' ' ' MET . 3.7 p -59.12 -47.49 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.616 0 O-C-N 121.67 -0.644 . . . . 0.0 111.262 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -65.88 -27.58 68.32 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 175.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' TRP . . . . . 0.62 ' CH2' HD22 ' A' ' 9' ' ' LEU . 13.1 t90 -67.32 -38.39 84.85 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 107.264 -1.384 . . . . 0.0 107.264 175.501 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 18' ' ' ARG . 6.0 mt -69.94 -41.9 73.94 Favored 'General case' 0 N--CA 1.494 1.747 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 -179.226 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 -62.65 -31.7 72.62 Favored 'General case' 0 N--CA 1.503 2.219 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.48 -31.86 53.96 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 179.122 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.2 mmtm -63.2 -35.99 82.14 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.677 -0.64 . . . . 0.0 110.084 179.036 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.6 mt -70.01 -35.68 74.53 Favored 'General case' 0 N--CA 1.504 2.275 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 175.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.6 ' HB3' ' CE1' ' A' ' 30' ' ' HIS . 43.7 mt-30 -82.0 -96.42 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 178.158 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.4 ' O ' ' HA ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER 68.29 -59.54 0.44 Allowed 'General case' 0 N--CA 1.518 2.965 0 C-N-CA 123.911 0.884 . . . . 0.0 113.23 178.779 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.7 m -102.3 -33.35 3.36 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.618 0 CA-C-O 118.256 -0.878 . . . . 0.0 111.522 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.6 ' CE1' ' HB3' ' A' ' 27' ' ' GLN . 7.6 p-80 -21.76 -51.11 0.02 OUTLIER 'General case' 0 N--CA 1.53 3.56 0 C-N-CA 124.717 1.207 . . . . 0.0 111.491 175.48 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.893 ' HB2' ' HB3' ' A' ' 34' ' ' ALA . 8.0 m120 -143.47 12.06 1.72 Allowed 'General case' 0 CA--C 1.586 2.341 0 C-N-CA 124.378 1.071 . . . . 0.0 109.188 177.73 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.4 ' HA ' ' O ' ' A' ' 28' ' ' ASP . 0.1 OUTLIER 47.31 86.65 0.02 OUTLIER 'General case' 1 N--CA 1.541 4.096 0 CA-C-N 119.617 1.099 . . . . 0.0 112.374 178.27 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 10.4 t 49.18 55.7 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.521 3.102 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 179.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.893 ' HB3' ' HB2' ' A' ' 31' ' ' ASN . . . -126.45 -62.99 1.12 Allowed 'General case' 0 N--CA 1.493 1.711 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.299 -176.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.503 2.191 0 CA-C-O 118.547 -0.74 . . . . 0.0 109.794 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SIN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 . . . . . 0 N--CA 1.509 2.482 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.478 ' O ' ' HB2' ' A' ' 4' ' ' GLN . 2.1 mp -64.08 153.2 7.64 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.802 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 179.117 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.478 ' HB2' ' O ' ' A' ' 3' ' ' ILE . 3.1 mp0 77.76 -58.02 0.48 Allowed 'General case' 0 N--CA 1.524 3.234 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 -177.564 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.3 mp -60.7 -44.85 96.04 Favored 'General case' 0 N--CA 1.506 2.337 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 176.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.49 -32.35 68.14 Favored 'General case' 0 N--CA 1.502 2.151 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 177.824 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 58.4 m170 -56.67 -32.43 65.38 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 121.436 -0.79 . . . . 0.0 110.633 179.038 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.6 m-80 -93.44 -26.94 16.99 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.952 -0.467 . . . . 0.0 111.141 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 13.4 mt -109.65 -68.25 0.93 Allowed 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.323 -0.861 . . . . 0.0 111.397 -178.176 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -58.63 -49.47 76.86 Favored Glycine 0 N--CA 1.514 3.869 0 CA-C-N 118.592 0.633 . . . . 0.0 111.678 -178.662 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.4 ttmt -52.54 -45.87 66.52 Favored 'General case' 0 N--CA 1.514 2.759 0 CA-C-N 118.407 1.104 . . . . 0.0 109.742 179.346 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 77.0 t60 -67.37 -39.08 85.66 Favored 'General case' 0 N--CA 1.505 2.308 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 177.577 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.69 HD23 ' HA ' ' A' ' 18' ' ' ARG . 7.2 tp -69.01 153.82 43.14 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-O 122.048 0.928 . . . . 0.0 112.212 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.559 ' HB3' ' HG3' ' A' ' 17' ' ' GLU . 0.7 OUTLIER -86.7 166.25 15.45 Favored 'General case' 0 N--CA 1.509 2.503 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.336 179.612 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 47.4 m -55.73 -58.28 8.47 Favored 'General case' 0 N--CA 1.521 3.105 0 O-C-N 121.255 -0.903 . . . . 0.0 112.019 -179.123 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.62 ' HA ' HG12 ' A' ' 19' ' ' VAL . 2.1 ttt -72.85 -30.04 63.68 Favored 'General case' 0 N--CA 1.518 2.933 0 O-C-N 121.371 -0.83 . . . . 0.0 109.307 178.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.559 ' HG3' ' HB3' ' A' ' 14' ' ' ASN . 2.9 mm-40 -68.85 -25.82 64.84 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 177.088 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.69 ' HA ' HD23 ' A' ' 13' ' ' LEU . 0.2 OUTLIER -77.87 -46.09 22.38 Favored 'General case' 0 C--O 1.186 -2.279 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.307 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.62 HG12 ' HA ' ' A' ' 16' ' ' MET . 7.0 p -62.31 -49.1 85.33 Favored 'Isoleucine or valine' 0 N--CA 1.519 2.985 0 O-C-N 121.446 -0.784 . . . . 0.0 112.335 -178.769 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.78 -25.99 67.81 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-O 121.552 0.691 . . . . 0.0 109.497 175.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' TRP . . . . . 0.528 ' HB3' ' O ' ' A' ' 18' ' ' ARG . 21.1 t90 -80.1 -41.83 24.79 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.459 179.24 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 18' ' ' ARG . 2.2 mt -65.88 -40.26 91.43 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 -177.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -66.47 -41.08 89.57 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 177.226 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.1 mtmm -65.6 -35.18 80.07 Favored 'General case' 0 N--CA 1.51 2.557 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 177.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.02 -41.38 86.73 Favored 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 178.524 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.8 mt -66.8 -31.75 72.57 Favored 'General case' 0 N--CA 1.505 2.288 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 177.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.511 ' HB3' ' ND1' ' A' ' 30' ' ' HIS . 19.2 mt-30 -69.64 -76.61 0.09 Allowed 'General case' 0 N--CA 1.487 1.39 0 CA-C-O 118.587 -0.72 . . . . 0.0 109.16 178.489 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.5 t70 42.45 85.05 0.02 OUTLIER 'General case' 0 N--CA 1.527 3.4 0 CA-C-N 119.002 0.819 . . . . 0.0 110.344 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.7 t 82.96 -51.86 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.525 3.303 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 -175.719 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.511 ' ND1' ' HB3' ' A' ' 27' ' ' GLN . 20.8 p-80 28.68 82.36 0.02 OUTLIER 'General case' 0 N--CA 1.525 3.276 0 CA-C-N 119.039 0.836 . . . . 0.0 111.768 175.156 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 76.74 -52.13 0.58 Allowed 'General case' 0 N--CA 1.527 3.38 0 O-C-N 121.695 -0.628 . . . . 0.0 110.931 -178.486 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 2.3 t80 68.52 50.09 0.72 Allowed 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 122.161 0.982 . . . . 0.0 111.594 -176.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 15.5 m -111.83 43.44 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.031 0 N-CA-C 105.622 -1.992 . . . . 0.0 105.622 175.137 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -111.21 -60.04 1.89 Allowed 'General case' 0 N--CA 1.492 1.635 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.94 -177.508 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.504 2.239 0 CA-C-O 117.729 -1.129 . . . . 0.0 109.961 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.508 2.45 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 49.7 mm -122.81 -55.08 2.83 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.489 0 O-C-N 121.037 -1.039 . . . . 0.0 109.23 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -72.81 -49.72 28.7 Favored 'General case' 0 N--CA 1.506 2.361 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.6 mp -56.39 -47.88 78.04 Favored 'General case' 0 N--CA 1.507 2.379 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . 0.402 ' HA ' HD23 ' A' ' 9' ' ' LEU . 14.6 mmt -61.55 -42.43 98.81 Favored 'General case' 0 N--CA 1.514 2.739 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 32.4 t60 -64.16 -34.55 78.33 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.838 -0.538 . . . . 0.0 110.146 178.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -61.0 -27.09 68.06 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.89 -0.506 . . . . 0.0 111.548 179.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.476 HD13 ' HA ' ' A' ' 9' ' ' LEU . 2.7 mm? -62.04 -53.83 50.01 Favored 'General case' 0 N--CA 1.511 2.622 0 CA-C-N 119.031 0.832 . . . . 0.0 109.492 179.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -71.86 -36.29 61.39 Favored Glycine 0 N--CA 1.505 3.256 0 N-CA-C 109.973 -1.251 . . . . 0.0 109.973 178.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.8 -21.38 66.04 Favored 'General case' 0 N--CA 1.507 2.406 0 CA-C-N 117.651 0.726 . . . . 0.0 110.568 178.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 83.7 t60 -81.22 -93.24 0.05 Allowed 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.492 -0.755 . . . . 0.0 109.225 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.546 ' HG ' ' HA ' ' A' ' 18' ' ' ARG . 0.4 OUTLIER 50.31 -155.11 0.12 Allowed 'General case' 0 N--CA 1.514 2.761 0 CA-C-N 119.198 0.908 . . . . 0.0 110.066 -179.261 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.49 ' HB3' ' CG ' ' A' ' 17' ' ' GLU . 10.3 t30 -164.52 79.17 0.37 Allowed 'General case' 0 N--CA 1.503 2.176 0 O-C-N 120.533 -1.354 . . . . 0.0 111.664 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.509 ' O ' HG12 ' A' ' 19' ' ' VAL . 70.7 m 52.0 -78.12 0.01 OUTLIER 'General case' 0 N--CA 1.521 3.085 0 N-CA-C 115.271 1.582 . . . . 0.0 115.271 176.552 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.534 ' HA ' HG12 ' A' ' 19' ' ' VAL . 0.0 OUTLIER -76.65 -49.09 17.05 Favored 'General case' 0 N--CA 1.519 2.991 0 CA-C-N 119.129 0.877 . . . . 0.0 109.138 -178.497 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.566 ' O ' ' HB2' ' A' ' 21' ' ' TRP . 1.1 pm0 -62.09 -25.71 67.86 Favored 'General case' 0 N--CA 1.51 2.537 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 176.202 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.546 ' HA ' ' HG ' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -73.58 -50.49 20.98 Favored 'General case' 0 N--CA 1.501 2.084 0 CA-C-O 121.414 0.626 . . . . 0.0 109.374 177.535 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.534 HG12 ' HA ' ' A' ' 16' ' ' MET . 5.9 p -66.3 -48.53 80.72 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.629 0 O-C-N 121.67 -0.644 . . . . 0.0 112.291 -178.201 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -59.67 -27.18 66.17 Favored 'General case' 0 C--N 1.295 -1.763 0 CA-C-O 121.479 0.657 . . . . 0.0 109.292 176.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . 0.566 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 23.9 t90 -77.96 -44.87 25.51 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 178.472 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.507 HD13 ' HA ' ' A' ' 22' ' ' LEU . 1.7 mm? -64.62 -41.2 96.34 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 -179.106 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.32 -38.47 81.59 Favored 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 177.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.0 mttp -65.53 -34.83 79.17 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 121.864 -0.523 . . . . 0.0 109.885 178.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.487 ' HE3' ' CZ2' ' A' ' 21' ' ' TRP . 0.8 OUTLIER -61.11 -42.14 97.97 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 122.19 -0.319 . . . . 0.0 110.494 179.246 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.1 mp -71.6 -38.29 70.86 Favored 'General case' 0 N--CA 1.505 2.29 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.86 32.29 3.49 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.904 -0.498 . . . . 0.0 110.401 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.41 121.72 14.48 Favored 'General case' 0 N--CA 1.505 2.322 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.3 m 48.32 35.1 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.521 3.114 0 CA-C-O 121.69 0.757 . . . . 0.0 109.856 -176.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 8.9 m80 -133.61 62.16 1.66 Allowed 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -179.45 -52.17 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.441 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 -177.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 8.8 p90 . . . . . 0 N--CA 1.5 2.034 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.888 179.97 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 . . . . . 0 N--CA 1.505 2.324 0 CA-C-O 119.201 -0.428 . . . . 0.0 111.124 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 44.1 mt -51.12 -45.81 30.93 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.117 0 CA-C-N 119.111 0.869 . . . . 0.0 109.918 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.43 ' HG3' HD12 ' A' ' 5' ' ' LEU . 2.3 pt20 -57.64 -46.48 84.11 Favored 'General case' 0 N--CA 1.517 2.891 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 178.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.43 HD12 ' HG3' ' A' ' 4' ' ' GLN . 0.6 OUTLIER -60.09 -43.03 95.83 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.208 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 33.1 mmt -63.32 -38.59 91.74 Favored 'General case' 0 N--CA 1.511 2.621 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.3 m80 -60.36 -39.08 85.91 Favored 'General case' 0 N--CA 1.506 2.357 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 178.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -61.28 -43.61 98.6 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.826 -0.546 . . . . 0.0 109.571 178.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.424 ' HA ' HD13 ' A' ' 9' ' ' LEU . 2.7 mm? -59.39 131.56 51.34 Favored 'General case' 0 N--CA 1.503 2.223 0 CA-C-O 121.221 0.534 . . . . 0.0 109.931 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.605 ' H ' HD22 ' A' ' 13' ' ' LEU . . . 101.46 -47.12 1.21 Allowed Glycine 0 N--CA 1.501 2.996 0 N-CA-C 109.929 -1.268 . . . . 0.0 109.929 -178.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.33 -43.74 10.14 Favored 'General case' 0 N--CA 1.509 2.476 0 CA-C-N 117.948 0.874 . . . . 0.0 109.272 179.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 54.5 t60 -63.98 -57.81 8.59 Favored 'General case' 0 N--CA 1.507 2.375 0 CA-C-O 121.118 0.485 . . . . 0.0 109.932 179.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.703 ' HG ' ' HG3' ' A' ' 18' ' ' ARG . 0.3 OUTLIER -61.81 153.36 28.91 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.079 -177.792 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -172.31 -41.1 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.321 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 15.2 p -139.25 -72.33 0.39 Allowed 'General case' 0 N--CA 1.51 2.559 0 CA-C-N 119.333 0.97 . . . . 0.0 109.737 -179.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -79.42 -20.77 46.73 Favored 'General case' 0 N--CA 1.514 2.746 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 177.692 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.583 ' CG ' ' HA ' ' A' ' 13' ' ' LEU . 1.1 pm0 -89.47 -35.26 16.08 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 176.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.703 ' HG3' ' HG ' ' A' ' 13' ' ' LEU . 7.6 mtt180 -67.18 -41.52 85.76 Favored 'General case' 0 N--CA 1.505 2.278 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 177.096 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.408 HG13 ' N ' ' A' ' 20' ' ' GLU . 7.1 p -61.64 -47.36 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.709 0 O-C-N 121.314 -0.866 . . . . 0.0 111.645 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.408 ' N ' HG13 ' A' ' 19' ' ' VAL . 4.8 mt-10 -67.17 -28.33 68.02 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 176.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . 0.469 ' HB3' ' O ' ' A' ' 18' ' ' ARG . 11.8 t90 -70.16 -37.41 75.2 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 176.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.485 HD13 ' HA ' ' A' ' 22' ' ' LEU . 2.2 mm? -71.35 -42.46 68.47 Favored 'General case' 0 N--CA 1.485 1.298 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 -177.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -67.87 -29.47 68.59 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 176.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.11 -8.92 47.45 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.526 -0.733 . . . . 0.0 110.774 178.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.68 -39.11 84.48 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.252 -0.905 . . . . 0.0 109.137 178.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.5 mp -71.71 -33.26 68.62 Favored 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 106.511 -1.663 . . . . 0.0 106.511 175.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.418 ' CB ' ' HB3' ' A' ' 30' ' ' HIS . 17.0 mt-30 -95.95 33.42 1.7 Allowed 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.441 178.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -73.45 110.14 7.51 Favored 'General case' 0 N--CA 1.503 2.193 0 N-CA-C 105.792 -1.929 . . . . 0.0 105.792 178.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.44 HG13 ' CD1' ' A' ' 32' ' ' PHE . 6.4 t 68.96 34.78 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.514 2.731 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 -173.688 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.418 ' HB3' ' CB ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -44.11 92.55 0.01 OUTLIER 'General case' 0 N--CA 1.533 3.714 0 N-CA-C 106.287 -1.746 . . . . 0.0 106.287 175.275 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 21.4 m-80 76.66 -65.62 0.29 Allowed 'General case' 0 N--CA 1.521 3.119 0 N-CA-C 103.061 -2.94 . . . . 0.0 103.061 -171.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.44 ' CD1' HG13 ' A' ' 29' ' ' VAL . 80.7 t80 . . . . . 0 C--O 1.204 -1.328 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 174.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 . . . . . 0 N--CA 1.514 2.757 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 49.7 mt -73.42 -41.68 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 121.083 -1.01 . . . . 0.0 109.701 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -69.37 -44.74 70.94 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.768 -0.582 . . . . 0.0 109.475 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.55 -47.7 84.37 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 122.06 -0.4 . . . . 0.0 110.348 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . 0.505 ' HA ' HD23 ' A' ' 9' ' ' LEU . 0.2 OUTLIER -67.82 -28.46 67.59 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.741 -0.6 . . . . 0.0 110.612 178.792 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 -75.43 -11.11 59.97 Favored 'General case' 0 N--CA 1.511 2.605 0 CA-C-N 118.835 0.743 . . . . 0.0 111.671 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.8 m-80 -98.95 17.38 19.75 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.198 -0.938 . . . . 0.0 111.023 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.505 HD23 ' HA ' ' A' ' 6' ' ' MET . 0.5 OUTLIER -80.51 80.64 6.92 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 120.945 -1.097 . . . . 0.0 111.143 -179.214 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.466 ' O ' HD13 ' A' ' 13' ' ' LEU . . . 70.69 45.6 51.79 Favored Glycine 0 N--CA 1.515 3.917 0 N-CA-C 104.634 -3.387 . . . . 0.0 104.634 -174.353 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.06 31.66 21.52 Favored 'General case' 0 N--CA 1.508 2.447 0 N-CA-C 105.079 -2.193 . . . . 0.0 105.079 -171.538 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.422 ' HB2' ' H ' ' A' ' 9' ' ' LEU . 47.6 t-80 27.0 63.98 0.08 Allowed 'General case' 0 N--CA 1.505 2.278 0 CA-C-O 124.007 1.861 . . . . 0.0 111.121 -175.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.618 HD22 ' N ' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -49.88 -22.94 1.66 Allowed 'General case' 0 CA--C 1.567 1.611 0 CA-C-N 111.921 -2.4 . . . . 0.0 114.396 -179.783 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.531 ' HB3' ' HB2' ' A' ' 17' ' ' GLU . 35.6 t30 130.31 161.86 0.0 OUTLIER 'General case' 1 N--CA 1.544 4.233 0 C-N-CA 125.1 1.36 . . . . 0.0 108.498 -178.992 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 8.0 t -59.8 -54.06 50.67 Favored 'General case' 0 N--CA 1.518 2.972 0 O-C-N 120.742 -1.224 . . . . 0.0 111.277 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -76.18 -18.14 59.22 Favored 'General case' 0 N--CA 1.517 2.908 0 O-C-N 121.41 -0.807 . . . . 0.0 109.801 178.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.531 ' HB2' ' HB3' ' A' ' 14' ' ' ASN . 1.1 mm-40 -77.84 -36.44 50.03 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 176.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.486 ' O ' HD23 ' A' ' 22' ' ' LEU . 0.4 OUTLIER -64.39 -48.28 76.05 Favored 'General case' 0 C--O 1.184 -2.366 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 179.695 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 3.4 p -57.16 -46.93 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.278 0 O-C-N 121.846 -0.534 . . . . 0.0 111.733 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -71.81 -28.41 63.57 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 176.012 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . 0.515 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 14.6 t90 -68.67 -37.06 79.32 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 176.7 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.486 HD23 ' O ' ' A' ' 18' ' ' ARG . 2.8 mm? -72.69 -42.66 64.0 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 -178.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -66.35 -27.35 67.81 Favored 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 177.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.415 ' O ' ' HG3' ' A' ' 27' ' ' GLN . 1.5 mtpp -85.92 -35.11 20.71 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.382 -0.823 . . . . 0.0 110.122 179.151 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -54.73 -41.5 70.44 Favored 'General case' 0 N--CA 1.51 2.529 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -179.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.5 pp -60.82 -34.78 75.07 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 122.054 -0.404 . . . . 0.0 110.321 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.415 ' HG3' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -85.94 -26.14 25.69 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.746 -0.597 . . . . 0.0 110.061 178.726 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -62.51 -51.93 65.48 Favored 'General case' 0 N--CA 1.513 2.712 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 10.9 p -67.13 -23.08 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.323 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 177.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -97.13 50.03 1.07 Allowed 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 176.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -156.9 -49.28 0.07 Allowed 'General case' 0 N--CA 1.505 2.288 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -178.246 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.485 ' O ' ' CG ' ' A' ' 32' ' ' PHE . 1.1 p90 . . . . . 0 N--CA 1.499 1.981 0 CA-C-O 122.412 1.101 . . . . 0.0 110.028 -179.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.507 2.393 0 CA-C-O 121.423 0.63 . . . . 0.0 110.471 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.1 tp -128.82 -38.14 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.506 2.358 0 O-C-N 121.463 -0.773 . . . . 0.0 110.797 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -74.36 -44.26 53.04 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.281 -0.887 . . . . 0.0 109.673 179.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.3 mt -59.79 -53.2 60.78 Favored 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -62.77 -32.65 73.85 Favored 'General case' 0 N--CA 1.512 2.667 0 O-C-N 122.078 -0.389 . . . . 0.0 110.793 179.112 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -60.42 -37.9 82.32 Favored 'General case' 0 N--CA 1.509 2.502 0 O-C-N 121.527 -0.733 . . . . 0.0 110.039 178.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.601 ' HA ' ' CB ' ' A' ' 12' ' ' HIS . 30.2 m-80 -80.53 41.35 0.54 Allowed 'General case' 0 N--CA 1.508 2.464 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -178.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.508 HD22 ' C ' ' A' ' 8' ' ' ASN . 3.0 mm? -123.71 175.4 6.88 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 174.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.443 ' HA3' ' CD1' ' A' ' 21' ' ' TRP . . . 61.64 41.43 99.59 Favored Glycine 1 N--CA 1.521 4.329 1 N-CA-C 102.5 -4.24 . . . . 0.0 102.5 -171.066 . . . . . . . . 4 3 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.9 mtmp? 87.2 -61.65 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 104.699 -2.334 . . . . 0.0 104.699 -170.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.82 ' C ' HD13 ' A' ' 13' ' ' LEU . 0.3 OUTLIER 153.83 -21.37 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.562 0 C-N-CA 126.426 1.891 . . . . 0.0 109.483 -178.107 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.82 HD13 ' C ' ' A' ' 12' ' ' HIS . 0.0 OUTLIER 33.21 -154.57 0.0 OUTLIER 'General case' 0 N--CA 1.515 2.78 0 C-N-CA 125.791 1.636 . . . . 0.0 115.307 176.661 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -172.03 -47.8 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.463 0 O-C-N 120.995 -1.066 . . . . 0.0 113.074 -179.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.645 ' O ' HG12 ' A' ' 19' ' ' VAL . 34.6 p -144.85 -78.91 0.19 Allowed 'General case' 0 N--CA 1.514 2.763 0 CA-C-N 119.794 1.179 . . . . 0.0 110.351 -179.047 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 2.1 mmt -68.29 -23.92 64.8 Favored 'General case' 0 N--CA 1.518 2.971 0 CA-C-N 119.044 0.838 . . . . 0.0 109.645 178.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.684 ' HG3' ' HB2' ' A' ' 13' ' ' LEU . 1.0 OUTLIER -89.59 -23.83 21.86 Favored 'General case' 0 N--CA 1.501 2.115 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 175.542 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.627 ' HG3' HD21 ' A' ' 13' ' ' LEU . 9.1 ttt85 -71.33 -46.3 60.95 Favored 'General case' 0 N--CA 1.51 2.547 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 176.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.645 HG12 ' O ' ' A' ' 15' ' ' SER . 2.2 p -58.86 -47.38 89.62 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.553 0 O-C-N 121.475 -0.766 . . . . 0.0 110.999 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -67.89 -28.58 67.64 Favored 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 176.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . 0.558 ' HB3' ' O ' ' A' ' 18' ' ' ARG . 22.4 t90 -68.46 -38.71 81.34 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 107.853 -1.165 . . . . 0.0 107.853 176.102 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.472 HD13 ' HA ' ' A' ' 22' ' ' LEU . 2.2 mm? -70.34 -42.63 71.61 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 -177.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.94 -32.67 74.07 Favored 'General case' 0 N--CA 1.503 2.19 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 177.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -78.28 -30.22 48.33 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.689 -0.632 . . . . 0.0 110.224 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.6 mmmp? -53.13 -36.95 61.37 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.44 -0.787 . . . . 0.0 111.135 179.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 mp -67.53 -39.8 85.05 Favored 'General case' 0 N--CA 1.507 2.406 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 178.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.403 ' HB3' ' HB2' ' A' ' 30' ' ' HIS . 17.7 mm-40 -97.77 -79.16 0.47 Allowed 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 179.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 65.32 -71.62 0.08 Allowed 'General case' 0 N--CA 1.51 2.562 0 C-N-CA 123.576 0.751 . . . . 0.0 111.087 178.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.677 ' HA ' ' CZ ' ' A' ' 32' ' ' PHE . 4.3 p -66.78 -40.33 85.7 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.167 0 O-C-N 121.603 -0.685 . . . . 0.0 109.269 178.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.403 ' HB2' ' HB3' ' A' ' 27' ' ' GLN . 95.5 m-70 -65.3 -28.61 69.44 Favored 'General case' 0 N--CA 1.504 2.263 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.073 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -61.64 -39.37 91.09 Favored 'General case' 0 N--CA 1.505 2.292 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 176.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.677 ' CZ ' ' HA ' ' A' ' 29' ' ' VAL . 30.3 p90 . . . . . 0 N--CA 1.501 2.091 0 O-C-N 121.729 -0.607 . . . . 0.0 110.335 177.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 . . . . . 0 N--CA 1.513 2.722 0 CA-C-O 121.259 0.552 . . . . 0.0 111.356 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.7 mp -68.35 -42.32 84.17 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.525 0 O-C-N 121.458 -0.776 . . . . 0.0 110.139 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.59 -50.25 73.37 Favored 'General case' 0 N--CA 1.511 2.62 0 O-C-N 121.725 -0.609 . . . . 0.0 111.713 -179.514 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.54 -42.93 81.92 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.552 -0.718 . . . . 0.0 111.018 -178.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 15.9 ptp -65.27 -25.82 67.82 Favored 'General case' 0 N--CA 1.512 2.645 0 CA-C-N 119.04 0.836 . . . . 0.0 110.003 178.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 51.8 t60 -77.12 -41.7 40.89 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 177.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -65.96 -46.91 76.41 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.985 -0.447 . . . . 0.0 110.234 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.457 ' HB3' ' NE ' ' A' ' 18' ' ' ARG . 17.7 mt -89.84 156.0 18.78 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.972 -0.455 . . . . 0.0 110.219 -179.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.55 -50.37 3.2 Favored Glycine 0 N--CA 1.513 3.78 0 N-CA-C 110.283 -1.127 . . . . 0.0 110.283 -179.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.4 ttpm? -57.31 -37.58 72.7 Favored 'General case' 0 N--CA 1.511 2.606 0 CA-C-N 119.179 1.49 . . . . 0.0 107.657 176.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -71.07 -42.28 69.62 Favored 'General case' 0 N--CA 1.497 1.925 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 177.031 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.541 ' CD1' ' HA ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -129.75 -90.8 0.47 Allowed 'General case' 0 N--CA 1.512 2.633 0 CA-C-O 118.51 -0.757 . . . . 0.0 109.906 178.42 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.664 ' HB3' ' CG ' ' A' ' 17' ' ' GLU . 7.9 t30 175.76 -86.62 0.0 OUTLIER 'General case' 0 N--CA 1.515 2.804 0 CA-C-N 120.016 1.28 . . . . 0.0 111.347 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -161.14 -60.57 0.05 Allowed 'General case' 0 N--CA 1.518 2.935 0 O-C-N 121.126 -0.983 . . . . 0.0 109.953 -178.11 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.521 ' HA ' HG12 ' A' ' 19' ' ' VAL . 13.3 tpp -70.71 -39.5 73.4 Favored 'General case' 0 N--CA 1.523 3.195 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 176.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.664 ' CG ' ' HB3' ' A' ' 14' ' ' ASN . 0.9 OUTLIER -62.01 -26.86 68.48 Favored 'General case' 0 N--CA 1.507 2.377 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 175.029 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.541 ' HA ' ' CD1' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -72.65 -48.26 40.83 Favored 'General case' 0 N--CA 1.511 2.581 0 CA-C-N 118.623 0.647 . . . . 0.0 109.914 178.296 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.521 HG12 ' HA ' ' A' ' 16' ' ' MET . 2.6 p -64.96 -41.95 93.47 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.32 0 O-C-N 121.416 -0.803 . . . . 0.0 110.054 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -69.96 -27.31 64.63 Favored 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 174.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . 0.559 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 28.8 t90 -70.97 -37.54 72.76 Favored 'General case' 0 N--CA 1.5 2.066 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 176.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.499 ' HA ' HD13 ' A' ' 22' ' ' LEU . 1.9 mm? -71.82 -43.78 65.04 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 119.768 -0.773 . . . . 0.0 109.258 -177.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -68.11 -38.62 82.47 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 177.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.466 ' HA ' ' HG2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -73.92 -23.18 59.5 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 121.786 -0.571 . . . . 0.0 110.705 179.753 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.39 -38.41 80.46 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.529 -0.732 . . . . 0.0 110.712 179.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.8 mp -70.22 -41.97 72.91 Favored 'General case' 0 N--CA 1.505 2.317 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 178.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.466 ' HG2' ' HA ' ' A' ' 24' ' ' LYS . 0.8 OUTLIER -102.73 44.35 1.02 Allowed 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.235 0.541 . . . . 0.0 109.702 178.699 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.07 -51.88 58.93 Favored 'General case' 0 N--CA 1.506 2.373 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.1 m -99.75 48.87 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.243 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 177.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.402 ' HB2' ' HB2' ' A' ' 27' ' ' GLN . 57.3 m80 -141.17 -52.69 0.46 Allowed 'General case' 0 N--CA 1.506 2.355 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -57.13 -32.5 66.41 Favored 'General case' 0 N--CA 1.511 2.592 0 C-N-CA 122.637 0.375 . . . . 0.0 110.681 177.488 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.424 ' CD1' ' C ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.159 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -179.062 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.51 2.557 0 CA-C-O 119.842 -0.123 . . . . 0.0 111.073 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.4 tt -66.47 -38.7 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 121.784 -0.572 . . . . 0.0 109.523 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.0 -41.75 77.37 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.573 -0.704 . . . . 0.0 109.119 178.159 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 11.9 mt -61.86 -50.88 70.48 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 122.084 -0.385 . . . . 0.0 110.271 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 15.0 ptt? -66.21 -27.36 67.92 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.84 -0.537 . . . . 0.0 111.079 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -77.95 -37.45 47.53 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.371 -0.831 . . . . 0.0 109.433 178.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -66.06 -47.69 73.47 Favored 'General case' 0 N--CA 1.51 2.55 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.608 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 21.1 mt -73.11 -41.84 63.58 Favored 'General case' 0 N--CA 1.507 2.411 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 178.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -67.69 -12.34 61.68 Favored Glycine 0 N--CA 1.504 3.17 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 177.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -57.91 -30.52 65.97 Favored 'General case' 0 N--CA 1.507 2.425 0 CA-C-N 119.592 1.696 . . . . 0.0 107.272 175.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -71.7 -46.62 58.17 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 108.069 -1.085 . . . . 0.0 108.069 176.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.619 HD21 ' HA ' ' A' ' 18' ' ' ARG . 2.0 pt? -132.9 -56.06 0.93 Allowed 'General case' 0 N--CA 1.514 2.75 0 CA-C-N 119.273 0.942 . . . . 0.0 111.953 178.281 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.496 ' N ' ' HG ' ' A' ' 13' ' ' LEU . 2.8 t30 176.34 160.95 0.34 Allowed 'General case' 0 N--CA 1.523 3.223 0 CA-C-N 119.829 1.195 . . . . 0.0 110.604 178.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 43.3 m -68.46 -52.69 29.75 Favored 'General case' 0 N--CA 1.514 2.731 0 O-C-N 121.345 -0.847 . . . . 0.0 111.163 -179.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 4.9 ttp -92.05 -6.81 50.34 Favored 'General case' 0 N--CA 1.516 2.838 0 O-C-N 121.567 -0.708 . . . . 0.0 110.821 179.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.428 ' CG ' ' HB3' ' A' ' 14' ' ' ASN . 9.8 mm-40 -95.63 -28.53 14.78 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.152 -0.968 . . . . 0.0 108.67 178.029 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.619 ' HA ' HD21 ' A' ' 13' ' ' LEU . 0.5 OUTLIER -64.44 -52.35 58.5 Favored 'General case' 0 C--O 1.178 -2.705 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 177.232 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 1.2 p -48.25 -50.45 11.34 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.616 0 C-N-CA 123.45 0.7 . . . . 0.0 111.983 178.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -65.58 -33.06 75.02 Favored 'General case' 0 C--N 1.296 -1.732 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 176.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . 0.586 ' HB2' HD11 ' A' ' 13' ' ' LEU . 5.0 t90 -69.16 -35.85 76.75 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.304 177.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.544 HD21 ' HG3' ' A' ' 18' ' ' ARG . 4.9 mt -73.28 -43.21 61.41 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 -177.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -69.22 -28.55 66.46 Favored 'General case' 0 N--CA 1.5 2.03 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 177.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -90.96 -20.66 21.92 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.65 -0.657 . . . . 0.0 111.222 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.14 -35.72 77.84 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.724 -0.61 . . . . 0.0 111.388 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 mp -60.89 -31.79 71.27 Favored 'General case' 0 N--CA 1.506 2.358 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 177.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.41 ' HB3' ' CD2' ' A' ' 30' ' ' HIS . 0.0 OUTLIER -89.77 -77.38 0.39 Allowed 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.646 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.586 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.1 OUTLIER 46.14 34.34 2.07 Favored 'General case' 0 N--CA 1.525 3.277 0 CA-C-O 122.342 1.067 . . . . 0.0 109.685 -178.145 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.639 HG22 ' O ' ' A' ' 32' ' ' PHE . 0.9 OUTLIER -178.89 -47.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.473 0 N-CA-C 104.957 -2.238 . . . . 0.0 104.957 -176.676 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.43 ' ND1' ' C ' ' A' ' 29' ' ' VAL . 0.0 OUTLIER 44.05 45.28 6.64 Favored 'General case' 0 N--CA 1.521 3.109 0 CA-C-N 118.846 0.748 . . . . 0.0 109.781 175.668 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 78.01 24.15 0.71 Allowed 'General case' 0 N--CA 1.517 2.896 0 C-N-CA 123.476 0.711 . . . . 0.0 110.499 -178.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.639 ' O ' HG22 ' A' ' 29' ' ' VAL . 39.0 p90 . . . . . 0 N--CA 1.51 2.529 0 O-C-N 121.384 -0.822 . . . . 0.0 109.544 178.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.473 ' HA ' HD21 ' A' ' 5' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.507 2.403 0 CA-C-O 119.79 -0.148 . . . . 0.0 111.258 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.9 tt -63.84 -21.92 29.81 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.641 0 O-C-N 121.19 -0.944 . . . . 0.0 111.206 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -82.28 -55.0 4.79 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.282 -0.886 . . . . 0.0 108.988 178.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.473 HD21 ' HA ' ' A' ' 2' ' ' GLU . 2.3 pp -60.6 -34.67 74.56 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 122.055 -0.403 . . . . 0.0 110.457 179.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . 0.502 ' HA ' HD23 ' A' ' 9' ' ' LEU . 21.5 mmt -62.99 -40.86 99.02 Favored 'General case' 0 N--CA 1.513 2.682 0 O-C-N 121.657 -0.652 . . . . 0.0 109.276 178.295 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -62.9 -33.71 75.88 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.849 -0.532 . . . . 0.0 110.002 178.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -64.24 -26.91 68.72 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.805 -0.559 . . . . 0.0 111.232 179.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.506 ' HA ' HD13 ' A' ' 9' ' ' LEU . 2.0 mm? -61.5 -43.71 98.37 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.229 -0.92 . . . . 0.0 111.15 -179.436 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -72.2 -4.79 60.81 Favored Glycine 0 N--CA 1.513 3.776 0 C-N-CA 120.997 -0.62 . . . . 0.0 112.333 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.477 ' HG3' ' CH2' ' A' ' 21' ' ' TRP . 0.0 OUTLIER -117.3 -32.18 5.05 Favored 'General case' 0 N--CA 1.51 2.525 0 CA-C-N 119.232 1.516 . . . . 0.0 110.454 178.869 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.937 ' C ' HD22 ' A' ' 13' ' ' LEU . 10.6 m-70 -99.24 -23.96 15.01 Favored 'General case' 0 N--CA 1.512 2.657 0 O-C-N 121.467 -0.77 . . . . 0.0 110.918 -179.533 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.937 HD22 ' C ' ' A' ' 12' ' ' HIS . 0.0 OUTLIER 22.25 -100.8 0.01 OUTLIER 'General case' 0 N--CA 1.52 3.056 0 C-N-CA 125.246 1.418 . . . . 0.0 114.574 179.322 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.54 ' HB3' ' CG ' ' A' ' 17' ' ' GLU . 2.4 t30 -164.09 -80.07 0.03 OUTLIER 'General case' 0 N--CA 1.515 2.814 0 CA-C-N 121.393 1.906 . . . . 0.0 114.642 -176.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 54.7 m -146.04 -66.61 0.29 Allowed 'General case' 0 N--CA 1.525 3.322 0 CA-C-N 120.028 1.285 . . . . 0.0 110.149 -176.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.53 ' HA ' HG12 ' A' ' 19' ' ' VAL . 6.6 mtp -73.98 -37.49 64.46 Favored 'General case' 0 N--CA 1.52 3.05 0 N-CA-C 105.59 -2.004 . . . . 0.0 105.59 175.529 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.54 ' CG ' ' HB3' ' A' ' 14' ' ' ASN . 1.3 pm0 -70.64 -21.69 62.6 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 173.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.935 ' HG2' HD23 ' A' ' 13' ' ' LEU . 0.0 OUTLIER -81.67 -22.25 37.61 Favored 'General case' 0 N--CA 1.519 3.019 0 CA-C-N 118.76 0.709 . . . . 0.0 110.974 176.871 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.53 HG12 ' HA ' ' A' ' 16' ' ' MET . 6.1 p -88.03 -40.74 13.85 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.686 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 176.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -71.62 -20.99 61.9 Favored 'General case' 0 C--N 1.308 -1.231 0 N-CA-C 106.843 -1.539 . . . . 0.0 106.843 172.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . 0.66 ' HB3' ' HA ' ' A' ' 18' ' ' ARG . 0.2 OUTLIER -61.0 -36.67 80.11 Favored 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 105.611 -1.996 . . . . 0.0 105.611 174.073 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.561 ' CD2' ' CD1' ' A' ' 21' ' ' TRP . 4.1 mm? -80.52 -30.78 37.21 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 118.032 -1.467 . . . . 0.0 109.779 179.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 36.9 mtt85 -61.51 -32.74 72.78 Favored 'General case' 0 N--CA 1.504 2.258 0 N-CA-C 107.451 -1.314 . . . . 0.0 107.451 174.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.79 -23.37 27.25 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 122.046 -0.409 . . . . 0.0 110.283 178.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.545 ' HG2' ' CZ3' ' A' ' 21' ' ' TRP . 0.1 OUTLIER -56.03 -47.46 77.8 Favored 'General case' 0 N--CA 1.513 2.708 0 CA-C-N 119.008 0.822 . . . . 0.0 109.218 179.032 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -69.89 -30.15 67.52 Favored 'General case' 0 N--CA 1.505 2.29 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 177.023 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -96.94 42.03 1.1 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.74 -0.6 . . . . 0.0 110.236 178.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.47 -58.88 1.83 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.175 -0.953 . . . . 0.0 108.772 178.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.0 t -118.54 -16.06 8.11 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.958 0 CA-C-O 117.389 -1.291 . . . . 0.0 112.28 179.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.441 ' CG ' ' H ' ' A' ' 31' ' ' ASN . 6.5 p-80 -20.18 -51.51 0.01 OUTLIER 'General case' 1 N--CA 1.54 4.026 0 C-N-CA 124.721 1.209 . . . . 0.0 110.346 173.654 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.441 ' H ' ' CG ' ' A' ' 30' ' ' HIS . 0.1 OUTLIER -156.0 27.09 0.37 Allowed 'General case' 0 CA--C 1.579 2.095 0 C-N-CA 125.252 1.421 . . . . 0.0 107.47 174.179 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.537 3.907 0 C-N-CA 125.277 1.431 . . . . 0.0 112.578 178.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 . . . . . 0 N--CA 1.509 2.482 0 N-CA-C 110.352 -0.24 . . . . 0.0 110.352 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.402 HG23 ' HE2' ' A' ' 6' ' ' MET . 41.6 mm -55.94 -41.17 66.47 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.774 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -67.86 -42.72 80.9 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.725 -0.609 . . . . 0.0 109.479 178.303 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.9 mt -57.36 -52.06 66.87 Favored 'General case' 0 N--CA 1.505 2.292 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 179.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . 0.402 ' HE2' HG23 ' A' ' 3' ' ' ILE . 7.1 ptt? -68.02 -29.89 69.0 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.927 -0.483 . . . . 0.0 110.432 178.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 51.0 t60 -62.63 -29.9 70.96 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.683 -0.636 . . . . 0.0 110.81 179.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.491 ' C ' HD22 ' A' ' 9' ' ' LEU . 26.3 m-80 -86.88 38.11 0.79 Allowed 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.379 -0.826 . . . . 0.0 111.496 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.516 HD13 ' HA ' ' A' ' 9' ' ' LEU . 2.1 mm? -130.38 -63.28 0.9 Allowed 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.074 -1.016 . . . . 0.0 108.61 178.67 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -74.79 -42.67 30.62 Favored Glycine 0 N--CA 1.506 3.348 0 N-CA-C 109.795 -1.322 . . . . 0.0 109.795 179.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -73.59 -32.39 64.09 Favored 'General case' 0 N--CA 1.507 2.382 0 CA-C-N 118.133 0.967 . . . . 0.0 108.836 177.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 58.9 t60 -63.46 -55.37 24.67 Favored 'General case' 0 N--CA 1.504 2.258 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 178.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.633 ' HG ' ' HG3' ' A' ' 18' ' ' ARG . 0.1 OUTLIER -82.09 153.92 25.84 Favored 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 -178.921 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 176.76 151.87 0.18 Allowed 'General case' 0 N--CA 1.512 2.635 0 O-C-N 121.782 -0.574 . . . . 0.0 110.648 -179.279 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 37.0 p 44.09 -83.83 0.01 OUTLIER 'General case' 0 N--CA 1.523 3.224 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 178.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.602 ' HA ' HG12 ' A' ' 19' ' ' VAL . 9.6 tpt -85.45 -33.76 21.81 Favored 'General case' 0 N--CA 1.513 2.685 0 CA-C-N 119.205 0.911 . . . . 0.0 109.979 -179.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.431 ' HB2' ' HA ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -76.75 -31.48 57.13 Favored 'General case' 0 N--CA 1.506 2.35 0 N-CA-C 107.305 -1.369 . . . . 0.0 107.305 177.383 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.633 ' HG3' ' HG ' ' A' ' 13' ' ' LEU . 9.6 mtt-85 -74.57 -41.86 59.77 Favored 'General case' 0 N--CA 1.506 2.329 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 177.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.602 HG12 ' HA ' ' A' ' 16' ' ' MET . 9.1 p -66.02 -43.47 92.52 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.759 0 O-C-N 121.02 -1.05 . . . . 0.0 110.908 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -68.96 -25.46 64.56 Favored 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 176.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . 0.529 ' HB3' ' O ' ' A' ' 18' ' ' ARG . 21.4 t90 -70.2 -38.6 75.36 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 175.248 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.469 ' HA ' HD13 ' A' ' 22' ' ' LEU . 2.1 mm? -72.19 -41.41 67.01 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -178.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 21.1 ttp-105 -68.29 -32.71 73.06 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 177.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.36 -23.8 54.16 Favored 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.451 ' HE3' ' CH2' ' A' ' 21' ' ' TRP . 4.6 mmtp -60.1 -37.56 80.32 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.25 -0.906 . . . . 0.0 108.987 177.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.4 mp -80.5 -36.91 32.66 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 175.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.471 ' C ' ' CE1' ' A' ' 30' ' ' HIS . 1.4 mt-30 -91.81 59.61 3.72 Favored 'General case' 0 N--CA 1.488 1.446 0 CA-C-O 121.551 0.691 . . . . 0.0 110.004 178.411 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -108.47 -37.74 5.88 Favored 'General case' 0 N--CA 1.5 2.065 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.255 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.441 ' O ' ' C ' ' A' ' 30' ' ' HIS . 15.7 m -129.57 -40.39 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.517 2.908 0 CA-C-O 116.218 -1.849 . . . . 0.0 111.085 178.653 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.471 ' CE1' ' C ' ' A' ' 27' ' ' GLN . 4.5 p-80 15.38 -102.12 0.0 OUTLIER 'General case' 1 N--CA 1.554 4.734 0 CA-C-N 121.081 1.764 . . . . 0.0 111.039 176.025 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -78.91 -49.48 12.78 Favored 'General case' 0 N--CA 1.502 2.169 0 N-CA-C 104.595 -2.372 . . . . 0.0 104.595 172.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 76.9 t80 . . . . . 0 N--CA 1.485 1.309 0 C-N-CA 126.028 1.731 . . . . 0.0 109.526 177.819 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.635 ' HB3' ' HB2' ' A' ' 5' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.873 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.7 tt -61.38 -36.87 75.81 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.538 0 O-C-N 122.097 -0.377 . . . . 0.0 111.091 -179.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -69.86 -40.23 75.88 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.527 -0.733 . . . . 0.0 109.547 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.635 ' HB2' ' HB3' ' A' ' 2' ' ' GLU . 0.3 OUTLIER -65.87 -51.38 59.24 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 122.084 -0.385 . . . . 0.0 110.284 -179.994 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 22.3 ptp -65.29 -29.81 70.6 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.77 -0.581 . . . . 0.0 110.616 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 76.1 t60 -74.32 -45.09 49.58 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.503 -0.748 . . . . 0.0 109.225 178.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 -60.53 -41.59 94.77 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.808 -0.557 . . . . 0.0 111.392 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.62 HD22 ' CH2' ' A' ' 21' ' ' TRP . 16.3 mt -88.34 -53.67 4.57 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.848 -0.533 . . . . 0.0 110.363 -178.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.501 ' HA2' HD22 ' A' ' 13' ' ' LEU . . . -57.96 -22.56 48.84 Favored Glycine 0 N--CA 1.514 3.887 0 CA-C-N 118.647 0.658 . . . . 0.0 111.817 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.8 ttpm? -63.69 -28.2 69.74 Favored 'General case' 0 N--CA 1.51 2.541 0 CA-C-N 119.079 1.44 . . . . 0.0 107.976 176.173 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 79.9 m-70 -100.69 -30.86 11.51 Favored 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 122.752 0.421 . . . . 0.0 111.076 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.584 ' HA ' ' HG3' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -139.5 -163.88 1.57 Allowed 'General case' 0 N--CA 1.517 2.921 0 O-C-N 121.248 -0.907 . . . . 0.0 111.746 -178.827 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 178.92 -46.12 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.796 0 O-C-N 120.823 -1.173 . . . . 0.0 112.846 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.476 ' O ' HG12 ' A' ' 19' ' ' VAL . 68.3 m -135.74 -81.1 0.41 Allowed 'General case' 0 N--CA 1.51 2.528 0 CA-C-N 119.596 1.089 . . . . 0.0 109.723 -179.05 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.531 ' HA ' ' CG1' ' A' ' 19' ' ' VAL . 3.8 ttt -74.94 -36.8 62.12 Favored 'General case' 0 N--CA 1.516 2.831 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 177.482 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.584 ' HG3' ' HA ' ' A' ' 13' ' ' LEU . 2.2 pm0 -65.75 -32.61 74.25 Favored 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 176.262 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.573 ' O ' ' HB3' ' A' ' 21' ' ' TRP . 2.1 ttt-85 -74.37 -49.05 24.29 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.889 -0.507 . . . . 0.0 109.889 179.042 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.531 ' CG1' ' HA ' ' A' ' 16' ' ' MET . 3.7 p -59.12 -47.49 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.616 0 O-C-N 121.67 -0.644 . . . . 0.0 111.262 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -65.88 -27.58 68.32 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 175.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . 0.62 ' CH2' HD22 ' A' ' 9' ' ' LEU . 13.1 t90 -67.32 -38.39 84.85 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 107.264 -1.384 . . . . 0.0 107.264 175.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 18' ' ' ARG . 6.0 mt -69.94 -41.9 73.94 Favored 'General case' 0 N--CA 1.494 1.747 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 -179.226 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 -62.65 -31.7 72.62 Favored 'General case' 0 N--CA 1.503 2.219 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.48 -31.86 53.96 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 179.122 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.2 mmtm -63.2 -35.99 82.14 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.677 -0.64 . . . . 0.0 110.084 179.036 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.6 mt -70.01 -35.68 74.53 Favored 'General case' 0 N--CA 1.504 2.275 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 175.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.6 ' HB3' ' CE1' ' A' ' 30' ' ' HIS . 43.7 mt-30 -82.0 -96.42 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 178.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.4 ' O ' ' HA ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER 68.29 -59.54 0.44 Allowed 'General case' 0 N--CA 1.518 2.965 0 C-N-CA 123.911 0.884 . . . . 0.0 113.23 178.779 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.7 m -102.3 -33.35 3.36 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.618 0 CA-C-O 118.256 -0.878 . . . . 0.0 111.522 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.6 ' CE1' ' HB3' ' A' ' 27' ' ' GLN . 7.6 p-80 -21.76 -51.11 0.02 OUTLIER 'General case' 0 N--CA 1.53 3.56 0 C-N-CA 124.717 1.207 . . . . 0.0 111.491 175.48 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.404 ' H ' ' CG ' ' A' ' 30' ' ' HIS . 23.7 m-20 -143.47 12.06 1.72 Allowed 'General case' 0 CA--C 1.586 2.341 0 C-N-CA 124.378 1.071 . . . . 0.0 109.188 177.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.4 ' HA ' ' O ' ' A' ' 28' ' ' ASP . 0.1 OUTLIER . . . . . 1 N--CA 1.541 4.096 0 CA-C-N 119.617 1.099 . . . . 0.0 112.374 178.27 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 . . . . . 0 N--CA 1.509 2.482 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.478 ' O ' ' HB2' ' A' ' 4' ' ' GLN . 2.1 mp -64.08 153.2 7.64 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.802 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 179.117 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.478 ' HB2' ' O ' ' A' ' 3' ' ' ILE . 3.1 mp0 77.76 -58.02 0.48 Allowed 'General case' 0 N--CA 1.524 3.234 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 -177.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.3 mp -60.7 -44.85 96.04 Favored 'General case' 0 N--CA 1.506 2.337 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 176.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.49 -32.35 68.14 Favored 'General case' 0 N--CA 1.502 2.151 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 177.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 58.4 m170 -56.67 -32.43 65.38 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 121.436 -0.79 . . . . 0.0 110.633 179.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.6 m-80 -93.44 -26.94 16.99 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.952 -0.467 . . . . 0.0 111.141 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 13.4 mt -109.65 -68.25 0.93 Allowed 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.323 -0.861 . . . . 0.0 111.397 -178.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -58.63 -49.47 76.86 Favored Glycine 0 N--CA 1.514 3.869 0 CA-C-N 118.592 0.633 . . . . 0.0 111.678 -178.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.4 ttmt -52.54 -45.87 66.52 Favored 'General case' 0 N--CA 1.514 2.759 0 CA-C-N 118.407 1.104 . . . . 0.0 109.742 179.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 77.0 t60 -67.37 -39.08 85.66 Favored 'General case' 0 N--CA 1.505 2.308 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 177.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.69 HD23 ' HA ' ' A' ' 18' ' ' ARG . 7.2 tp -69.01 153.82 43.14 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-O 122.048 0.928 . . . . 0.0 112.212 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.559 ' HB3' ' HG3' ' A' ' 17' ' ' GLU . 0.7 OUTLIER -86.7 166.25 15.45 Favored 'General case' 0 N--CA 1.509 2.503 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.336 179.612 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 47.4 m -55.73 -58.28 8.47 Favored 'General case' 0 N--CA 1.521 3.105 0 O-C-N 121.255 -0.903 . . . . 0.0 112.019 -179.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.62 ' HA ' HG12 ' A' ' 19' ' ' VAL . 2.1 ttt -72.85 -30.04 63.68 Favored 'General case' 0 N--CA 1.518 2.933 0 O-C-N 121.371 -0.83 . . . . 0.0 109.307 178.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.559 ' HG3' ' HB3' ' A' ' 14' ' ' ASN . 2.9 mm-40 -68.85 -25.82 64.84 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 177.088 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.69 ' HA ' HD23 ' A' ' 13' ' ' LEU . 0.2 OUTLIER -77.87 -46.09 22.38 Favored 'General case' 0 C--O 1.186 -2.279 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.307 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.62 HG12 ' HA ' ' A' ' 16' ' ' MET . 7.0 p -62.31 -49.1 85.33 Favored 'Isoleucine or valine' 0 N--CA 1.519 2.985 0 O-C-N 121.446 -0.784 . . . . 0.0 112.335 -178.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.78 -25.99 67.81 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-O 121.552 0.691 . . . . 0.0 109.497 175.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . 0.528 ' HB3' ' O ' ' A' ' 18' ' ' ARG . 21.1 t90 -80.1 -41.83 24.79 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.459 179.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 18' ' ' ARG . 2.2 mt -65.88 -40.26 91.43 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 -177.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -66.47 -41.08 89.57 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 177.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.1 mtmm -65.6 -35.18 80.07 Favored 'General case' 0 N--CA 1.51 2.557 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 177.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.02 -41.38 86.73 Favored 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 178.524 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.8 mt -66.8 -31.75 72.57 Favored 'General case' 0 N--CA 1.505 2.288 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 177.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.511 ' HB3' ' ND1' ' A' ' 30' ' ' HIS . 19.2 mt-30 -69.64 -76.61 0.09 Allowed 'General case' 0 N--CA 1.487 1.39 0 CA-C-O 118.587 -0.72 . . . . 0.0 109.16 178.489 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.5 t70 42.45 85.05 0.02 OUTLIER 'General case' 0 N--CA 1.527 3.4 0 CA-C-N 119.002 0.819 . . . . 0.0 110.344 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.7 t 82.96 -51.86 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.525 3.303 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 -175.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.511 ' ND1' ' HB3' ' A' ' 27' ' ' GLN . 20.8 p-80 28.68 82.36 0.02 OUTLIER 'General case' 0 N--CA 1.525 3.276 0 CA-C-N 119.039 0.836 . . . . 0.0 111.768 175.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 76.74 -52.13 0.58 Allowed 'General case' 0 N--CA 1.527 3.38 0 O-C-N 121.695 -0.628 . . . . 0.0 110.931 -178.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 2.3 t80 . . . . . 0 CA--C 1.541 0.609 0 CA-C-O 122.161 0.982 . . . . 0.0 111.594 -176.986 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SIN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.508 2.45 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 49.7 mm -122.81 -55.08 2.83 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.489 0 O-C-N 121.037 -1.039 . . . . 0.0 109.23 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -72.81 -49.72 28.7 Favored 'General case' 0 N--CA 1.506 2.361 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.6 mp -56.39 -47.88 78.04 Favored 'General case' 0 N--CA 1.507 2.379 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.402 ' HA ' HD23 ' A' ' 9' ' ' LEU . 14.6 mmt -61.55 -42.43 98.81 Favored 'General case' 0 N--CA 1.514 2.739 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 32.4 t60 -64.16 -34.55 78.33 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.838 -0.538 . . . . 0.0 110.146 178.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.4 m-80 -61.0 -27.09 68.06 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.89 -0.506 . . . . 0.0 111.548 179.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.476 HD13 ' HA ' ' A' ' 9' ' ' LEU . 2.7 mm? -62.04 -53.83 50.01 Favored 'General case' 0 N--CA 1.511 2.622 0 CA-C-N 119.031 0.832 . . . . 0.0 109.492 179.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -71.86 -36.29 61.39 Favored Glycine 0 N--CA 1.505 3.256 0 N-CA-C 109.973 -1.251 . . . . 0.0 109.973 178.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.8 -21.38 66.04 Favored 'General case' 0 N--CA 1.507 2.406 0 CA-C-N 117.651 0.726 . . . . 0.0 110.568 178.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 83.7 t60 -81.22 -93.24 0.05 Allowed 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.492 -0.755 . . . . 0.0 109.225 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.546 ' HG ' ' HA ' ' A' ' 18' ' ' ARG . 0.4 OUTLIER 50.31 -155.11 0.12 Allowed 'General case' 0 N--CA 1.514 2.761 0 CA-C-N 119.198 0.908 . . . . 0.0 110.066 -179.261 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.49 ' HB3' ' CG ' ' A' ' 17' ' ' GLU . 10.3 t30 -164.52 79.17 0.37 Allowed 'General case' 0 N--CA 1.503 2.176 0 O-C-N 120.533 -1.354 . . . . 0.0 111.664 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.509 ' O ' HG12 ' A' ' 19' ' ' VAL . 70.7 m 52.0 -78.12 0.01 OUTLIER 'General case' 0 N--CA 1.521 3.085 0 N-CA-C 115.271 1.582 . . . . 0.0 115.271 176.552 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.534 ' HA ' HG12 ' A' ' 19' ' ' VAL . 0.0 OUTLIER -76.65 -49.09 17.05 Favored 'General case' 0 N--CA 1.519 2.991 0 CA-C-N 119.129 0.877 . . . . 0.0 109.138 -178.497 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.566 ' O ' ' HB2' ' A' ' 21' ' ' TRP . 1.1 pm0 -62.09 -25.71 67.86 Favored 'General case' 0 N--CA 1.51 2.537 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 176.202 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.546 ' HA ' ' HG ' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -73.58 -50.49 20.98 Favored 'General case' 0 N--CA 1.501 2.084 0 CA-C-O 121.414 0.626 . . . . 0.0 109.374 177.535 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.534 HG12 ' HA ' ' A' ' 16' ' ' MET . 5.9 p -66.3 -48.53 80.72 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.629 0 O-C-N 121.67 -0.644 . . . . 0.0 112.291 -178.201 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -59.67 -27.18 66.17 Favored 'General case' 0 C--N 1.295 -1.763 0 CA-C-O 121.479 0.657 . . . . 0.0 109.292 176.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . 0.566 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 23.9 t90 -77.96 -44.87 25.51 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 178.472 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.507 HD13 ' HA ' ' A' ' 22' ' ' LEU . 1.7 mm? -64.62 -41.2 96.34 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 -179.106 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.32 -38.47 81.59 Favored 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 177.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.0 mttp -65.53 -34.83 79.17 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 121.864 -0.523 . . . . 0.0 109.885 178.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.487 ' HE3' ' CZ2' ' A' ' 21' ' ' TRP . 0.8 OUTLIER -61.11 -42.14 97.97 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 122.19 -0.319 . . . . 0.0 110.494 179.246 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.1 mp -71.6 -38.29 70.86 Favored 'General case' 0 N--CA 1.505 2.29 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.86 32.29 3.49 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.904 -0.498 . . . . 0.0 110.401 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.41 121.72 14.48 Favored 'General case' 0 N--CA 1.505 2.322 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.3 m 48.32 35.1 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.521 3.114 0 CA-C-O 121.69 0.757 . . . . 0.0 109.856 -176.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 8.9 m80 -133.61 62.16 1.66 Allowed 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -179.45 -52.17 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.441 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 -177.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.663 ' O ' HG23 ' A' ' 33' ' ' VAL . 8.8 p90 -53.64 -41.66 66.98 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.888 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.663 HG23 ' O ' ' A' ' 32' ' ' PHE . 1.4 t 171.84 90.46 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.515 2.818 0 N-CA-C 105.9 -1.889 . . . . 0.0 105.9 179.259 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -176.57 -71.49 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.429 -0.794 . . . . 0.0 109.845 -178.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.504 2.237 0 CA-C-O 117.776 -1.107 . . . . 0.0 110.008 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SIN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 . . . . . 0 N--CA 1.505 2.324 0 CA-C-O 119.201 -0.428 . . . . 0.0 111.124 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 44.1 mt -51.12 -45.81 30.93 Favored 'Isoleucine or valine' 0 N--CA 1.521 3.117 0 CA-C-N 119.111 0.869 . . . . 0.0 109.918 179.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.43 ' HG3' HD12 ' A' ' 5' ' ' LEU . 2.3 pt20 -57.64 -46.48 84.11 Favored 'General case' 0 N--CA 1.517 2.891 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 178.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.43 HD12 ' HG3' ' A' ' 4' ' ' GLN . 0.6 OUTLIER -60.09 -43.03 95.83 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 179.208 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 33.1 mmt -63.32 -38.59 91.74 Favored 'General case' 0 N--CA 1.511 2.621 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.3 m80 -60.36 -39.08 85.91 Favored 'General case' 0 N--CA 1.506 2.357 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 178.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -61.28 -43.61 98.6 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.826 -0.546 . . . . 0.0 109.571 178.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.424 ' HA ' HD13 ' A' ' 9' ' ' LEU . 2.7 mm? -59.39 131.56 51.34 Favored 'General case' 0 N--CA 1.503 2.223 0 CA-C-O 121.221 0.534 . . . . 0.0 109.931 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.605 ' H ' HD22 ' A' ' 13' ' ' LEU . . . 101.46 -47.12 1.21 Allowed Glycine 0 N--CA 1.501 2.996 0 N-CA-C 109.929 -1.268 . . . . 0.0 109.929 -178.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.33 -43.74 10.14 Favored 'General case' 0 N--CA 1.509 2.476 0 CA-C-N 117.948 0.874 . . . . 0.0 109.272 179.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 54.5 t60 -63.98 -57.81 8.59 Favored 'General case' 0 N--CA 1.507 2.375 0 CA-C-O 121.118 0.485 . . . . 0.0 109.932 179.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.703 ' HG ' ' HG3' ' A' ' 18' ' ' ARG . 0.3 OUTLIER -61.81 153.36 28.91 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.079 -177.792 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -172.31 -41.1 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.321 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 15.2 p -139.25 -72.33 0.39 Allowed 'General case' 0 N--CA 1.51 2.559 0 CA-C-N 119.333 0.97 . . . . 0.0 109.737 -179.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -79.42 -20.77 46.73 Favored 'General case' 0 N--CA 1.514 2.746 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 177.692 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.583 ' CG ' ' HA ' ' A' ' 13' ' ' LEU . 1.1 pm0 -89.47 -35.26 16.08 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 176.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.703 ' HG3' ' HG ' ' A' ' 13' ' ' LEU . 7.6 mtt180 -67.18 -41.52 85.76 Favored 'General case' 0 N--CA 1.505 2.278 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 177.096 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.408 HG13 ' N ' ' A' ' 20' ' ' GLU . 7.1 p -61.64 -47.36 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.709 0 O-C-N 121.314 -0.866 . . . . 0.0 111.645 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.408 ' N ' HG13 ' A' ' 19' ' ' VAL . 4.8 mt-10 -67.17 -28.33 68.02 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 176.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . 0.469 ' HB3' ' O ' ' A' ' 18' ' ' ARG . 11.8 t90 -70.16 -37.41 75.2 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 176.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.485 HD13 ' HA ' ' A' ' 22' ' ' LEU . 2.2 mm? -71.35 -42.46 68.47 Favored 'General case' 0 N--CA 1.485 1.298 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 -177.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -67.87 -29.47 68.59 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 176.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.11 -8.92 47.45 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.526 -0.733 . . . . 0.0 110.774 178.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.68 -39.11 84.48 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.252 -0.905 . . . . 0.0 109.137 178.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.5 mp -71.71 -33.26 68.62 Favored 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 106.511 -1.663 . . . . 0.0 106.511 175.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.418 ' CB ' ' HB3' ' A' ' 30' ' ' HIS . 17.0 mt-30 -95.95 33.42 1.7 Allowed 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.441 178.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -73.45 110.14 7.51 Favored 'General case' 0 N--CA 1.503 2.193 0 N-CA-C 105.792 -1.929 . . . . 0.0 105.792 178.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.44 HG13 ' CD1' ' A' ' 32' ' ' PHE . 6.4 t 68.96 34.78 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.514 2.731 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 -173.688 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.582 ' CE1' ' HB2' ' A' ' 34' ' ' ALA . 0.0 OUTLIER -44.11 92.55 0.01 OUTLIER 'General case' 0 N--CA 1.533 3.714 0 N-CA-C 106.287 -1.746 . . . . 0.0 106.287 175.275 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 21.4 m-80 76.66 -65.62 0.29 Allowed 'General case' 0 N--CA 1.521 3.119 0 N-CA-C 103.061 -2.94 . . . . 0.0 103.061 -171.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.44 ' CD1' HG13 ' A' ' 29' ' ' VAL . 80.7 t80 -180.0 -94.77 0.0 OUTLIER 'General case' 0 C--O 1.204 -1.328 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 174.032 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.51 HG23 ' CE1' ' A' ' 30' ' ' HIS . 16.8 m 24.18 48.36 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.532 3.647 0 C-N-CA 124.968 1.307 . . . . 0.0 112.715 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.582 ' HB2' ' CE1' ' A' ' 30' ' ' HIS . . . -149.35 23.2 0.92 Allowed 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.556 -0.715 . . . . 0.0 112.129 -177.322 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.508 2.429 0 CA-C-O 117.633 -1.175 . . . . 0.0 110.195 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SIN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 . . . . . 0 N--CA 1.514 2.757 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 49.7 mt -73.42 -41.68 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 121.083 -1.01 . . . . 0.0 109.701 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -69.37 -44.74 70.94 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.768 -0.582 . . . . 0.0 109.475 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.55 -47.7 84.37 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 122.06 -0.4 . . . . 0.0 110.348 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.505 ' HA ' HD23 ' A' ' 9' ' ' LEU . 0.2 OUTLIER -67.82 -28.46 67.59 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.741 -0.6 . . . . 0.0 110.612 178.792 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 -75.43 -11.11 59.97 Favored 'General case' 0 N--CA 1.511 2.605 0 CA-C-N 118.835 0.743 . . . . 0.0 111.671 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.8 m-80 -98.95 17.38 19.75 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.198 -0.938 . . . . 0.0 111.023 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.505 HD23 ' HA ' ' A' ' 6' ' ' MET . 0.5 OUTLIER -80.51 80.64 6.92 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 120.945 -1.097 . . . . 0.0 111.143 -179.214 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.466 ' O ' HD13 ' A' ' 13' ' ' LEU . . . 70.69 45.6 51.79 Favored Glycine 0 N--CA 1.515 3.917 0 N-CA-C 104.634 -3.387 . . . . 0.0 104.634 -174.353 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.06 31.66 21.52 Favored 'General case' 0 N--CA 1.508 2.447 0 N-CA-C 105.079 -2.193 . . . . 0.0 105.079 -171.538 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.422 ' HB2' ' H ' ' A' ' 9' ' ' LEU . 47.6 t-80 27.0 63.98 0.08 Allowed 'General case' 0 N--CA 1.505 2.278 0 CA-C-O 124.007 1.861 . . . . 0.0 111.121 -175.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.618 HD22 ' N ' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -49.88 -22.94 1.66 Allowed 'General case' 0 CA--C 1.567 1.611 0 CA-C-N 111.921 -2.4 . . . . 0.0 114.396 -179.783 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.531 ' HB3' ' HB2' ' A' ' 17' ' ' GLU . 35.6 t30 130.31 161.86 0.0 OUTLIER 'General case' 1 N--CA 1.544 4.233 0 C-N-CA 125.1 1.36 . . . . 0.0 108.498 -178.992 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 8.0 t -59.8 -54.06 50.67 Favored 'General case' 0 N--CA 1.518 2.972 0 O-C-N 120.742 -1.224 . . . . 0.0 111.277 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -76.18 -18.14 59.22 Favored 'General case' 0 N--CA 1.517 2.908 0 O-C-N 121.41 -0.807 . . . . 0.0 109.801 178.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.531 ' HB2' ' HB3' ' A' ' 14' ' ' ASN . 1.1 mm-40 -77.84 -36.44 50.03 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 176.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.486 ' O ' HD23 ' A' ' 22' ' ' LEU . 0.4 OUTLIER -64.39 -48.28 76.05 Favored 'General case' 0 C--O 1.184 -2.366 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 179.695 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 3.4 p -57.16 -46.93 84.76 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.278 0 O-C-N 121.846 -0.534 . . . . 0.0 111.733 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -71.81 -28.41 63.57 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 176.012 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . 0.515 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 14.6 t90 -68.67 -37.06 79.32 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 176.7 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.486 HD23 ' O ' ' A' ' 18' ' ' ARG . 2.8 mm? -72.69 -42.66 64.0 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 -178.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -66.35 -27.35 67.81 Favored 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 177.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.415 ' O ' ' HG3' ' A' ' 27' ' ' GLN . 1.5 mtpp -85.92 -35.11 20.71 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 121.382 -0.823 . . . . 0.0 110.122 179.151 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -54.73 -41.5 70.44 Favored 'General case' 0 N--CA 1.51 2.529 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -179.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.5 pp -60.82 -34.78 75.07 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 122.054 -0.404 . . . . 0.0 110.321 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.415 ' HG3' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -85.94 -26.14 25.69 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.746 -0.597 . . . . 0.0 110.061 178.726 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -62.51 -51.93 65.48 Favored 'General case' 0 N--CA 1.513 2.712 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 10.9 p -67.13 -23.08 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.323 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 177.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -97.13 50.03 1.07 Allowed 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 107.736 -1.209 . . . . 0.0 107.736 176.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -156.9 -49.28 0.07 Allowed 'General case' 0 N--CA 1.505 2.288 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -178.246 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.485 ' O ' ' CG ' ' A' ' 32' ' ' PHE . 1.1 p90 -67.08 81.0 0.12 Allowed 'General case' 0 N--CA 1.499 1.981 0 CA-C-O 122.412 1.101 . . . . 0.0 110.028 -179.132 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 31.4 m 42.4 47.1 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.524 3.238 0 O-C-N 121.225 -0.922 . . . . 0.0 110.989 -178.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -86.3 87.86 7.51 Favored 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.492 0.663 . . . . 0.0 109.244 -179.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.5 mp . . . . . 0 N--CA 1.504 2.264 0 CA-C-O 118.712 -0.661 . . . . 0.0 109.867 -179.491 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SIN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.507 2.393 0 CA-C-O 121.423 0.63 . . . . 0.0 110.471 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.1 tp -128.82 -38.14 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.506 2.358 0 O-C-N 121.463 -0.773 . . . . 0.0 110.797 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -74.36 -44.26 53.04 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.281 -0.887 . . . . 0.0 109.673 179.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.3 mt -59.79 -53.2 60.78 Favored 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -62.77 -32.65 73.85 Favored 'General case' 0 N--CA 1.512 2.667 0 O-C-N 122.078 -0.389 . . . . 0.0 110.793 179.112 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -60.42 -37.9 82.32 Favored 'General case' 0 N--CA 1.509 2.502 0 O-C-N 121.527 -0.733 . . . . 0.0 110.039 178.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.601 ' HA ' ' CB ' ' A' ' 12' ' ' HIS . 30.2 m-80 -80.53 41.35 0.54 Allowed 'General case' 0 N--CA 1.508 2.464 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -178.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.508 HD22 ' C ' ' A' ' 8' ' ' ASN . 3.0 mm? -123.71 175.4 6.88 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 174.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.443 ' HA3' ' CD1' ' A' ' 21' ' ' TRP . . . 61.64 41.43 99.59 Favored Glycine 1 N--CA 1.521 4.329 1 N-CA-C 102.5 -4.24 . . . . 0.0 102.5 -171.066 . . . . . . . . 4 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.9 mtmp? 87.2 -61.65 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 104.699 -2.334 . . . . 0.0 104.699 -170.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.82 ' C ' HD13 ' A' ' 13' ' ' LEU . 0.3 OUTLIER 153.83 -21.37 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.562 0 C-N-CA 126.426 1.891 . . . . 0.0 109.483 -178.107 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.82 HD13 ' C ' ' A' ' 12' ' ' HIS . 0.0 OUTLIER 33.21 -154.57 0.0 OUTLIER 'General case' 0 N--CA 1.515 2.78 0 C-N-CA 125.791 1.636 . . . . 0.0 115.307 176.661 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -172.03 -47.8 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.463 0 O-C-N 120.995 -1.066 . . . . 0.0 113.074 -179.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.645 ' O ' HG12 ' A' ' 19' ' ' VAL . 34.6 p -144.85 -78.91 0.19 Allowed 'General case' 0 N--CA 1.514 2.763 0 CA-C-N 119.794 1.179 . . . . 0.0 110.351 -179.047 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 2.1 mmt -68.29 -23.92 64.8 Favored 'General case' 0 N--CA 1.518 2.971 0 CA-C-N 119.044 0.838 . . . . 0.0 109.645 178.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.684 ' HG3' ' HB2' ' A' ' 13' ' ' LEU . 1.0 OUTLIER -89.59 -23.83 21.86 Favored 'General case' 0 N--CA 1.501 2.115 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 175.542 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.627 ' HG3' HD21 ' A' ' 13' ' ' LEU . 9.1 ttt85 -71.33 -46.3 60.95 Favored 'General case' 0 N--CA 1.51 2.547 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 176.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.645 HG12 ' O ' ' A' ' 15' ' ' SER . 2.2 p -58.86 -47.38 89.62 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.553 0 O-C-N 121.475 -0.766 . . . . 0.0 110.999 179.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -67.89 -28.58 67.64 Favored 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 176.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . 0.558 ' HB3' ' O ' ' A' ' 18' ' ' ARG . 22.4 t90 -68.46 -38.71 81.34 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 107.853 -1.165 . . . . 0.0 107.853 176.102 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.472 HD13 ' HA ' ' A' ' 22' ' ' LEU . 2.2 mm? -70.34 -42.63 71.61 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 -177.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.94 -32.67 74.07 Favored 'General case' 0 N--CA 1.503 2.19 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 177.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -78.28 -30.22 48.33 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.689 -0.632 . . . . 0.0 110.224 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.6 mmmp? -53.13 -36.95 61.37 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.44 -0.787 . . . . 0.0 111.135 179.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 mp -67.53 -39.8 85.05 Favored 'General case' 0 N--CA 1.507 2.406 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 178.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.403 ' HB3' ' HB2' ' A' ' 30' ' ' HIS . 17.7 mm-40 -97.77 -79.16 0.47 Allowed 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 179.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 65.32 -71.62 0.08 Allowed 'General case' 0 N--CA 1.51 2.562 0 C-N-CA 123.576 0.751 . . . . 0.0 111.087 178.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.806 HG22 ' HB2' ' A' ' 34' ' ' ALA . 4.3 p -66.78 -40.33 85.7 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.167 0 O-C-N 121.603 -0.685 . . . . 0.0 109.269 178.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.403 ' HB2' ' HB3' ' A' ' 27' ' ' GLN . 95.5 m-70 -65.3 -28.61 69.44 Favored 'General case' 0 N--CA 1.504 2.263 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.073 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -61.64 -39.37 91.09 Favored 'General case' 0 N--CA 1.505 2.292 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 176.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.677 ' CZ ' ' HA ' ' A' ' 29' ' ' VAL . 30.3 p90 -99.33 38.17 1.45 Allowed 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.729 -0.607 . . . . 0.0 110.335 177.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.454 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 38.5 t 74.08 -63.6 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.516 2.833 0 C-N-CA 123.455 0.702 . . . . 0.0 110.382 179.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.806 ' HB2' HG22 ' A' ' 29' ' ' VAL . . . 77.57 -62.51 0.38 Allowed 'General case' 0 N--CA 1.512 2.671 0 C-N-CA 123.133 0.573 . . . . 0.0 110.081 -179.275 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.502 2.144 0 CA-C-O 118.767 -0.635 . . . . 0.0 109.579 179.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SIN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 . . . . . 0 N--CA 1.513 2.722 0 CA-C-O 121.259 0.552 . . . . 0.0 111.356 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.7 mp -68.35 -42.32 84.17 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.525 0 O-C-N 121.458 -0.776 . . . . 0.0 110.139 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.59 -50.25 73.37 Favored 'General case' 0 N--CA 1.511 2.62 0 O-C-N 121.725 -0.609 . . . . 0.0 111.713 -179.514 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.54 -42.93 81.92 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.552 -0.718 . . . . 0.0 111.018 -178.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 15.9 ptp -65.27 -25.82 67.82 Favored 'General case' 0 N--CA 1.512 2.645 0 CA-C-N 119.04 0.836 . . . . 0.0 110.003 178.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 51.8 t60 -77.12 -41.7 40.89 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 177.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -65.96 -46.91 76.41 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.985 -0.447 . . . . 0.0 110.234 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.457 ' HB3' ' NE ' ' A' ' 18' ' ' ARG . 17.7 mt -89.84 156.0 18.78 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.972 -0.455 . . . . 0.0 110.219 -179.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.55 -50.37 3.2 Favored Glycine 0 N--CA 1.513 3.78 0 N-CA-C 110.283 -1.127 . . . . 0.0 110.283 -179.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.4 ttpm? -57.31 -37.58 72.7 Favored 'General case' 0 N--CA 1.511 2.606 0 CA-C-N 119.179 1.49 . . . . 0.0 107.657 176.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -71.07 -42.28 69.62 Favored 'General case' 0 N--CA 1.497 1.925 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 177.031 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.541 ' CD1' ' HA ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -129.75 -90.8 0.47 Allowed 'General case' 0 N--CA 1.512 2.633 0 CA-C-O 118.51 -0.757 . . . . 0.0 109.906 178.42 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.664 ' HB3' ' CG ' ' A' ' 17' ' ' GLU . 7.9 t30 175.76 -86.62 0.0 OUTLIER 'General case' 0 N--CA 1.515 2.804 0 CA-C-N 120.016 1.28 . . . . 0.0 111.347 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -161.14 -60.57 0.05 Allowed 'General case' 0 N--CA 1.518 2.935 0 O-C-N 121.126 -0.983 . . . . 0.0 109.953 -178.11 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.521 ' HA ' HG12 ' A' ' 19' ' ' VAL . 13.3 tpp -70.71 -39.5 73.4 Favored 'General case' 0 N--CA 1.523 3.195 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 176.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.664 ' CG ' ' HB3' ' A' ' 14' ' ' ASN . 0.9 OUTLIER -62.01 -26.86 68.48 Favored 'General case' 0 N--CA 1.507 2.377 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 175.029 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.541 ' HA ' ' CD1' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -72.65 -48.26 40.83 Favored 'General case' 0 N--CA 1.511 2.581 0 CA-C-N 118.623 0.647 . . . . 0.0 109.914 178.296 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.521 HG12 ' HA ' ' A' ' 16' ' ' MET . 2.6 p -64.96 -41.95 93.47 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.32 0 O-C-N 121.416 -0.803 . . . . 0.0 110.054 179.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -69.96 -27.31 64.63 Favored 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 174.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . 0.559 ' HB2' ' O ' ' A' ' 17' ' ' GLU . 28.8 t90 -70.97 -37.54 72.76 Favored 'General case' 0 N--CA 1.5 2.066 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 176.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.499 ' HA ' HD13 ' A' ' 22' ' ' LEU . 1.9 mm? -71.82 -43.78 65.04 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 119.768 -0.773 . . . . 0.0 109.258 -177.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -68.11 -38.62 82.47 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 177.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.466 ' HA ' ' HG2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -73.92 -23.18 59.5 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 121.786 -0.571 . . . . 0.0 110.705 179.753 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.39 -38.41 80.46 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.529 -0.732 . . . . 0.0 110.712 179.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.8 mp -70.22 -41.97 72.91 Favored 'General case' 0 N--CA 1.505 2.317 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 178.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.466 ' HG2' ' HA ' ' A' ' 24' ' ' LYS . 0.8 OUTLIER -102.73 44.35 1.02 Allowed 'General case' 0 N--CA 1.498 1.968 0 CA-C-O 121.235 0.541 . . . . 0.0 109.702 178.699 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.07 -51.88 58.93 Favored 'General case' 0 N--CA 1.506 2.373 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.437 ' O ' ' HB2' ' A' ' 34' ' ' ALA . 16.1 m -99.75 48.87 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.243 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 177.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.402 ' HB2' ' HB2' ' A' ' 27' ' ' GLN . 57.3 m80 -141.17 -52.69 0.46 Allowed 'General case' 0 N--CA 1.506 2.355 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -57.13 -32.5 66.41 Favored 'General case' 0 N--CA 1.511 2.592 0 C-N-CA 122.637 0.375 . . . . 0.0 110.681 177.488 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.552 ' HE1' ' HB2' ' A' ' 34' ' ' ALA . 0.0 OUTLIER -80.19 21.79 0.57 Allowed 'General case' 0 N--CA 1.502 2.159 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -179.062 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 21.2 t 69.28 80.94 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.5 0 O-C-N 121.354 -0.841 . . . . 0.0 108.84 -179.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.552 ' HB2' ' HE1' ' A' ' 32' ' ' PHE . . . -91.83 -50.49 5.7 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.854 -0.529 . . . . 0.0 109.641 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.0 tp . . . . . 0 N--CA 1.501 2.107 0 CA-C-O 118.735 -0.65 . . . . 0.0 109.808 179.614 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SIN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.51 2.557 0 CA-C-O 119.842 -0.123 . . . . 0.0 111.073 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 2.4 tt -66.47 -38.7 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 121.784 -0.572 . . . . 0.0 109.523 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.0 -41.75 77.37 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.573 -0.704 . . . . 0.0 109.119 178.159 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 11.9 mt -61.86 -50.88 70.48 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 122.084 -0.385 . . . . 0.0 110.271 179.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 15.0 ptt? -66.21 -27.36 67.92 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.84 -0.537 . . . . 0.0 111.079 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -77.95 -37.45 47.53 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.371 -0.831 . . . . 0.0 109.433 178.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -66.06 -47.69 73.47 Favored 'General case' 0 N--CA 1.51 2.55 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.608 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 21.1 mt -73.11 -41.84 63.58 Favored 'General case' 0 N--CA 1.507 2.411 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 178.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -67.69 -12.34 61.68 Favored Glycine 0 N--CA 1.504 3.17 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 177.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -57.91 -30.52 65.97 Favored 'General case' 0 N--CA 1.507 2.425 0 CA-C-N 119.592 1.696 . . . . 0.0 107.272 175.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -71.7 -46.62 58.17 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 108.069 -1.085 . . . . 0.0 108.069 176.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.619 HD21 ' HA ' ' A' ' 18' ' ' ARG . 2.0 pt? -132.9 -56.06 0.93 Allowed 'General case' 0 N--CA 1.514 2.75 0 CA-C-N 119.273 0.942 . . . . 0.0 111.953 178.281 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.496 ' N ' ' HG ' ' A' ' 13' ' ' LEU . 2.8 t30 176.34 160.95 0.34 Allowed 'General case' 0 N--CA 1.523 3.223 0 CA-C-N 119.829 1.195 . . . . 0.0 110.604 178.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 43.3 m -68.46 -52.69 29.75 Favored 'General case' 0 N--CA 1.514 2.731 0 O-C-N 121.345 -0.847 . . . . 0.0 111.163 -179.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 4.9 ttp -92.05 -6.81 50.34 Favored 'General case' 0 N--CA 1.516 2.838 0 O-C-N 121.567 -0.708 . . . . 0.0 110.821 179.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.428 ' CG ' ' HB3' ' A' ' 14' ' ' ASN . 9.8 mm-40 -95.63 -28.53 14.78 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.152 -0.968 . . . . 0.0 108.67 178.029 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.619 ' HA ' HD21 ' A' ' 13' ' ' LEU . 0.5 OUTLIER -64.44 -52.35 58.5 Favored 'General case' 0 C--O 1.178 -2.705 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 177.232 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 1.2 p -48.25 -50.45 11.34 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.616 0 C-N-CA 123.45 0.7 . . . . 0.0 111.983 178.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -65.58 -33.06 75.02 Favored 'General case' 0 C--N 1.296 -1.732 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 176.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . 0.586 ' HB2' HD11 ' A' ' 13' ' ' LEU . 5.0 t90 -69.16 -35.85 76.75 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.304 177.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.544 HD21 ' HG3' ' A' ' 18' ' ' ARG . 4.9 mt -73.28 -43.21 61.41 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 -177.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -69.22 -28.55 66.46 Favored 'General case' 0 N--CA 1.5 2.03 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 177.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -90.96 -20.66 21.92 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.65 -0.657 . . . . 0.0 111.222 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.14 -35.72 77.84 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 121.724 -0.61 . . . . 0.0 111.388 -179.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 mp -60.89 -31.79 71.27 Favored 'General case' 0 N--CA 1.506 2.358 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 177.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.41 ' HB3' ' CD2' ' A' ' 30' ' ' HIS . 0.0 OUTLIER -89.77 -77.38 0.39 Allowed 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.646 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.586 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.1 OUTLIER 46.14 34.34 2.07 Favored 'General case' 0 N--CA 1.525 3.277 0 CA-C-O 122.342 1.067 . . . . 0.0 109.685 -178.145 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.639 HG22 ' O ' ' A' ' 32' ' ' PHE . 0.9 OUTLIER -178.89 -47.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.473 0 N-CA-C 104.957 -2.238 . . . . 0.0 104.957 -176.676 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.97 ' HE1' ' HB3' ' A' ' 34' ' ' ALA . 0.0 OUTLIER 44.05 45.28 6.64 Favored 'General case' 0 N--CA 1.521 3.109 0 CA-C-N 118.846 0.748 . . . . 0.0 109.781 175.668 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 78.01 24.15 0.71 Allowed 'General case' 0 N--CA 1.517 2.896 0 C-N-CA 123.476 0.711 . . . . 0.0 110.499 -178.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.639 ' O ' HG22 ' A' ' 29' ' ' VAL . 39.0 p90 -166.46 -142.06 0.05 OUTLIER 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.384 -0.822 . . . . 0.0 109.544 178.457 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 54.2 t -133.04 107.5 11.69 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.251 0 O-C-N 120.566 -1.334 . . . . 0.0 108.646 -179.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.97 ' HB3' ' HE1' ' A' ' 30' ' ' HIS . . . -148.97 116.67 6.24 Favored 'General case' 0 N--CA 1.505 2.303 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.0 tp . . . . . 0 N--CA 1.508 2.47 0 CA-C-O 117.806 -1.093 . . . . 0.0 110.662 -179.84 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SIN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.473 ' HA ' HD21 ' A' ' 5' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.507 2.403 0 CA-C-O 119.79 -0.148 . . . . 0.0 111.258 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.9 tt -63.84 -21.92 29.81 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.641 0 O-C-N 121.19 -0.944 . . . . 0.0 111.206 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -82.28 -55.0 4.79 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.282 -0.886 . . . . 0.0 108.988 178.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.473 HD21 ' HA ' ' A' ' 2' ' ' GLU . 2.3 pp -60.6 -34.67 74.56 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 122.055 -0.403 . . . . 0.0 110.457 179.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.502 ' HA ' HD23 ' A' ' 9' ' ' LEU . 21.5 mmt -62.99 -40.86 99.02 Favored 'General case' 0 N--CA 1.513 2.682 0 O-C-N 121.657 -0.652 . . . . 0.0 109.276 178.295 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -62.9 -33.71 75.88 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.849 -0.532 . . . . 0.0 110.002 178.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -64.24 -26.91 68.72 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.805 -0.559 . . . . 0.0 111.232 179.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.506 ' HA ' HD13 ' A' ' 9' ' ' LEU . 2.0 mm? -61.5 -43.71 98.37 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.229 -0.92 . . . . 0.0 111.15 -179.436 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -72.2 -4.79 60.81 Favored Glycine 0 N--CA 1.513 3.776 0 C-N-CA 120.997 -0.62 . . . . 0.0 112.333 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.477 ' HG3' ' CH2' ' A' ' 21' ' ' TRP . 0.0 OUTLIER -117.3 -32.18 5.05 Favored 'General case' 0 N--CA 1.51 2.525 0 CA-C-N 119.232 1.516 . . . . 0.0 110.454 178.869 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.937 ' C ' HD22 ' A' ' 13' ' ' LEU . 10.6 m-70 -99.24 -23.96 15.01 Favored 'General case' 0 N--CA 1.512 2.657 0 O-C-N 121.467 -0.77 . . . . 0.0 110.918 -179.533 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.937 HD22 ' C ' ' A' ' 12' ' ' HIS . 0.0 OUTLIER 22.25 -100.8 0.01 OUTLIER 'General case' 0 N--CA 1.52 3.056 0 C-N-CA 125.246 1.418 . . . . 0.0 114.574 179.322 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.54 ' HB3' ' CG ' ' A' ' 17' ' ' GLU . 2.4 t30 -164.09 -80.07 0.03 OUTLIER 'General case' 0 N--CA 1.515 2.814 0 CA-C-N 121.393 1.906 . . . . 0.0 114.642 -176.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 54.7 m -146.04 -66.61 0.29 Allowed 'General case' 0 N--CA 1.525 3.322 0 CA-C-N 120.028 1.285 . . . . 0.0 110.149 -176.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.53 ' HA ' HG12 ' A' ' 19' ' ' VAL . 6.6 mtp -73.98 -37.49 64.46 Favored 'General case' 0 N--CA 1.52 3.05 0 N-CA-C 105.59 -2.004 . . . . 0.0 105.59 175.529 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.54 ' CG ' ' HB3' ' A' ' 14' ' ' ASN . 1.3 pm0 -70.64 -21.69 62.6 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 173.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.935 ' HG2' HD23 ' A' ' 13' ' ' LEU . 0.0 OUTLIER -81.67 -22.25 37.61 Favored 'General case' 0 N--CA 1.519 3.019 0 CA-C-N 118.76 0.709 . . . . 0.0 110.974 176.871 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.53 HG12 ' HA ' ' A' ' 16' ' ' MET . 6.1 p -88.03 -40.74 13.85 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.686 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 176.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -71.62 -20.99 61.9 Favored 'General case' 0 C--N 1.308 -1.231 0 N-CA-C 106.843 -1.539 . . . . 0.0 106.843 172.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . 0.66 ' HB3' ' HA ' ' A' ' 18' ' ' ARG . 0.2 OUTLIER -61.0 -36.67 80.11 Favored 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 105.611 -1.996 . . . . 0.0 105.611 174.073 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.561 ' CD2' ' CD1' ' A' ' 21' ' ' TRP . 4.1 mm? -80.52 -30.78 37.21 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 118.032 -1.467 . . . . 0.0 109.779 179.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 36.9 mtt85 -61.51 -32.74 72.78 Favored 'General case' 0 N--CA 1.504 2.258 0 N-CA-C 107.451 -1.314 . . . . 0.0 107.451 174.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.79 -23.37 27.25 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 122.046 -0.409 . . . . 0.0 110.283 178.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.545 ' HG2' ' CZ3' ' A' ' 21' ' ' TRP . 0.1 OUTLIER -56.03 -47.46 77.8 Favored 'General case' 0 N--CA 1.513 2.708 0 CA-C-N 119.008 0.822 . . . . 0.0 109.218 179.032 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -69.89 -30.15 67.52 Favored 'General case' 0 N--CA 1.505 2.29 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 177.023 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -96.94 42.03 1.1 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.74 -0.6 . . . . 0.0 110.236 178.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -99.47 -58.88 1.83 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.175 -0.953 . . . . 0.0 108.772 178.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.0 t -118.54 -16.06 8.11 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.958 0 CA-C-O 117.389 -1.291 . . . . 0.0 112.28 179.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.441 ' CG ' ' H ' ' A' ' 31' ' ' ASN . 6.5 p-80 -20.18 -51.51 0.01 OUTLIER 'General case' 1 N--CA 1.54 4.026 0 C-N-CA 124.721 1.209 . . . . 0.0 110.346 173.654 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.537 ' HB2' ' HB3' ' A' ' 34' ' ' ALA . 0.1 OUTLIER -156.0 27.09 0.37 Allowed 'General case' 0 CA--C 1.579 2.095 0 C-N-CA 125.252 1.421 . . . . 0.0 107.47 174.179 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 44.47 94.65 0.01 OUTLIER 'General case' 0 N--CA 1.537 3.907 0 C-N-CA 125.277 1.431 . . . . 0.0 112.578 178.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 17.4 m 37.41 52.64 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.526 3.343 0 CA-C-O 121.769 0.795 . . . . 0.0 110.6 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.537 ' HB3' ' HB2' ' A' ' 31' ' ' ASN . . . -128.3 -153.05 0.54 Allowed 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.888 -0.507 . . . . 0.0 109.7 -177.695 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.7 tt . . . . . 0 N--CA 1.503 2.198 0 O-C-N 121.41 -0.806 . . . . 0.0 109.78 -179.956 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SIN . . . . . 0.463 ' H22' ' HB2' ' A' ' 4' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 . . . . . 0 N--CA 1.509 2.482 0 N-CA-C 110.352 -0.24 . . . . 0.0 110.352 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.402 HG23 ' HE2' ' A' ' 6' ' ' MET . 41.6 mm -55.94 -41.17 66.47 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.774 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.463 ' HB2' ' H22' ' A' ' 1' ' ' SIN . 1.4 mm-40 -67.86 -42.72 80.9 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.725 -0.609 . . . . 0.0 109.479 178.303 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.9 mt -57.36 -52.06 66.87 Favored 'General case' 0 N--CA 1.505 2.292 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 179.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.402 ' HE2' HG23 ' A' ' 3' ' ' ILE . 7.1 ptt? -68.02 -29.89 69.0 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.927 -0.483 . . . . 0.0 110.432 178.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 51.0 t60 -62.63 -29.9 70.96 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.683 -0.636 . . . . 0.0 110.81 179.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.491 ' C ' HD22 ' A' ' 9' ' ' LEU . 26.3 m-80 -86.88 38.11 0.79 Allowed 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.379 -0.826 . . . . 0.0 111.496 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.516 HD13 ' HA ' ' A' ' 9' ' ' LEU . 2.1 mm? -130.38 -63.28 0.9 Allowed 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.074 -1.016 . . . . 0.0 108.61 178.67 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -74.79 -42.67 30.62 Favored Glycine 0 N--CA 1.506 3.348 0 N-CA-C 109.795 -1.322 . . . . 0.0 109.795 179.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -73.59 -32.39 64.09 Favored 'General case' 0 N--CA 1.507 2.382 0 CA-C-N 118.133 0.967 . . . . 0.0 108.836 177.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 58.9 t60 -63.46 -55.37 24.67 Favored 'General case' 0 N--CA 1.504 2.258 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 178.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.633 ' HG ' ' HG3' ' A' ' 18' ' ' ARG . 0.1 OUTLIER -82.09 153.92 25.84 Favored 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 -178.921 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 176.76 151.87 0.18 Allowed 'General case' 0 N--CA 1.512 2.635 0 O-C-N 121.782 -0.574 . . . . 0.0 110.648 -179.279 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 37.0 p 44.09 -83.83 0.01 OUTLIER 'General case' 0 N--CA 1.523 3.224 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 178.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.602 ' HA ' HG12 ' A' ' 19' ' ' VAL . 9.6 tpt -85.45 -33.76 21.81 Favored 'General case' 0 N--CA 1.513 2.685 0 CA-C-N 119.205 0.911 . . . . 0.0 109.979 -179.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.431 ' HB2' ' HA ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -76.75 -31.48 57.13 Favored 'General case' 0 N--CA 1.506 2.35 0 N-CA-C 107.305 -1.369 . . . . 0.0 107.305 177.383 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.633 ' HG3' ' HG ' ' A' ' 13' ' ' LEU . 9.6 mtt-85 -74.57 -41.86 59.77 Favored 'General case' 0 N--CA 1.506 2.329 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 177.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.602 HG12 ' HA ' ' A' ' 16' ' ' MET . 9.1 p -66.02 -43.47 92.52 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.759 0 O-C-N 121.02 -1.05 . . . . 0.0 110.908 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -68.96 -25.46 64.56 Favored 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 176.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . 0.529 ' HB3' ' O ' ' A' ' 18' ' ' ARG . 21.4 t90 -70.2 -38.6 75.36 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 175.248 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.469 HD13 ' HA ' ' A' ' 22' ' ' LEU . 2.1 mm? -72.19 -41.41 67.01 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -178.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 21.1 ttp-105 -68.29 -32.71 73.06 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 177.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.36 -23.8 54.16 Favored 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.451 ' HE3' ' CH2' ' A' ' 21' ' ' TRP . 4.6 mmtp -60.1 -37.56 80.32 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.25 -0.906 . . . . 0.0 108.987 177.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.4 mp -80.5 -36.91 32.66 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 175.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.471 ' C ' ' CE1' ' A' ' 30' ' ' HIS . 1.4 mt-30 -91.81 59.61 3.72 Favored 'General case' 0 N--CA 1.488 1.446 0 CA-C-O 121.551 0.691 . . . . 0.0 110.004 178.411 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -108.47 -37.74 5.88 Favored 'General case' 0 N--CA 1.5 2.065 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.255 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.441 ' O ' ' C ' ' A' ' 30' ' ' HIS . 15.7 m -129.57 -40.39 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.517 2.908 0 CA-C-O 116.218 -1.849 . . . . 0.0 111.085 178.653 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.601 ' CE1' ' HB2' ' A' ' 34' ' ' ALA . 4.5 p-80 15.38 -102.12 0.0 OUTLIER 'General case' 1 N--CA 1.554 4.734 0 CA-C-N 121.081 1.764 . . . . 0.0 111.039 176.025 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -78.91 -49.48 12.78 Favored 'General case' 0 N--CA 1.502 2.169 0 N-CA-C 104.595 -2.372 . . . . 0.0 104.595 172.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 76.9 t80 146.42 -32.1 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 126.028 1.731 . . . . 0.0 109.526 177.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.477 HG13 ' O ' ' A' ' 33' ' ' VAL . 7.2 p -55.85 89.12 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.524 3.251 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 179.578 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.601 ' HB2' ' CE1' ' A' ' 30' ' ' HIS . . . -137.34 111.53 8.45 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.112 -173.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.447 HD13 ' HA ' ' A' ' 35' ' ' LEU . 2.4 mm? . . . . . 0 N--CA 1.501 2.102 0 CA-C-O 118.747 -0.644 . . . . 0.0 109.342 179.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SIN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.635 ' HB3' ' HB2' ' A' ' 5' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.873 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.7 tt -61.38 -36.87 75.81 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.538 0 O-C-N 122.097 -0.377 . . . . 0.0 111.091 -179.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -69.86 -40.23 75.88 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.527 -0.733 . . . . 0.0 109.547 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.635 ' HB2' ' HB3' ' A' ' 2' ' ' GLU . 0.3 OUTLIER -65.87 -51.38 59.24 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 122.084 -0.385 . . . . 0.0 110.284 -179.994 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 22.3 ptp -65.29 -29.81 70.6 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.77 -0.581 . . . . 0.0 110.616 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 76.1 t60 -74.32 -45.09 49.58 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.503 -0.748 . . . . 0.0 109.225 178.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 -60.53 -41.59 94.77 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.808 -0.557 . . . . 0.0 111.392 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.62 HD22 ' CH2' ' A' ' 21' ' ' TRP . 16.3 mt -88.34 -53.67 4.57 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.848 -0.533 . . . . 0.0 110.363 -178.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.501 ' HA2' HD22 ' A' ' 13' ' ' LEU . . . -57.96 -22.56 48.84 Favored Glycine 0 N--CA 1.514 3.887 0 CA-C-N 118.647 0.658 . . . . 0.0 111.817 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.8 ttpm? -63.69 -28.2 69.74 Favored 'General case' 0 N--CA 1.51 2.541 0 CA-C-N 119.079 1.44 . . . . 0.0 107.976 176.173 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 79.9 m-70 -100.69 -30.86 11.51 Favored 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 122.752 0.421 . . . . 0.0 111.076 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.584 ' HA ' ' HG3' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -139.5 -163.88 1.57 Allowed 'General case' 0 N--CA 1.517 2.921 0 O-C-N 121.248 -0.907 . . . . 0.0 111.746 -178.827 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 178.92 -46.12 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.796 0 O-C-N 120.823 -1.173 . . . . 0.0 112.846 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.476 ' O ' HG12 ' A' ' 19' ' ' VAL . 68.3 m -135.74 -81.1 0.41 Allowed 'General case' 0 N--CA 1.51 2.528 0 CA-C-N 119.596 1.089 . . . . 0.0 109.723 -179.05 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.531 ' HA ' ' CG1' ' A' ' 19' ' ' VAL . 3.8 ttt -74.94 -36.8 62.12 Favored 'General case' 0 N--CA 1.516 2.831 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 177.482 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.584 ' HG3' ' HA ' ' A' ' 13' ' ' LEU . 2.2 pm0 -65.75 -32.61 74.25 Favored 'General case' 0 N--CA 1.5 2.056 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 176.262 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.573 ' O ' ' HB3' ' A' ' 21' ' ' TRP . 2.1 ttt-85 -74.37 -49.05 24.29 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.889 -0.507 . . . . 0.0 109.889 179.042 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.531 ' CG1' ' HA ' ' A' ' 16' ' ' MET . 3.7 p -59.12 -47.49 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.616 0 O-C-N 121.67 -0.644 . . . . 0.0 111.262 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -65.88 -27.58 68.32 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 175.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . 0.62 ' CH2' HD22 ' A' ' 9' ' ' LEU . 13.1 t90 -67.32 -38.39 84.85 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 107.264 -1.384 . . . . 0.0 107.264 175.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 18' ' ' ARG . 6.0 mt -69.94 -41.9 73.94 Favored 'General case' 0 N--CA 1.494 1.747 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 -179.226 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 -62.65 -31.7 72.62 Favored 'General case' 0 N--CA 1.503 2.219 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.48 -31.86 53.96 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 179.122 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.2 mmtm -63.2 -35.99 82.14 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.677 -0.64 . . . . 0.0 110.084 179.036 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.6 mt -70.01 -35.68 74.53 Favored 'General case' 0 N--CA 1.504 2.275 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 175.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.6 ' HB3' ' CE1' ' A' ' 30' ' ' HIS . 43.7 mt-30 -82.0 -96.42 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 178.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.4 ' O ' ' HA ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER 68.29 -59.54 0.44 Allowed 'General case' 0 N--CA 1.518 2.965 0 C-N-CA 123.911 0.884 . . . . 0.0 113.23 178.779 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.7 m -102.3 -33.35 3.36 Favored 'Isoleucine or valine' 0 N--CA 1.531 3.618 0 CA-C-O 118.256 -0.878 . . . . 0.0 111.522 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.6 ' CE1' ' HB3' ' A' ' 27' ' ' GLN . 7.6 p-80 -21.76 -51.11 0.02 OUTLIER 'General case' 0 N--CA 1.53 3.56 0 C-N-CA 124.717 1.207 . . . . 0.0 111.491 175.48 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.893 ' HB2' ' HB3' ' A' ' 34' ' ' ALA . 23.7 m-20 -143.47 12.06 1.72 Allowed 'General case' 0 CA--C 1.586 2.341 0 C-N-CA 124.378 1.071 . . . . 0.0 109.188 177.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.4 ' HA ' ' O ' ' A' ' 28' ' ' ASP . 0.1 OUTLIER 47.31 86.65 0.02 OUTLIER 'General case' 1 N--CA 1.541 4.096 0 CA-C-N 119.617 1.099 . . . . 0.0 112.374 178.27 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 10.4 t 49.18 55.7 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.521 3.102 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 179.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.893 ' HB3' ' HB2' ' A' ' 31' ' ' ASN . . . -126.45 -62.99 1.12 Allowed 'General case' 0 N--CA 1.493 1.711 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.299 -176.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.503 2.191 0 CA-C-O 118.547 -0.74 . . . . 0.0 109.794 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SIN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 . . . . . 0 N--CA 1.509 2.482 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.478 ' O ' ' HB2' ' A' ' 4' ' ' GLN . 2.1 mp -64.08 153.2 7.64 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.802 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 179.117 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.478 ' HB2' ' O ' ' A' ' 3' ' ' ILE . 3.1 mp0 77.76 -58.02 0.48 Allowed 'General case' 0 N--CA 1.524 3.234 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 -177.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.3 mp -60.7 -44.85 96.04 Favored 'General case' 0 N--CA 1.506 2.337 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 176.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.49 -32.35 68.14 Favored 'General case' 0 N--CA 1.502 2.151 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 177.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 58.4 m170 -56.67 -32.43 65.38 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 121.436 -0.79 . . . . 0.0 110.633 179.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.6 m-80 -93.44 -26.94 16.99 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.952 -0.467 . . . . 0.0 111.141 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 13.4 mt -109.65 -68.25 0.93 Allowed 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.323 -0.861 . . . . 0.0 111.397 -178.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -58.63 -49.47 76.86 Favored Glycine 0 N--CA 1.514 3.869 0 CA-C-N 118.592 0.633 . . . . 0.0 111.678 -178.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.4 ttmt -52.54 -45.87 66.52 Favored 'General case' 0 N--CA 1.514 2.759 0 CA-C-N 118.407 1.104 . . . . 0.0 109.742 179.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 77.0 t60 -67.37 -39.08 85.66 Favored 'General case' 0 N--CA 1.505 2.308 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 177.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.69 HD23 ' HA ' ' A' ' 18' ' ' ARG . 7.2 tp -69.01 153.82 43.14 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-O 122.048 0.928 . . . . 0.0 112.212 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.559 ' HB3' ' HG3' ' A' ' 17' ' ' GLU . 0.7 OUTLIER -86.7 166.25 15.45 Favored 'General case' 0 N--CA 1.509 2.503 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.336 179.612 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 47.4 m -55.73 -58.28 8.47 Favored 'General case' 0 N--CA 1.521 3.105 0 O-C-N 121.255 -0.903 . . . . 0.0 112.019 -179.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.62 ' HA ' HG12 ' A' ' 19' ' ' VAL . 2.1 ttt -72.85 -30.04 63.68 Favored 'General case' 0 N--CA 1.518 2.933 0 O-C-N 121.371 -0.83 . . . . 0.0 109.307 178.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.559 ' HG3' ' HB3' ' A' ' 14' ' ' ASN . 2.9 mm-40 -68.85 -25.82 64.84 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 177.088 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.69 ' HA ' HD23 ' A' ' 13' ' ' LEU . 0.2 OUTLIER -77.87 -46.09 22.38 Favored 'General case' 0 C--O 1.186 -2.279 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.307 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.62 HG12 ' HA ' ' A' ' 16' ' ' MET . 7.0 p -62.31 -49.1 85.33 Favored 'Isoleucine or valine' 0 N--CA 1.519 2.985 0 O-C-N 121.446 -0.784 . . . . 0.0 112.335 -178.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.78 -25.99 67.81 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-O 121.552 0.691 . . . . 0.0 109.497 175.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . 0.528 ' HB3' ' O ' ' A' ' 18' ' ' ARG . 21.1 t90 -80.1 -41.83 24.79 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.459 179.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 18' ' ' ARG . 2.2 mt -65.88 -40.26 91.43 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 -177.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -66.47 -41.08 89.57 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 177.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.1 mtmm -65.6 -35.18 80.07 Favored 'General case' 0 N--CA 1.51 2.557 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 177.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.02 -41.38 86.73 Favored 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 178.524 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.8 mt -66.8 -31.75 72.57 Favored 'General case' 0 N--CA 1.505 2.288 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 177.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.511 ' HB3' ' ND1' ' A' ' 30' ' ' HIS . 19.2 mt-30 -69.64 -76.61 0.09 Allowed 'General case' 0 N--CA 1.487 1.39 0 CA-C-O 118.587 -0.72 . . . . 0.0 109.16 178.489 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.5 t70 42.45 85.05 0.02 OUTLIER 'General case' 0 N--CA 1.527 3.4 0 CA-C-N 119.002 0.819 . . . . 0.0 110.344 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.7 t 82.96 -51.86 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.525 3.303 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 -175.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.511 ' ND1' ' HB3' ' A' ' 27' ' ' GLN . 20.8 p-80 28.68 82.36 0.02 OUTLIER 'General case' 0 N--CA 1.525 3.276 0 CA-C-N 119.039 0.836 . . . . 0.0 111.768 175.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 76.74 -52.13 0.58 Allowed 'General case' 0 N--CA 1.527 3.38 0 O-C-N 121.695 -0.628 . . . . 0.0 110.931 -178.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 2.3 t80 68.52 50.09 0.72 Allowed 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 122.161 0.982 . . . . 0.0 111.594 -176.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 15.5 m -111.83 43.44 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.031 0 N-CA-C 105.622 -1.992 . . . . 0.0 105.622 175.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -111.21 -60.04 1.89 Allowed 'General case' 0 N--CA 1.492 1.635 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.94 -177.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.504 2.239 0 CA-C-O 117.729 -1.129 . . . . 0.0 109.961 -179.963 . . . . . . . . 1 1 . 1 stop_ save_