data_1bm4_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 1bm4 _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.2 t . . . . . 0 CA--C 1.562 1.41 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.19 -27.33 68.62 Favored 'General case' 0 CA--C 1.571 1.775 0 N-CA-C 116.233 1.938 . . . . 0.0 116.233 175.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -75.46 -46.86 30.02 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-N 120.168 1.349 . . . . 0.0 113.77 163.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -59.79 -30.35 68.84 Favored 'General case' 0 CA--C 1.572 1.81 0 N-CA-C 115.099 1.518 . . . . 0.0 115.099 171.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -72.77 -41.77 64.7 Favored 'General case' 0 CA--C 1.563 1.445 0 CA-C-N 121.605 2.002 . . . . 0.0 114.525 170.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 79.5 mtm180 -54.86 -38.2 67.18 Favored 'General case' 0 CA--C 1.578 2.026 0 CA-C-N 120.594 1.543 . . . . 0.0 114.439 163.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 97.4 mt -68.49 -40.65 80.83 Favored 'General case' 0 CA--C 1.571 1.761 0 CA-C-O 117.661 -1.162 . . . . 0.0 114.045 167.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -72.28 -35.44 68.71 Favored 'General case' 0 N--CA 1.498 1.972 0 CA-C-N 121.677 2.035 . . . . 0.0 114.271 -178.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -64.71 -35.94 82.67 Favored 'General case' 0 CA--C 1.575 1.925 0 CA-C-N 121.235 1.834 . . . . 0.0 114.09 167.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.8 -55.89 22.33 Favored 'General case' 0 CA--C 1.57 1.726 0 CA-C-N 120.051 1.296 . . . . 0.0 113.558 166.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 14.8 m-30 -59.24 -35.24 73.32 Favored 'General case' 0 CA--C 1.568 1.657 0 N-CA-C 115.125 1.528 . . . . 0.0 115.125 175.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 2.9 tpp180 -69.93 -24.07 63.3 Favored 'General case' 0 CA--C 1.57 1.739 0 N-CA-C 115.536 1.68 . . . . 0.0 115.536 167.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 49.9 tpt85 -63.37 -32.87 74.41 Favored 'General case' 0 CA--C 1.577 1.991 0 CA-C-N 121.291 1.86 . . . . 0.0 114.845 164.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 9.5 p90 -120.48 39.22 3.79 Favored 'General case' 0 CA--C 1.578 2.04 0 C-N-CA 124.262 1.025 . . . . 0.0 113.544 174.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 57.2 m . . . . . 0 CA--C 1.581 2.154 0 O-C-N 119.755 -1.84 . . . . 0.0 106.362 166.838 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.4 m . . . . . 0 CA--C 1.568 1.656 0 CA-C-O 121.875 0.845 . . . . 0.0 110.899 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -148.53 -37.88 0.18 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.028 -1.045 . . . . 0.0 112.396 158.122 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -71.54 -42.2 68.2 Favored 'General case' 0 N--CA 1.5 2.072 0 CA-C-N 121.369 1.895 . . . . 0.0 112.92 161.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.6 mp -51.79 -46.46 64.21 Favored 'General case' 0 CA--C 1.574 1.902 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 164.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 82.8 mt-10 -64.47 -40.5 95.8 Favored 'General case' 0 CA--C 1.565 1.546 0 N-CA-C 116.015 1.858 . . . . 0.0 116.015 171.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 71.2 mtm180 -55.79 -37.34 68.47 Favored 'General case' 0 CA--C 1.577 1.988 0 CA-C-N 121.379 1.9 . . . . 0.0 114.44 166.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 93.6 mt -67.94 -39.1 83.51 Favored 'General case' 0 CA--C 1.573 1.853 0 CA-C-O 117.56 -1.21 . . . . 0.0 113.854 166.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -64.68 -42.02 95.64 Favored 'General case' 0 N--CA 1.5 2.039 0 CA-C-N 121.849 2.113 . . . . 0.0 114.368 177.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -69.47 -35.57 75.73 Favored 'General case' 0 CA--C 1.571 1.77 0 CA-C-N 120.018 1.281 . . . . 0.0 114.276 171.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.79 -51.42 69.41 Favored 'General case' 0 CA--C 1.574 1.866 0 CA-C-N 120.817 1.644 . . . . 0.0 114.465 167.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 34.8 m-85 -72.78 -7.25 49.78 Favored 'General case' 0 CA--C 1.576 1.946 0 N-CA-C 116.218 1.932 . . . . 0.0 116.218 172.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -105.1 54.0 0.71 Allowed 'General case' 0 CA--C 1.571 1.781 0 CA-C-N 121.675 2.034 . . . . 0.0 111.626 162.042 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 34.3 ttp-105 -169.41 -37.5 0.02 OUTLIER 'General case' 0 CA--C 1.569 1.707 0 C-N-CA 124.819 1.248 . . . . 0.0 111.883 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -54.51 -28.94 48.67 Favored 'General case' 0 CA--C 1.581 2.141 0 N-CA-C 117.471 2.397 . . . . 0.0 117.471 178.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.2 t . . . . . 0 CA--C 1.579 2.079 0 CA-C-N 120.112 1.324 . . . . 0.0 108.912 159.082 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.4 t . . . . . 0 N--CA 1.503 2.222 1 N-CA-C 123.456 4.613 . . . . 0.0 123.456 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -77.02 141.49 40.31 Favored 'General case' 0 CA--C 1.566 1.578 0 O-C-N 119.789 -1.82 . . . . 0.0 111.185 161.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 37.4 t80 68.58 -47.57 0.55 Allowed 'General case' 0 N--CA 1.512 2.64 0 C-N-CA 124.967 1.307 . . . . 0.0 113.319 -161.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -63.09 -21.37 66.13 Favored 'General case' 0 CA--C 1.574 1.885 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 172.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -73.87 -37.41 64.74 Favored 'General case' 0 CA--C 1.565 1.527 0 CA-C-N 121.795 2.089 . . . . 0.0 115.454 163.105 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 74.8 mmt-85 -60.06 -38.49 82.99 Favored 'General case' 0 CA--C 1.569 1.684 0 CA-C-N 120.506 1.503 . . . . 0.0 114.178 165.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 95.7 mt -68.09 -37.5 81.28 Favored 'General case' 0 CA--C 1.571 1.769 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 166.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.8 ttmp? -73.49 -38.96 65.21 Favored 'General case' 0 N--CA 1.501 2.076 0 CA-C-N 121.403 1.911 . . . . 0.0 114.375 -177.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -64.39 -38.19 90.18 Favored 'General case' 0 CA--C 1.577 1.998 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 167.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.39 -47.3 84.73 Favored 'General case' 0 CA--C 1.571 1.774 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 167.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -59.44 -28.19 66.75 Favored 'General case' 0 CA--C 1.569 1.693 0 N-CA-C 115.969 1.84 . . . . 0.0 115.969 169.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.2 -3.99 42.43 Favored 'General case' 0 CA--C 1.578 2.02 0 N-CA-C 115.989 1.848 . . . . 0.0 115.989 165.28 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 66.5 mmt-85 -79.63 -45.25 19.44 Favored 'General case' 0 CA--C 1.569 1.678 0 CA-C-N 121.686 2.039 . . . . 0.0 112.341 152.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -67.8 -48.47 66.19 Favored 'General case' 0 CA--C 1.574 1.87 0 CA-C-N 119.086 0.857 . . . . 0.0 113.104 -177.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 91.7 m . . . . . 0 CA--C 1.581 2.159 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 168.291 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.5 m . . . . . 0 CA--C 1.566 1.59 0 CA-C-O 122.328 1.061 . . . . 0.0 111.067 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -147.42 -42.47 0.17 Allowed 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 118.34 -0.838 . . . . 0.0 111.662 155.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -62.89 -38.16 89.79 Favored 'General case' 0 N--CA 1.499 1.979 0 CA-C-N 121.048 1.749 . . . . 0.0 113.982 163.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -47.49 -42.89 23.92 Favored 'General case' 0 CA--C 1.576 1.948 0 N-CA-C 115.194 1.553 . . . . 0.0 115.194 161.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -72.71 -37.32 67.83 Favored 'General case' 0 CA--C 1.566 1.564 0 N-CA-C 115.035 1.494 . . . . 0.0 115.035 170.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 58.5 mtt-85 -52.81 -45.37 67.2 Favored 'General case' 0 CA--C 1.579 2.067 0 CA-C-N 121.537 1.971 . . . . 0.0 113.476 165.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 95.6 mt -63.45 -40.21 96.54 Favored 'General case' 0 CA--C 1.57 1.727 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 168.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.0 mmpt? -62.54 -38.03 88.4 Favored 'General case' 0 N--CA 1.497 1.915 0 CA-C-N 121.086 1.766 . . . . 0.0 114.883 172.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -60.96 -46.66 89.82 Favored 'General case' 0 CA--C 1.569 1.7 0 CA-C-N 119.957 1.253 . . . . 0.0 113.306 168.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.409 ' O ' ' HB3' ' A' ' 28' ' ' ARG . . . -60.17 -50.35 74.03 Favored 'General case' 0 CA--C 1.57 1.732 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 170.553 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 20.1 m-30 -56.57 -37.31 70.41 Favored 'General case' 0 CA--C 1.574 1.876 0 CA-C-N 120.925 1.693 . . . . 0.0 114.795 170.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -25.64 68.43 Favored 'General case' 0 CA--C 1.582 2.174 0 N-CA-C 115.084 1.513 . . . . 0.0 115.084 170.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.409 ' HB3' ' O ' ' A' ' 25' ' ' ALA . 7.5 tpm_? -56.25 -35.37 67.32 Favored 'General case' 0 CA--C 1.578 2.024 0 CA-C-N 121.982 2.173 . . . . 0.0 115.308 162.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -102.92 -43.9 5.4 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 124.246 1.019 . . . . 0.0 112.42 -171.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 86.2 m . . . . . 0 CA--C 1.574 1.866 0 CA-C-O 117.791 -1.099 . . . . 0.0 108.906 174.486 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 97.5 p . . . . . 0 CA--C 1.567 1.614 0 N-CA-C 116.225 1.935 . . . . 0.0 116.225 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.88 -38.0 89.5 Favored 'General case' 0 CA--C 1.571 1.785 0 N-CA-C 115.372 1.619 . . . . 0.0 115.372 171.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -63.92 -44.11 93.89 Favored 'General case' 0 CA--C 1.573 1.829 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 166.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 13.5 tp -58.17 -45.63 87.15 Favored 'General case' 0 CA--C 1.567 1.633 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 169.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -67.39 -39.59 85.62 Favored 'General case' 0 CA--C 1.562 1.433 0 N-CA-C 114.738 1.384 . . . . 0.0 114.738 173.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.9 ttp85 -49.4 -43.05 44.04 Favored 'General case' 0 CA--C 1.581 2.141 0 CA-C-N 121.484 1.947 . . . . 0.0 114.547 163.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 93.1 mt -67.97 -46.42 71.43 Favored 'General case' 0 CA--C 1.569 1.686 0 CA-C-O 117.594 -1.193 . . . . 0.0 113.642 168.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.6 mttm -66.14 -39.42 89.83 Favored 'General case' 0 N--CA 1.502 2.149 0 CA-C-N 121.8 2.091 . . . . 0.0 114.48 178.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -61.45 -33.59 74.0 Favored 'General case' 0 CA--C 1.571 1.773 0 N-CA-C 114.819 1.414 . . . . 0.0 114.819 169.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.11 -45.91 65.93 Favored 'General case' 0 CA--C 1.572 1.804 0 N-CA-C 115.056 1.502 . . . . 0.0 115.056 163.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 14.8 m-30 -69.98 -23.74 63.21 Favored 'General case' 0 CA--C 1.565 1.557 0 N-CA-C 116.413 2.005 . . . . 0.0 116.413 -178.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -72.72 73.28 1.08 Allowed 'General case' 0 CA--C 1.577 2.008 0 CA-C-N 121.445 1.929 . . . . 0.0 110.296 166.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.66 -55.76 0.03 OUTLIER 'General case' 0 CA--C 1.564 1.506 0 C-N-CA 125.757 1.623 . . . . 0.0 108.194 -169.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 24.7 p90 -75.32 -32.29 60.88 Favored 'General case' 0 CA--C 1.578 2.054 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 162.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 23.3 m . . . . . 0 CA--C 1.576 1.958 0 CA-C-N 120.469 1.486 . . . . 0.0 108.458 170.945 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 76.1 p . . . . . 0 CA--C 1.573 1.863 0 N-CA-C 115.678 1.733 . . . . 0.0 115.678 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.0 -42.95 84.14 Favored 'General case' 0 CA--C 1.571 1.776 0 CA-C-N 120.841 1.655 . . . . 0.0 114.877 164.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -67.28 -40.17 86.09 Favored 'General case' 0 CA--C 1.573 1.855 0 CA-C-N 120.44 1.473 . . . . 0.0 114.6 173.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.0 mp -56.12 -39.17 71.81 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 165.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.99 -34.12 61.95 Favored 'General case' 0 CA--C 1.569 1.706 0 CA-C-N 120.885 1.675 . . . . 0.0 115.213 172.562 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 74.8 ttt-85 -53.08 -44.35 67.47 Favored 'General case' 0 CA--C 1.578 2.053 0 CA-C-N 120.568 1.531 . . . . 0.0 114.243 159.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 94.7 mt -70.31 -39.97 74.47 Favored 'General case' 0 CA--C 1.569 1.699 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 171.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 61.0 tttm -69.05 -41.77 77.18 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-N 120.779 1.627 . . . . 0.0 114.227 -174.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -62.54 -31.19 71.94 Favored 'General case' 0 CA--C 1.58 2.115 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 168.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.24 -41.82 39.68 Favored 'General case' 0 CA--C 1.573 1.83 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 168.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 22.4 m-30 -57.91 -39.73 78.67 Favored 'General case' 0 CA--C 1.577 2.017 0 CA-C-N 121.451 1.932 . . . . 0.0 114.717 170.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 30.5 ttp180 -50.11 -38.31 38.18 Favored 'General case' 0 CA--C 1.579 2.087 0 N-CA-C 116.029 1.862 . . . . 0.0 116.029 157.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.6 tpm_? -76.34 -42.11 46.0 Favored 'General case' 0 CA--C 1.572 1.819 0 CA-C-N 121.424 1.92 . . . . 0.0 113.999 172.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -68.22 -18.59 64.61 Favored 'General case' 0 N--CA 1.503 2.21 0 N-CA-C 114.801 1.408 . . . . 0.0 114.801 174.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 17.8 m . . . . . 0 CA--C 1.583 2.22 0 C-N-CA 123.88 0.872 . . . . 0.0 108.858 159.715 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 59.6 p . . . . . 0 N--CA 1.498 1.97 0 CA-C-O 116.972 -1.49 . . . . 0.0 109.155 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . 62.13 -60.19 0.12 Allowed 'General case' 0 N--CA 1.508 2.435 0 N-CA-C 116.532 2.049 . . . . 0.0 116.532 169.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -65.69 -48.35 72.35 Favored 'General case' 0 N--CA 1.496 1.861 0 CA-C-N 120.5 1.5 . . . . 0.0 112.894 158.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 16.3 tp -50.68 -44.35 57.8 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 164.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -66.91 -39.81 87.52 Favored 'General case' 0 CA--C 1.564 1.502 0 N-CA-C 115.791 1.774 . . . . 0.0 115.791 173.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 78.9 mtt85 -54.04 -44.06 70.69 Favored 'General case' 0 CA--C 1.573 1.857 0 CA-C-N 121.571 1.987 . . . . 0.0 114.145 163.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 98.4 mt -64.42 -40.08 95.08 Favored 'General case' 0 CA--C 1.569 1.686 0 CA-C-O 117.222 -1.37 . . . . 0.0 113.726 169.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -66.01 -38.07 87.53 Favored 'General case' 0 N--CA 1.502 2.147 0 CA-C-N 122.159 2.254 . . . . 0.0 113.952 173.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -64.65 -38.18 90.11 Favored 'General case' 0 CA--C 1.577 2.011 0 N-CA-C 113.971 1.1 . . . . 0.0 113.971 170.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.93 -42.69 84.9 Favored 'General case' 0 CA--C 1.571 1.767 0 N-CA-C 115.885 1.809 . . . . 0.0 115.885 165.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 15.8 m-30 -75.26 -29.62 60.24 Favored 'General case' 0 CA--C 1.568 1.672 0 CA-C-N 120.5 1.5 . . . . 0.0 114.693 179.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -72.47 61.09 0.48 Allowed 'General case' 0 CA--C 1.581 2.168 0 CA-C-N 120.873 1.67 . . . . 0.0 112.394 165.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 94.4 mtt180 -158.27 -55.34 0.07 Allowed 'General case' 0 CA--C 1.567 1.632 0 C-N-CA 125.909 1.684 . . . . 0.0 109.608 -173.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 22.4 p90 -64.43 -35.28 80.41 Favored 'General case' 0 N--CA 1.502 2.147 0 N-CA-C 115.188 1.551 . . . . 0.0 115.188 -176.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.1 t . . . . . 0 CA--C 1.57 1.733 0 CA-C-N 120.315 1.416 . . . . 0.0 107.695 160.248 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.7 m . . . . . 0 N--CA 1.498 1.96 0 CA-C-O 117.973 -1.013 . . . . 0.0 111.935 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . 58.54 -72.55 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.98 0 C-N-CA 126.655 1.982 . . . . 0.0 115.498 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -63.23 -47.11 83.87 Favored 'General case' 0 N--CA 1.497 1.878 0 CA-C-N 120.776 1.625 . . . . 0.0 113.124 165.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.95 -42.35 68.79 Favored 'General case' 0 N--CA 1.496 1.872 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 165.292 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -66.67 -45.85 77.6 Favored 'General case' 0 CA--C 1.563 1.474 0 N-CA-C 114.83 1.419 . . . . 0.0 114.83 174.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.97 -38.62 57.29 Favored 'General case' 0 CA--C 1.576 1.96 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 167.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 82.7 mt -70.88 -41.93 70.7 Favored 'General case' 0 CA--C 1.571 1.785 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 166.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 34.8 ttpt -64.79 -44.58 89.51 Favored 'General case' 0 N--CA 1.494 1.744 0 CA-C-N 121.092 1.769 . . . . 0.0 114.34 -177.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -62.5 -35.86 80.7 Favored 'General case' 0 CA--C 1.575 1.905 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 173.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.12 -56.04 22.8 Favored 'General case' 0 CA--C 1.57 1.748 0 N-CA-C 113.982 1.105 . . . . 0.0 113.982 164.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -57.66 -41.28 81.17 Favored 'General case' 0 CA--C 1.571 1.757 0 CA-C-N 120.641 1.564 . . . . 0.0 115.192 176.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.7 tpm_? -64.89 -35.0 79.72 Favored 'General case' 0 CA--C 1.574 1.883 0 CA-C-N 120.453 1.479 . . . . 0.0 114.607 169.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.8 ttt180 -61.71 -38.42 87.79 Favored 'General case' 0 CA--C 1.573 1.834 0 CA-C-N 121.632 2.014 . . . . 0.0 114.409 169.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -102.14 10.88 39.08 Favored 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 114.741 1.386 . . . . 0.0 114.741 -177.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 78.7 m . . . . . 0 CA--C 1.574 1.899 0 CA-C-N 119.992 1.269 . . . . 0.0 108.011 172.414 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 CA--C 1.568 1.663 0 CA-C-O 121.182 0.515 . . . . 0.0 111.668 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . 65.01 -48.88 0.35 Allowed 'General case' 0 N--CA 1.508 2.45 0 N-CA-C 115.869 1.803 . . . . 0.0 115.869 175.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -57.58 -46.5 83.92 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 119.459 -2.025 . . . . 0.0 113.597 154.037 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 36.8 tp -50.67 -44.28 57.63 Favored 'General case' 0 CA--C 1.574 1.885 0 N-CA-C 115.203 1.557 . . . . 0.0 115.203 166.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -75.31 -34.59 61.27 Favored 'General case' 0 CA--C 1.567 1.613 0 N-CA-C 114.965 1.469 . . . . 0.0 114.965 174.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 58.4 mtm180 -55.17 -43.74 74.58 Favored 'General case' 0 CA--C 1.577 1.989 0 CA-C-N 121.458 1.935 . . . . 0.0 113.776 163.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.1 mt -65.18 -36.75 85.19 Favored 'General case' 0 CA--C 1.575 1.905 0 N-CA-C 114.775 1.398 . . . . 0.0 114.775 166.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 18.9 ttmm -69.15 -41.01 77.84 Favored 'General case' 0 N--CA 1.494 1.767 0 CA-C-N 120.101 1.319 . . . . 0.0 113.889 177.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.4 mm-40 -58.23 -45.93 86.81 Favored 'General case' 0 CA--C 1.565 1.542 0 CA-C-N 119.779 1.172 . . . . 0.0 114.03 164.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.88 -52.85 63.8 Favored 'General case' 0 CA--C 1.571 1.761 0 N-CA-C 114.491 1.293 . . . . 0.0 114.491 172.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -65.06 -34.99 79.73 Favored 'General case' 0 CA--C 1.572 1.809 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 172.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -68.36 -42.81 78.66 Favored 'General case' 0 N--CA 1.494 1.747 0 CA-C-N 121.198 1.817 . . . . 0.0 114.511 173.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 92.3 mtt180 -67.83 -41.85 82.4 Favored 'General case' 0 CA--C 1.575 1.912 0 CA-C-N 120.789 1.632 . . . . 0.0 113.992 167.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -129.38 74.48 1.59 Allowed 'General case' 0 CA--C 1.568 1.662 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 -166.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 2.7 m . . . . . 0 CA--C 1.573 1.839 0 O-C-N 120.714 -1.241 . . . . 0.0 108.128 -170.269 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 26.2 p . . . . . 0 CA--C 1.56 1.351 0 CA-C-O 121.463 0.649 . . . . 0.0 109.938 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -75.67 -59.94 2.53 Favored 'General case' 0 CA--C 1.568 1.648 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 -174.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.6 tmtm? -68.7 -17.98 64.17 Favored 'General case' 0 CA--C 1.579 2.086 0 N-CA-C 116.872 2.175 . . . . 0.0 116.872 -176.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 92.0 t -105.05 79.72 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 CA-C-N 120.331 1.423 . . . . 0.0 107.404 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 50.1 mttm -138.46 62.16 1.56 Allowed 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 168.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -134.15 87.49 0.26 Allowed Glycine 0 CA--C 1.545 1.951 0 O-C-N 120.966 -1.084 . . . . 0.0 114.666 -152.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 52.0 mm -98.45 131.25 45.93 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 2 CA-C-N 125.58 4.69 . . . . 0.0 108.006 -3.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 89.9 m -97.96 121.2 39.59 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.29 -0.881 . . . . 0.0 109.541 174.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 73.79 93.72 0.08 Allowed 'General case' 0 N--CA 1.501 2.084 0 C-N-CA 125.38 1.472 . . . . 0.0 110.628 -176.306 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -65.48 152.39 51.46 Favored Glycine 0 CA--C 1.561 2.928 1 O-C-N 116.026 -4.171 . . . . 0.0 118.111 -24.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -51.7 94.45 0.03 OUTLIER 'Trans proline' 0 CA--C 1.569 2.255 0 C-N-CA 124.485 3.457 . . . . 0.0 115.879 171.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 8.3 t30 48.0 49.96 16.47 Favored 'General case' 0 N--CA 1.505 2.286 0 C-N-CA 125.009 1.323 . . . . 0.0 113.931 -162.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 34.32 36.61 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.518 0 N-CA-C 117.953 2.575 . . . . 0.0 117.953 -165.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 36.7 m -73.29 -52.43 5.28 Favored Pre-proline 0 CA--C 1.573 1.851 0 CA-C-O 115.851 -2.023 . . . . 0.0 112.496 -173.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -65.31 -48.77 3.09 Favored 'Trans proline' 0 CA--C 1.567 2.16 0 CA-C-N 125.288 2.924 . . . . 0.0 114.485 161.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.2 t -57.34 -48.64 78.46 Favored 'General case' 0 CA--C 1.562 1.41 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 -170.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.19 -27.33 68.62 Favored 'General case' 0 CA--C 1.571 1.775 0 N-CA-C 116.233 1.938 . . . . 0.0 116.233 175.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -75.46 -46.86 30.02 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-N 120.168 1.349 . . . . 0.0 113.77 163.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -59.79 -30.35 68.84 Favored 'General case' 0 CA--C 1.572 1.81 0 N-CA-C 115.099 1.518 . . . . 0.0 115.099 171.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -72.77 -41.77 64.7 Favored 'General case' 0 CA--C 1.563 1.445 0 CA-C-N 121.605 2.002 . . . . 0.0 114.525 170.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 79.5 mtm180 -54.86 -38.2 67.18 Favored 'General case' 0 CA--C 1.578 2.026 0 CA-C-N 120.594 1.543 . . . . 0.0 114.439 163.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 97.4 mt -68.49 -40.65 80.83 Favored 'General case' 0 CA--C 1.571 1.761 0 CA-C-O 117.661 -1.162 . . . . 0.0 114.045 167.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -72.28 -35.44 68.71 Favored 'General case' 0 N--CA 1.498 1.972 0 CA-C-N 121.677 2.035 . . . . 0.0 114.271 -178.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -64.71 -35.94 82.67 Favored 'General case' 0 CA--C 1.575 1.925 0 CA-C-N 121.235 1.834 . . . . 0.0 114.09 167.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.8 -55.89 22.33 Favored 'General case' 0 CA--C 1.57 1.726 0 CA-C-N 120.051 1.296 . . . . 0.0 113.558 166.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 14.8 m-30 -59.24 -35.24 73.32 Favored 'General case' 0 CA--C 1.568 1.657 0 N-CA-C 115.125 1.528 . . . . 0.0 115.125 175.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 2.9 tpp180 -69.93 -24.07 63.3 Favored 'General case' 0 CA--C 1.57 1.739 0 N-CA-C 115.536 1.68 . . . . 0.0 115.536 167.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 49.9 tpt85 -63.37 -32.87 74.41 Favored 'General case' 0 CA--C 1.577 1.991 0 CA-C-N 121.291 1.86 . . . . 0.0 114.845 164.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 9.5 p90 -120.48 39.22 3.79 Favored 'General case' 0 CA--C 1.578 2.04 0 C-N-CA 124.262 1.025 . . . . 0.0 113.544 174.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 57.2 m -169.6 113.39 0.5 Allowed Pre-proline 0 CA--C 1.581 2.154 0 O-C-N 119.755 -1.84 . . . . 0.0 106.362 166.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -85.47 67.9 5.62 Favored 'Trans proline' 0 CA--C 1.57 2.305 0 C-N-CA 123.319 2.679 . . . . 0.0 114.526 -176.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 . . . . . 0 N--CA 1.503 2.202 0 CA-C-O 125.353 2.501 . . . . 0.0 111.137 -176.558 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 43.5 t . . . . . 0 CA--C 1.561 1.371 0 CA-C-O 121.405 0.622 . . . . 0.0 110.347 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.74 -22.57 62.4 Favored 'General case' 0 CA--C 1.572 1.806 0 N-CA-C 117.288 2.329 . . . . 0.0 117.288 -177.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.6 115.04 4.81 Favored 'General case' 0 CA--C 1.567 1.605 0 CA-C-N 120.228 1.376 . . . . 0.0 108.219 170.543 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.4 p -92.2 49.79 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.585 2.307 0 CA-C-O 122.572 1.177 . . . . 0.0 112.86 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -158.76 73.0 0.6 Allowed 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 104.945 -2.243 . . . . 0.0 104.945 167.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 172.46 69.32 0.04 OUTLIER Glycine 0 N--CA 1.481 1.683 0 C-N-CA 120.583 -0.818 . . . . 0.0 114.727 -155.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 42.4 mm -113.04 135.41 52.62 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 N-CA-C 106.418 -1.697 . . . . 0.0 106.418 173.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.2 m -55.32 -27.37 46.58 Favored 'General case' 0 N--CA 1.504 2.234 0 N-CA-C 116.991 2.219 . . . . 0.0 116.991 -166.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 41.6 mm-40 -136.63 44.96 2.33 Favored 'General case' 0 CA--C 1.567 1.597 0 CA-C-N 120.686 1.584 . . . . 0.0 110.113 164.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -170.95 41.5 0.19 Allowed Glycine 0 CA--C 1.559 2.822 0 N-CA-C 120.975 3.15 . . . . 0.0 120.975 -166.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -77.02 68.88 7.22 Favored 'Trans proline' 0 CA--C 1.575 2.526 1 CA-C-N 125.88 4.84 . . . . 0.0 114.724 179.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 23.9 m120 61.77 79.15 0.26 Allowed 'General case' 0 N--CA 1.505 2.306 0 C-N-CA 125.652 1.581 . . . . 0.0 110.789 -165.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -92.16 -22.24 19.96 Favored 'General case' 0 N--CA 1.498 1.961 0 N-CA-C 117.764 2.505 . . . . 0.0 117.764 -169.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 73.5 p -61.38 -39.18 60.18 Favored Pre-proline 0 CA--C 1.58 2.132 0 CA-C-O 114.407 -2.711 . . . . 0.0 115.768 169.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -66.31 -54.73 0.45 Allowed 'Trans proline' 0 CA--C 1.568 2.201 0 CA-C-N 127.141 3.586 . . . . 0.0 114.755 169.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.4 m -170.68 84.27 0.1 Allowed 'General case' 0 CA--C 1.568 1.656 0 CA-C-N 120.878 1.672 . . . . 0.0 110.899 172.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -148.53 -37.88 0.18 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.028 -1.045 . . . . 0.0 112.396 158.122 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -71.54 -42.2 68.2 Favored 'General case' 0 N--CA 1.5 2.072 0 CA-C-N 121.369 1.895 . . . . 0.0 112.92 161.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.6 mp -51.79 -46.46 64.21 Favored 'General case' 0 CA--C 1.574 1.902 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 164.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 82.8 mt-10 -64.47 -40.5 95.8 Favored 'General case' 0 CA--C 1.565 1.546 0 N-CA-C 116.015 1.858 . . . . 0.0 116.015 171.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 71.2 mtm180 -55.79 -37.34 68.47 Favored 'General case' 0 CA--C 1.577 1.988 0 CA-C-N 121.379 1.9 . . . . 0.0 114.44 166.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 93.6 mt -67.94 -39.1 83.51 Favored 'General case' 0 CA--C 1.573 1.853 0 CA-C-O 117.56 -1.21 . . . . 0.0 113.854 166.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -64.68 -42.02 95.64 Favored 'General case' 0 N--CA 1.5 2.039 0 CA-C-N 121.849 2.113 . . . . 0.0 114.368 177.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -69.47 -35.57 75.73 Favored 'General case' 0 CA--C 1.571 1.77 0 CA-C-N 120.018 1.281 . . . . 0.0 114.276 171.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.79 -51.42 69.41 Favored 'General case' 0 CA--C 1.574 1.866 0 CA-C-N 120.817 1.644 . . . . 0.0 114.465 167.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 34.8 m-85 -72.78 -7.25 49.78 Favored 'General case' 0 CA--C 1.576 1.946 0 N-CA-C 116.218 1.932 . . . . 0.0 116.218 172.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -105.1 54.0 0.71 Allowed 'General case' 0 CA--C 1.571 1.781 0 CA-C-N 121.675 2.034 . . . . 0.0 111.626 162.042 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 34.3 ttp-105 -169.41 -37.5 0.02 OUTLIER 'General case' 0 CA--C 1.569 1.707 0 C-N-CA 124.819 1.248 . . . . 0.0 111.883 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -54.51 -28.94 48.67 Favored 'General case' 0 CA--C 1.581 2.141 0 N-CA-C 117.471 2.397 . . . . 0.0 117.471 178.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.2 t -94.38 131.17 31.74 Favored Pre-proline 0 CA--C 1.579 2.079 0 CA-C-N 120.112 1.324 . . . . 0.0 108.912 159.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -66.61 -34.93 31.02 Favored 'Trans proline' 0 CA--C 1.571 2.351 0 CA-C-N 122.83 2.046 . . . . 0.0 116.121 176.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 . . . . . 0 N--CA 1.488 1.431 0 CA-C-O 125.34 2.495 . . . . 0.0 109.393 169.013 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 72.3 m . . . . . 0 CA--C 1.561 1.374 0 CA-C-O 121.099 0.476 . . . . 0.0 110.448 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -88.33 75.48 8.5 Favored 'General case' 0 CA--C 1.57 1.719 0 CA-C-O 122.209 1.005 . . . . 0.0 112.579 -176.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 85.3 tttt 66.98 -79.05 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.028 0 C-N-CA 126.017 1.727 . . . . 0.0 111.653 -176.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 94.8 t -127.17 88.12 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 N-CA-C 104.99 -2.226 . . . . 0.0 104.99 167.302 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 179.57 81.7 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 103.811 -2.662 . . . . 0.0 103.811 -177.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -164.91 -141.66 3.19 Favored Glycine 0 N--CA 1.483 1.83 0 N-CA-C 114.822 0.689 . . . . 0.0 114.822 -160.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 36.1 mm -72.37 93.9 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.127 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 -177.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 12.8 p -143.3 -73.54 0.28 Allowed 'General case' 0 N--CA 1.499 2.019 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 -159.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -146.11 65.1 1.21 Allowed 'General case' 0 CA--C 1.568 1.661 0 N-CA-C 106.386 -1.709 . . . . 0.0 106.386 165.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 148.82 80.24 0.03 OUTLIER Glycine 0 CA--C 1.551 2.316 0 CA-C-O 117.411 -1.771 . . . . 0.0 111.966 -147.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -78.27 89.53 1.34 Allowed 'Trans proline' 0 CA--C 1.565 2.042 0 CA-C-N 122.286 3.043 . . . . 0.0 112.949 -176.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 12.2 p-10 -64.1 -29.19 70.34 Favored 'General case' 0 CA--C 1.576 1.956 0 N-CA-C 116.896 2.184 . . . . 0.0 116.896 -174.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -81.25 76.54 8.19 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-O 122.956 1.36 . . . . 0.0 109.775 173.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 47.0 t -118.65 46.67 0.76 Allowed Pre-proline 0 CA--C 1.59 2.5 0 N-CA-C 115.701 1.741 . . . . 0.0 115.701 169.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 0.2 OUTLIER -92.2 -156.16 0.65 Allowed 'Cis proline' 0 CA--C 1.583 2.949 0 CA-C-N 124.844 2.766 . . . . 0.0 113.497 -6.467 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.4 t 16.99 44.6 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.222 1 N-CA-C 123.456 4.613 . . . . 0.0 123.456 158.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -77.02 141.49 40.31 Favored 'General case' 0 CA--C 1.566 1.578 0 O-C-N 119.789 -1.82 . . . . 0.0 111.185 161.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 37.4 t80 68.58 -47.57 0.55 Allowed 'General case' 0 N--CA 1.512 2.64 0 C-N-CA 124.967 1.307 . . . . 0.0 113.319 -161.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -63.09 -21.37 66.13 Favored 'General case' 0 CA--C 1.574 1.885 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 172.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -73.87 -37.41 64.74 Favored 'General case' 0 CA--C 1.565 1.527 0 CA-C-N 121.795 2.089 . . . . 0.0 115.454 163.105 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 74.8 mmt-85 -60.06 -38.49 82.99 Favored 'General case' 0 CA--C 1.569 1.684 0 CA-C-N 120.506 1.503 . . . . 0.0 114.178 165.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 95.7 mt -68.09 -37.5 81.28 Favored 'General case' 0 CA--C 1.571 1.769 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 166.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.8 ttmp? -73.49 -38.96 65.21 Favored 'General case' 0 N--CA 1.501 2.076 0 CA-C-N 121.403 1.911 . . . . 0.0 114.375 -177.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -64.39 -38.19 90.18 Favored 'General case' 0 CA--C 1.577 1.998 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 167.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.39 -47.3 84.73 Favored 'General case' 0 CA--C 1.571 1.774 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 167.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -59.44 -28.19 66.75 Favored 'General case' 0 CA--C 1.569 1.693 0 N-CA-C 115.969 1.84 . . . . 0.0 115.969 169.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.2 -3.99 42.43 Favored 'General case' 0 CA--C 1.578 2.02 0 N-CA-C 115.989 1.848 . . . . 0.0 115.989 165.28 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 66.5 mmt-85 -79.63 -45.25 19.44 Favored 'General case' 0 CA--C 1.569 1.678 0 CA-C-N 121.686 2.039 . . . . 0.0 112.341 152.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -67.8 -48.47 66.19 Favored 'General case' 0 CA--C 1.574 1.87 0 CA-C-N 119.086 0.857 . . . . 0.0 113.104 -177.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 91.7 m -119.65 95.85 49.4 Favored Pre-proline 0 CA--C 1.581 2.159 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 168.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -84.66 62.41 6.36 Favored 'Trans proline' 0 CA--C 1.57 2.286 0 C-N-CA 123.51 2.807 . . . . 0.0 114.884 -176.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 78.7 m-85 . . . . . 0 N--CA 1.493 1.705 0 CA-C-O 124.923 2.297 . . . . 0.0 109.868 -169.8 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 86.6 m . . . . . 0 CA--C 1.563 1.457 0 CA-C-O 118.37 -0.824 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -81.63 78.27 8.39 Favored 'General case' 0 CA--C 1.569 1.7 0 CA-C-N 120.888 1.676 . . . . 0.0 112.133 -178.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 67.6 mttm 53.38 70.05 0.64 Allowed 'General case' 0 N--CA 1.505 2.296 0 C-N-CA 125.171 1.388 . . . . 0.0 111.711 -169.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.4 m 46.4 90.38 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.471 0 C-N-CA 126.209 1.804 . . . . 0.0 112.094 -163.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.23 82.5 1.31 Allowed 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 105.466 -2.049 . . . . 0.0 105.466 177.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -153.62 -142.33 3.44 Favored Glycine 0 CA--C 1.542 1.769 0 N-CA-C 114.791 0.676 . . . . 0.0 114.791 -156.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 10.1 tp -96.21 123.75 48.6 Favored 'Isoleucine or valine' 0 CA--C 1.573 1.842 0 CA-C-O 122.199 0.999 . . . . 0.0 110.587 -169.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.7 m -76.21 -45.63 32.18 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -166.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -128.82 77.39 1.78 Allowed 'General case' 0 CA--C 1.563 1.464 0 CA-C-N 120.639 1.563 . . . . 0.0 113.129 179.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 171.99 70.37 0.04 OUTLIER Glycine 0 N--CA 1.488 2.142 1 O-C-N 115.278 -4.639 . . . . 0.0 117.243 -29.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -78.04 45.86 1.92 Allowed 'Trans proline' 0 CA--C 1.576 2.598 0 CA-C-N 123.267 3.534 . . . . 0.0 116.134 169.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -85.99 76.04 9.88 Favored 'General case' 0 CA--C 1.569 1.707 0 O-C-N 120.609 -1.307 . . . . 0.0 109.373 170.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 18.2 pt-20 -101.33 -5.99 24.69 Favored 'General case' 0 N--CA 1.497 1.892 0 N-CA-C 118.259 2.689 . . . . 0.0 118.259 -159.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.5 t -60.39 -35.54 27.86 Favored Pre-proline 0 CA--C 1.581 2.163 0 CA-C-O 114.422 -2.704 . . . . 0.0 116.735 166.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -70.11 -57.29 0.12 Allowed 'Trans proline' 0 CA--C 1.564 1.989 0 CA-C-N 127.117 3.578 . . . . 0.0 114.745 172.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.5 m -164.19 80.59 0.4 Allowed 'General case' 0 CA--C 1.566 1.59 0 CA-C-N 119.641 1.109 . . . . 0.0 111.067 173.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -147.42 -42.47 0.17 Allowed 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 118.34 -0.838 . . . . 0.0 111.662 155.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -62.89 -38.16 89.79 Favored 'General case' 0 N--CA 1.499 1.979 0 CA-C-N 121.048 1.749 . . . . 0.0 113.982 163.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -47.49 -42.89 23.92 Favored 'General case' 0 CA--C 1.576 1.948 0 N-CA-C 115.194 1.553 . . . . 0.0 115.194 161.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -72.71 -37.32 67.83 Favored 'General case' 0 CA--C 1.566 1.564 0 N-CA-C 115.035 1.494 . . . . 0.0 115.035 170.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 58.5 mtt-85 -52.81 -45.37 67.2 Favored 'General case' 0 CA--C 1.579 2.067 0 CA-C-N 121.537 1.971 . . . . 0.0 113.476 165.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 95.6 mt -63.45 -40.21 96.54 Favored 'General case' 0 CA--C 1.57 1.727 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 168.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.0 mmpt? -62.54 -38.03 88.4 Favored 'General case' 0 N--CA 1.497 1.915 0 CA-C-N 121.086 1.766 . . . . 0.0 114.883 172.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -60.96 -46.66 89.82 Favored 'General case' 0 CA--C 1.569 1.7 0 CA-C-N 119.957 1.253 . . . . 0.0 113.306 168.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.409 ' O ' ' HB3' ' A' ' 28' ' ' ARG . . . -60.17 -50.35 74.03 Favored 'General case' 0 CA--C 1.57 1.732 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 170.553 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 20.1 m-30 -56.57 -37.31 70.41 Favored 'General case' 0 CA--C 1.574 1.876 0 CA-C-N 120.925 1.693 . . . . 0.0 114.795 170.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -25.64 68.43 Favored 'General case' 0 CA--C 1.582 2.174 0 N-CA-C 115.084 1.513 . . . . 0.0 115.084 170.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.409 ' HB3' ' O ' ' A' ' 25' ' ' ALA . 7.5 tpm_? -56.25 -35.37 67.32 Favored 'General case' 0 CA--C 1.578 2.024 0 CA-C-N 121.982 2.173 . . . . 0.0 115.308 162.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -102.92 -43.9 5.4 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 124.246 1.019 . . . . 0.0 112.42 -171.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 86.2 m -115.01 135.56 22.49 Favored Pre-proline 0 CA--C 1.574 1.866 0 CA-C-O 117.791 -1.099 . . . . 0.0 108.906 174.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -48.65 -35.34 29.5 Favored 'Trans proline' 0 CA--C 1.57 2.286 0 N-CA-C 119.077 2.684 . . . . 0.0 119.077 178.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 38.9 p90 . . . . . 0 CA--C 1.569 1.709 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 170.57 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 32.0 p . . . . . 0 CA--C 1.565 1.544 0 CA-C-O 122.11 0.957 . . . . 0.0 110.712 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -145.33 143.25 30.05 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.309 -0.87 . . . . 0.0 111.638 -176.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 28.4 mtmm 91.91 107.49 0.03 OUTLIER 'General case' 0 N--CA 1.51 2.555 0 C-N-CA 127.302 2.241 . . . . 0.0 107.403 -172.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.6 m -104.03 68.07 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 CA-C-O 122.784 1.278 . . . . 0.0 110.509 -172.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -133.41 70.43 1.46 Allowed 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 105.996 -1.853 . . . . 0.0 105.996 160.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 145.02 151.76 5.48 Favored Glycine 0 CA--C 1.544 1.853 0 C-N-CA 120.43 -0.891 . . . . 0.0 113.182 -141.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 16.7 tt -75.76 133.79 30.51 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.022 0 CA-C-O 121.821 0.82 . . . . 0.0 110.507 174.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.2 p -131.93 61.96 1.64 Allowed 'General case' 0 N--CA 1.503 2.183 0 CA-C-O 121.952 0.882 . . . . 0.0 110.198 177.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -145.06 70.85 1.28 Allowed 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 165.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.56 104.71 1.41 Allowed Glycine 0 CA--C 1.553 2.456 0 CA-C-O 116.519 -2.267 . . . . 0.0 111.768 -132.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -69.18 148.66 69.35 Favored 'Trans proline' 0 CA--C 1.56 1.786 0 CA-C-N 123.207 3.503 . . . . 0.0 114.429 -178.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -62.51 -35.61 79.94 Favored 'General case' 0 CA--C 1.576 1.978 0 CA-C-N 113.193 -1.821 . . . . 0.0 115.721 -178.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 65.19 -15.3 0.1 Allowed 'General case' 0 N--CA 1.509 2.522 0 N-CA-C 118.026 2.602 . . . . 0.0 118.026 164.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 45.6 t -54.32 -49.92 87.81 Favored Pre-proline 0 CA--C 1.584 2.288 0 CA-C-N 122.589 2.45 . . . . 0.0 115.827 -178.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -75.21 -8.58 19.95 Favored 'Trans proline' 0 CA--C 1.573 2.449 0 CA-C-N 125.995 3.177 . . . . 0.0 117.586 169.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 97.5 p -60.92 -43.15 99.0 Favored 'General case' 0 CA--C 1.567 1.614 0 N-CA-C 116.225 1.935 . . . . 0.0 116.225 -169.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.88 -38.0 89.5 Favored 'General case' 0 CA--C 1.571 1.785 0 N-CA-C 115.372 1.619 . . . . 0.0 115.372 171.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -63.92 -44.11 93.89 Favored 'General case' 0 CA--C 1.573 1.829 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 166.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 13.5 tp -58.17 -45.63 87.15 Favored 'General case' 0 CA--C 1.567 1.633 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 169.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -67.39 -39.59 85.62 Favored 'General case' 0 CA--C 1.562 1.433 0 N-CA-C 114.738 1.384 . . . . 0.0 114.738 173.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.9 ttp85 -49.4 -43.05 44.04 Favored 'General case' 0 CA--C 1.581 2.141 0 CA-C-N 121.484 1.947 . . . . 0.0 114.547 163.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 93.1 mt -67.97 -46.42 71.43 Favored 'General case' 0 CA--C 1.569 1.686 0 CA-C-O 117.594 -1.193 . . . . 0.0 113.642 168.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.6 mttm -66.14 -39.42 89.83 Favored 'General case' 0 N--CA 1.502 2.149 0 CA-C-N 121.8 2.091 . . . . 0.0 114.48 178.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -61.45 -33.59 74.0 Favored 'General case' 0 CA--C 1.571 1.773 0 N-CA-C 114.819 1.414 . . . . 0.0 114.819 169.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.11 -45.91 65.93 Favored 'General case' 0 CA--C 1.572 1.804 0 N-CA-C 115.056 1.502 . . . . 0.0 115.056 163.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 14.8 m-30 -69.98 -23.74 63.21 Favored 'General case' 0 CA--C 1.565 1.557 0 N-CA-C 116.413 2.005 . . . . 0.0 116.413 -178.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -72.72 73.28 1.08 Allowed 'General case' 0 CA--C 1.577 2.008 0 CA-C-N 121.445 1.929 . . . . 0.0 110.296 166.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.66 -55.76 0.03 OUTLIER 'General case' 0 CA--C 1.564 1.506 0 C-N-CA 125.757 1.623 . . . . 0.0 108.194 -169.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 24.7 p90 -75.32 -32.29 60.88 Favored 'General case' 0 CA--C 1.578 2.054 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 162.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 23.3 m -106.58 130.81 22.36 Favored Pre-proline 0 CA--C 1.576 1.958 0 CA-C-N 120.469 1.486 . . . . 0.0 108.458 170.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_exo -56.06 -35.1 94.31 Favored 'Trans proline' 0 CA--C 1.568 2.219 0 C-N-CA 122.985 2.457 . . . . 0.0 118.438 176.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 . . . . . 0 N--CA 1.488 1.447 0 CA-C-O 124.736 2.207 . . . . 0.0 107.802 169.393 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 42.2 t . . . . . 0 CA--C 1.559 1.321 0 CA-C-O 121.164 0.506 . . . . 0.0 109.991 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.26 31.04 5.43 Favored 'General case' 0 CA--C 1.574 1.891 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 -177.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -74.36 100.93 3.92 Favored 'General case' 0 CA--C 1.569 1.693 0 O-C-N 120.333 -1.48 . . . . 0.0 111.359 -174.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.8 m 42.91 47.54 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.516 2.845 0 C-N-CA 125.558 1.543 . . . . 0.0 114.56 -166.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -165.86 77.6 0.25 Allowed 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 179.659 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -78.66 -87.39 0.48 Allowed Glycine 0 N--CA 1.488 2.111 0 N-CA-C 116.495 1.358 . . . . 0.0 116.495 -155.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 44.7 mt -89.8 87.7 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.072 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 -177.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 76.7 p -118.92 85.12 2.31 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 -172.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -155.32 66.52 0.64 Allowed 'General case' 0 CA--C 1.566 1.574 0 N-CA-C 105.342 -2.095 . . . . 0.0 105.342 160.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.82 94.34 0.89 Allowed Glycine 0 CA--C 1.557 2.668 0 CA-C-O 116.957 -2.024 . . . . 0.0 113.787 -137.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_exo -56.56 105.26 0.16 Allowed 'Trans proline' 0 CA--C 1.56 1.792 0 CA-C-N 122.272 3.036 . . . . 0.0 114.889 175.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -72.4 -33.64 67.3 Favored 'General case' 0 N--CA 1.499 2.014 0 N-CA-C 116.357 1.984 . . . . 0.0 116.357 -171.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -80.67 -39.38 27.36 Favored 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 115.093 1.516 . . . . 0.0 115.093 -169.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 30.1 t -57.3 -51.63 80.22 Favored Pre-proline 0 CA--C 1.584 2.265 0 CA-C-O 115.425 -2.226 . . . . 0.0 114.282 171.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -64.71 -47.12 5.69 Favored 'Trans proline' 0 CA--C 1.562 1.919 0 CA-C-N 125.718 3.078 . . . . 0.0 114.949 169.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 76.1 p -65.06 -34.19 77.83 Favored 'General case' 0 CA--C 1.573 1.863 0 CA-C-N 122.77 2.532 . . . . 0.0 115.678 -178.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.0 -42.95 84.14 Favored 'General case' 0 CA--C 1.571 1.776 0 CA-C-N 120.841 1.655 . . . . 0.0 114.877 164.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -67.28 -40.17 86.09 Favored 'General case' 0 CA--C 1.573 1.855 0 CA-C-N 120.44 1.473 . . . . 0.0 114.6 173.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.0 mp -56.12 -39.17 71.81 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 165.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.99 -34.12 61.95 Favored 'General case' 0 CA--C 1.569 1.706 0 CA-C-N 120.885 1.675 . . . . 0.0 115.213 172.562 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 74.8 ttt-85 -53.08 -44.35 67.47 Favored 'General case' 0 CA--C 1.578 2.053 0 CA-C-N 120.568 1.531 . . . . 0.0 114.243 159.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 94.7 mt -70.31 -39.97 74.47 Favored 'General case' 0 CA--C 1.569 1.699 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 171.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 61.0 tttm -69.05 -41.77 77.18 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-N 120.779 1.627 . . . . 0.0 114.227 -174.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -62.54 -31.19 71.94 Favored 'General case' 0 CA--C 1.58 2.115 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 168.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.24 -41.82 39.68 Favored 'General case' 0 CA--C 1.573 1.83 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 168.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 22.4 m-30 -57.91 -39.73 78.67 Favored 'General case' 0 CA--C 1.577 2.017 0 CA-C-N 121.451 1.932 . . . . 0.0 114.717 170.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 30.5 ttp180 -50.11 -38.31 38.18 Favored 'General case' 0 CA--C 1.579 2.087 0 N-CA-C 116.029 1.862 . . . . 0.0 116.029 157.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.6 tpm_? -76.34 -42.11 46.0 Favored 'General case' 0 CA--C 1.572 1.819 0 CA-C-N 121.424 1.92 . . . . 0.0 113.999 172.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -68.22 -18.59 64.61 Favored 'General case' 0 N--CA 1.503 2.21 0 N-CA-C 114.801 1.408 . . . . 0.0 114.801 174.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 17.8 m -69.28 124.8 91.21 Favored Pre-proline 0 CA--C 1.583 2.22 0 C-N-CA 123.88 0.872 . . . . 0.0 108.858 159.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -76.55 -22.57 12.09 Favored 'Trans proline' 0 CA--C 1.567 2.169 0 N-CA-C 117.925 2.24 . . . . 0.0 117.925 -162.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 124.597 2.141 . . . . 0.0 112.302 -160.433 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 53.3 t . . . . . 0 CA--C 1.564 1.483 0 CA-C-O 118.134 -0.936 . . . . 0.0 108.81 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -145.37 89.85 1.97 Allowed 'General case' 0 CA--C 1.571 1.765 0 CA-C-N 120.304 1.411 . . . . 0.0 110.272 175.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 42.3 tptt -141.0 127.87 20.46 Favored 'General case' 0 CA--C 1.563 1.477 1 O-C-N 114.76 -4.962 . . . . 0.0 110.213 -22.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.3 p -94.99 84.26 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.569 1.703 0 CA-C-O 123.765 1.745 . . . . 0.0 108.014 179.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.91 78.71 1.49 Allowed 'General case' 0 CA--C 1.567 1.602 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 168.733 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -128.71 112.0 1.33 Allowed Glycine 0 N--CA 1.483 1.774 0 O-C-N 121.023 -1.048 . . . . 0.0 114.587 -145.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 90.9 mt -129.95 101.39 6.01 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 N-CA-C 104.805 -2.294 . . . . 0.0 104.805 173.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 99.0 m -155.75 -62.63 0.11 Allowed 'General case' 0 N--CA 1.504 2.239 0 O-C-N 120.308 -1.495 . . . . 0.0 110.898 -177.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -141.11 63.49 1.44 Allowed 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 106.216 -1.772 . . . . 0.0 106.216 174.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 65.64 -171.87 24.88 Favored Glycine 0 CA--C 1.57 3.493 0 N-CA-C 116.571 1.389 . . . . 0.0 116.571 -135.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -63.06 84.5 0.11 Allowed 'Trans proline' 0 CA--C 1.568 2.217 0 C-N-CA 123.641 2.894 . . . . 0.0 115.044 164.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -92.61 28.48 2.0 Allowed 'General case' 0 CA--C 1.579 2.06 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 -165.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -167.26 146.08 5.03 Favored 'General case' 0 CA--C 1.566 1.569 0 O-C-N 120.385 -1.447 . . . . 0.0 110.928 -172.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 30.4 t -121.82 -69.2 0.02 OUTLIER Pre-proline 0 CA--C 1.572 1.827 0 CA-C-O 115.419 -2.229 . . . . 0.0 107.35 144.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -81.36 19.62 1.15 Allowed 'Trans proline' 0 CA--C 1.58 2.795 0 CA-C-N 126.034 3.191 . . . . 0.0 117.167 169.129 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 59.6 p 66.64 -110.21 0.15 Allowed 'General case' 0 N--CA 1.498 1.97 0 C-N-CA 126.456 1.902 . . . . 0.0 109.155 -157.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . 62.13 -60.19 0.12 Allowed 'General case' 0 N--CA 1.508 2.435 0 N-CA-C 116.532 2.049 . . . . 0.0 116.532 169.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -65.69 -48.35 72.35 Favored 'General case' 0 N--CA 1.496 1.861 0 CA-C-N 120.5 1.5 . . . . 0.0 112.894 158.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 16.3 tp -50.68 -44.35 57.8 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 164.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -66.91 -39.81 87.52 Favored 'General case' 0 CA--C 1.564 1.502 0 N-CA-C 115.791 1.774 . . . . 0.0 115.791 173.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 78.9 mtt85 -54.04 -44.06 70.69 Favored 'General case' 0 CA--C 1.573 1.857 0 CA-C-N 121.571 1.987 . . . . 0.0 114.145 163.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 98.4 mt -64.42 -40.08 95.08 Favored 'General case' 0 CA--C 1.569 1.686 0 CA-C-O 117.222 -1.37 . . . . 0.0 113.726 169.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -66.01 -38.07 87.53 Favored 'General case' 0 N--CA 1.502 2.147 0 CA-C-N 122.159 2.254 . . . . 0.0 113.952 173.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -64.65 -38.18 90.11 Favored 'General case' 0 CA--C 1.577 2.011 0 N-CA-C 113.971 1.1 . . . . 0.0 113.971 170.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.93 -42.69 84.9 Favored 'General case' 0 CA--C 1.571 1.767 0 N-CA-C 115.885 1.809 . . . . 0.0 115.885 165.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 15.8 m-30 -75.26 -29.62 60.24 Favored 'General case' 0 CA--C 1.568 1.672 0 CA-C-N 120.5 1.5 . . . . 0.0 114.693 179.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -72.47 61.09 0.48 Allowed 'General case' 0 CA--C 1.581 2.168 0 CA-C-N 120.873 1.67 . . . . 0.0 112.394 165.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 94.4 mtt180 -158.27 -55.34 0.07 Allowed 'General case' 0 CA--C 1.567 1.632 0 C-N-CA 125.909 1.684 . . . . 0.0 109.608 -173.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 22.4 p90 -64.43 -35.28 80.41 Favored 'General case' 0 N--CA 1.502 2.147 0 N-CA-C 115.188 1.551 . . . . 0.0 115.188 -176.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.1 t -110.46 104.47 55.92 Favored Pre-proline 0 CA--C 1.57 1.733 0 CA-C-N 120.315 1.416 . . . . 0.0 107.695 160.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_exo -52.01 -43.12 54.63 Favored 'Trans proline' 0 CA--C 1.567 2.144 0 C-N-CA 123.097 2.531 . . . . 0.0 116.065 168.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 . . . . . 0 N--CA 1.489 1.509 0 CA-C-O 125.466 2.555 . . . . 0.0 111.719 170.029 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.45 ' N ' ' HZ2' ' A' ' 5' ' ' LYS . 50.7 t . . . . . 0 CA--C 1.563 1.474 0 CA-C-O 118.325 -0.845 . . . . 0.0 108.855 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -92.62 76.14 5.02 Favored 'General case' 0 CA--C 1.566 1.558 0 CA-C-N 120.792 1.633 . . . . 0.0 111.636 176.256 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -163.16 104.34 0.99 Allowed 'General case' 0 CA--C 1.568 1.637 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 174.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.0 p 44.42 70.72 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.473 0 C-N-CA 127.078 2.151 . . . . 0.0 116.525 170.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.45 ' HZ2' ' N ' ' A' ' 1' ' ' CYS . 0.0 OUTLIER -160.42 72.37 0.47 Allowed 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 155.52 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -176.23 94.05 0.1 OUTLIER Glycine 0 N--CA 1.48 1.583 0 O-C-N 121.318 -0.864 . . . . 0.0 114.083 -158.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 42.1 mm -77.94 129.57 37.3 Favored 'Isoleucine or valine' 0 CA--C 1.576 1.964 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 175.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 56.3 m -73.73 107.57 6.06 Favored 'General case' 0 CA--C 1.572 1.819 0 O-C-N 121.563 -0.711 . . . . 0.0 112.366 -163.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 50.54 75.87 0.17 Allowed 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 116.311 1.967 . . . . 0.0 116.311 173.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -159.54 68.44 0.26 Allowed Glycine 0 CA--C 1.548 2.101 1 O-C-N 115.589 -4.444 . . . . 0.0 115.516 -36.048 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -79.38 67.62 8.54 Favored 'Trans proline' 0 CA--C 1.571 2.375 0 CA-C-N 122.517 3.158 . . . . 0.0 114.321 174.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -92.72 65.8 4.31 Favored 'General case' 0 CA--C 1.57 1.731 0 O-C-N 121.125 -0.985 . . . . 0.0 110.348 179.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 50.16 54.08 11.72 Favored 'General case' 0 N--CA 1.507 2.397 0 C-N-CA 124.583 1.153 . . . . 0.0 113.879 -162.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 36.1 t -65.64 -51.36 50.49 Favored Pre-proline 0 CA--C 1.579 2.068 0 CA-C-O 115.601 -2.143 . . . . 0.0 113.344 175.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -65.85 -22.51 56.27 Favored 'Trans proline' 0 CA--C 1.575 2.564 0 CA-C-N 125.667 3.06 . . . . 0.0 116.63 161.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.7 m 66.3 -89.14 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 125.826 1.65 . . . . 0.0 111.935 171.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . 58.54 -72.55 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.98 0 C-N-CA 126.655 1.982 . . . . 0.0 115.498 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -63.23 -47.11 83.87 Favored 'General case' 0 N--CA 1.497 1.878 0 CA-C-N 120.776 1.625 . . . . 0.0 113.124 165.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.95 -42.35 68.79 Favored 'General case' 0 N--CA 1.496 1.872 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 165.292 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -66.67 -45.85 77.6 Favored 'General case' 0 CA--C 1.563 1.474 0 N-CA-C 114.83 1.419 . . . . 0.0 114.83 174.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.97 -38.62 57.29 Favored 'General case' 0 CA--C 1.576 1.96 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 167.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 82.7 mt -70.88 -41.93 70.7 Favored 'General case' 0 CA--C 1.571 1.785 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 166.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 34.8 ttpt -64.79 -44.58 89.51 Favored 'General case' 0 N--CA 1.494 1.744 0 CA-C-N 121.092 1.769 . . . . 0.0 114.34 -177.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -62.5 -35.86 80.7 Favored 'General case' 0 CA--C 1.575 1.905 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 173.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.12 -56.04 22.8 Favored 'General case' 0 CA--C 1.57 1.748 0 N-CA-C 113.982 1.105 . . . . 0.0 113.982 164.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -57.66 -41.28 81.17 Favored 'General case' 0 CA--C 1.571 1.757 0 CA-C-N 120.641 1.564 . . . . 0.0 115.192 176.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.7 tpm_? -64.89 -35.0 79.72 Favored 'General case' 0 CA--C 1.574 1.883 0 CA-C-N 120.453 1.479 . . . . 0.0 114.607 169.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.8 ttt180 -61.71 -38.42 87.79 Favored 'General case' 0 CA--C 1.573 1.834 0 CA-C-N 121.632 2.014 . . . . 0.0 114.409 169.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -102.14 10.88 39.08 Favored 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 114.741 1.386 . . . . 0.0 114.741 -177.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 78.7 m -99.24 130.17 27.75 Favored Pre-proline 0 CA--C 1.574 1.899 0 CA-C-N 119.992 1.269 . . . . 0.0 108.011 172.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_endo -74.3 -22.61 16.28 Favored 'Trans proline' 0 CA--C 1.569 2.253 0 C-N-CA 122.58 2.186 . . . . 0.0 117.136 -177.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 125.023 2.344 . . . . 0.0 110.797 -173.518 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 99.9 m . . . . . 0 CA--C 1.56 1.331 0 CA-C-O 120.809 0.338 . . . . 0.0 110.202 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -89.68 37.5 0.88 Allowed 'General case' 0 CA--C 1.576 1.945 0 N-CA-C 115.347 1.61 . . . . 0.0 115.347 175.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.2 tptt -162.94 -59.62 0.04 OUTLIER 'General case' 0 CA--C 1.567 1.609 0 O-C-N 120.696 -1.253 . . . . 0.0 110.43 174.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 48.9 t -93.43 70.39 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.575 1.914 0 CA-C-O 122.746 1.26 . . . . 0.0 108.759 -177.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.2 pttm -157.05 44.29 0.37 Allowed 'General case' 0 CA--C 1.575 1.906 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 149.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 72.84 50.3 14.3 Favored Glycine 0 CA--C 1.55 2.273 0 N-CA-C 120.766 3.066 . . . . 0.0 120.766 -165.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 72.6 mt -131.47 113.11 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 176.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 36.6 p -105.42 -80.42 0.55 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 120.906 -1.121 . . . . 0.0 108.497 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 34.4 tp60 -150.42 82.18 1.36 Allowed 'General case' 0 CA--C 1.552 1.044 0 CA-C-N 120.967 1.712 . . . . 0.0 110.469 178.179 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -95.01 -70.22 1.08 Allowed Glycine 0 N--CA 1.496 2.694 1 O-C-N 115.545 -4.472 . . . . 0.0 116.652 -24.206 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -77.15 91.32 1.18 Allowed 'Trans proline' 0 CA--C 1.566 2.121 0 CA-C-N 122.726 3.263 . . . . 0.0 114.278 -167.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -76.3 -45.61 31.66 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 114.667 1.358 . . . . 0.0 114.667 -174.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -84.07 7.89 17.2 Favored 'General case' 0 CA--C 1.574 1.896 0 N-CA-C 117.461 2.393 . . . . 0.0 117.461 -168.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 38.8 t -87.15 -56.06 0.34 Allowed Pre-proline 0 CA--C 1.579 2.063 0 CA-C-O 115.326 -2.274 . . . . 0.0 111.688 162.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -68.3 -41.85 6.34 Favored 'Trans proline' 0 CA--C 1.572 2.378 0 CA-C-N 126.089 3.21 . . . . 0.0 116.174 173.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.2 t -104.44 174.06 6.04 Favored 'General case' 0 CA--C 1.568 1.663 0 CA-C-N 119.499 1.045 . . . . 0.0 111.668 167.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . 65.01 -48.88 0.35 Allowed 'General case' 0 N--CA 1.508 2.45 0 N-CA-C 115.869 1.803 . . . . 0.0 115.869 175.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -57.58 -46.5 83.92 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 119.459 -2.025 . . . . 0.0 113.597 154.037 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 36.8 tp -50.67 -44.28 57.63 Favored 'General case' 0 CA--C 1.574 1.885 0 N-CA-C 115.203 1.557 . . . . 0.0 115.203 166.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -75.31 -34.59 61.27 Favored 'General case' 0 CA--C 1.567 1.613 0 N-CA-C 114.965 1.469 . . . . 0.0 114.965 174.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 58.4 mtm180 -55.17 -43.74 74.58 Favored 'General case' 0 CA--C 1.577 1.989 0 CA-C-N 121.458 1.935 . . . . 0.0 113.776 163.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.1 mt -65.18 -36.75 85.19 Favored 'General case' 0 CA--C 1.575 1.905 0 N-CA-C 114.775 1.398 . . . . 0.0 114.775 166.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 18.9 ttmm -69.15 -41.01 77.84 Favored 'General case' 0 N--CA 1.494 1.767 0 CA-C-N 120.101 1.319 . . . . 0.0 113.889 177.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.4 mm-40 -58.23 -45.93 86.81 Favored 'General case' 0 CA--C 1.565 1.542 0 CA-C-N 119.779 1.172 . . . . 0.0 114.03 164.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.88 -52.85 63.8 Favored 'General case' 0 CA--C 1.571 1.761 0 N-CA-C 114.491 1.293 . . . . 0.0 114.491 172.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -65.06 -34.99 79.73 Favored 'General case' 0 CA--C 1.572 1.809 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 172.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -68.36 -42.81 78.66 Favored 'General case' 0 N--CA 1.494 1.747 0 CA-C-N 121.198 1.817 . . . . 0.0 114.511 173.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 92.3 mtt180 -67.83 -41.85 82.4 Favored 'General case' 0 CA--C 1.575 1.912 0 CA-C-N 120.789 1.632 . . . . 0.0 113.992 167.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -129.38 74.48 1.59 Allowed 'General case' 0 CA--C 1.568 1.662 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 -166.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 2.7 m -91.54 112.23 53.26 Favored Pre-proline 0 CA--C 1.573 1.839 0 O-C-N 120.714 -1.241 . . . . 0.0 108.128 -170.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -89.7 61.77 2.09 Favored 'Trans proline' 0 CA--C 1.571 2.352 0 CA-C-N 122.756 2.02 . . . . 0.0 115.2 -158.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 124.856 2.265 . . . . 0.0 108.561 -171.722 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.2 t . . . . . 0 CA--C 1.562 1.41 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.19 -27.33 68.62 Favored 'General case' 0 CA--C 1.571 1.775 0 N-CA-C 116.233 1.938 . . . . 0.0 116.233 175.714 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -75.46 -46.86 30.02 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-N 120.168 1.349 . . . . 0.0 113.77 163.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -59.79 -30.35 68.84 Favored 'General case' 0 CA--C 1.572 1.81 0 N-CA-C 115.099 1.518 . . . . 0.0 115.099 171.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -72.77 -41.77 64.7 Favored 'General case' 0 CA--C 1.563 1.445 0 CA-C-N 121.605 2.002 . . . . 0.0 114.525 170.566 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 79.5 mtm180 -54.86 -38.2 67.18 Favored 'General case' 0 CA--C 1.578 2.026 0 CA-C-N 120.594 1.543 . . . . 0.0 114.439 163.084 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 97.4 mt -68.49 -40.65 80.83 Favored 'General case' 0 CA--C 1.571 1.761 0 CA-C-O 117.661 -1.162 . . . . 0.0 114.045 167.83 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -72.28 -35.44 68.71 Favored 'General case' 0 N--CA 1.498 1.972 0 CA-C-N 121.677 2.035 . . . . 0.0 114.271 -178.374 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -64.71 -35.94 82.67 Favored 'General case' 0 CA--C 1.575 1.925 0 CA-C-N 121.235 1.834 . . . . 0.0 114.09 167.407 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.8 -55.89 22.33 Favored 'General case' 0 CA--C 1.57 1.726 0 CA-C-N 120.051 1.296 . . . . 0.0 113.558 166.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 14.8 m-30 -59.24 -35.24 73.32 Favored 'General case' 0 CA--C 1.568 1.657 0 N-CA-C 115.125 1.528 . . . . 0.0 115.125 175.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 2.9 tpp180 -69.93 -24.07 63.3 Favored 'General case' 0 CA--C 1.57 1.739 0 N-CA-C 115.536 1.68 . . . . 0.0 115.536 167.419 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 49.9 tpt85 -63.37 -32.87 74.41 Favored 'General case' 0 CA--C 1.577 1.991 0 CA-C-N 121.291 1.86 . . . . 0.0 114.845 164.737 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 9.5 p90 -120.48 39.22 3.79 Favored 'General case' 0 CA--C 1.578 2.04 0 C-N-CA 124.262 1.025 . . . . 0.0 113.544 174.202 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 57.2 m . . . . . 0 CA--C 1.581 2.154 0 O-C-N 119.755 -1.84 . . . . 0.0 106.362 166.838 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.4 m . . . . . 0 CA--C 1.568 1.656 0 CA-C-O 121.875 0.845 . . . . 0.0 110.899 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -148.53 -37.88 0.18 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.028 -1.045 . . . . 0.0 112.396 158.122 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -71.54 -42.2 68.2 Favored 'General case' 0 N--CA 1.5 2.072 0 CA-C-N 121.369 1.895 . . . . 0.0 112.92 161.084 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.6 mp -51.79 -46.46 64.21 Favored 'General case' 0 CA--C 1.574 1.902 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 164.496 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 82.8 mt-10 -64.47 -40.5 95.8 Favored 'General case' 0 CA--C 1.565 1.546 0 N-CA-C 116.015 1.858 . . . . 0.0 116.015 171.265 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 71.2 mtm180 -55.79 -37.34 68.47 Favored 'General case' 0 CA--C 1.577 1.988 0 CA-C-N 121.379 1.9 . . . . 0.0 114.44 166.136 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 93.6 mt -67.94 -39.1 83.51 Favored 'General case' 0 CA--C 1.573 1.853 0 CA-C-O 117.56 -1.21 . . . . 0.0 113.854 166.138 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -64.68 -42.02 95.64 Favored 'General case' 0 N--CA 1.5 2.039 0 CA-C-N 121.849 2.113 . . . . 0.0 114.368 177.095 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -69.47 -35.57 75.73 Favored 'General case' 0 CA--C 1.571 1.77 0 CA-C-N 120.018 1.281 . . . . 0.0 114.276 171.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.79 -51.42 69.41 Favored 'General case' 0 CA--C 1.574 1.866 0 CA-C-N 120.817 1.644 . . . . 0.0 114.465 167.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 34.8 m-85 -72.78 -7.25 49.78 Favored 'General case' 0 CA--C 1.576 1.946 0 N-CA-C 116.218 1.932 . . . . 0.0 116.218 172.583 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -105.1 54.0 0.71 Allowed 'General case' 0 CA--C 1.571 1.781 0 CA-C-N 121.675 2.034 . . . . 0.0 111.626 162.042 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 34.3 ttp-105 -169.41 -37.5 0.02 OUTLIER 'General case' 0 CA--C 1.569 1.707 0 C-N-CA 124.819 1.248 . . . . 0.0 111.883 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -54.51 -28.94 48.67 Favored 'General case' 0 CA--C 1.581 2.141 0 N-CA-C 117.471 2.397 . . . . 0.0 117.471 178.743 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.2 t . . . . . 0 CA--C 1.579 2.079 0 CA-C-N 120.112 1.324 . . . . 0.0 108.912 159.082 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.4 t . . . . . 0 N--CA 1.503 2.222 1 N-CA-C 123.456 4.613 . . . . 0.0 123.456 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -77.02 141.49 40.31 Favored 'General case' 0 CA--C 1.566 1.578 0 O-C-N 119.789 -1.82 . . . . 0.0 111.185 161.56 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 37.4 t80 68.58 -47.57 0.55 Allowed 'General case' 0 N--CA 1.512 2.64 0 C-N-CA 124.967 1.307 . . . . 0.0 113.319 -161.229 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -63.09 -21.37 66.13 Favored 'General case' 0 CA--C 1.574 1.885 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 172.053 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -73.87 -37.41 64.74 Favored 'General case' 0 CA--C 1.565 1.527 0 CA-C-N 121.795 2.089 . . . . 0.0 115.454 163.105 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 74.8 mmt-85 -60.06 -38.49 82.99 Favored 'General case' 0 CA--C 1.569 1.684 0 CA-C-N 120.506 1.503 . . . . 0.0 114.178 165.256 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 95.7 mt -68.09 -37.5 81.28 Favored 'General case' 0 CA--C 1.571 1.769 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 166.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.8 ttmp? -73.49 -38.96 65.21 Favored 'General case' 0 N--CA 1.501 2.076 0 CA-C-N 121.403 1.911 . . . . 0.0 114.375 -177.253 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -64.39 -38.19 90.18 Favored 'General case' 0 CA--C 1.577 1.998 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 167.243 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.39 -47.3 84.73 Favored 'General case' 0 CA--C 1.571 1.774 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 167.637 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -59.44 -28.19 66.75 Favored 'General case' 0 CA--C 1.569 1.693 0 N-CA-C 115.969 1.84 . . . . 0.0 115.969 169.049 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.2 -3.99 42.43 Favored 'General case' 0 CA--C 1.578 2.02 0 N-CA-C 115.989 1.848 . . . . 0.0 115.989 165.28 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 66.5 mmt-85 -79.63 -45.25 19.44 Favored 'General case' 0 CA--C 1.569 1.678 0 CA-C-N 121.686 2.039 . . . . 0.0 112.341 152.59 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -67.8 -48.47 66.19 Favored 'General case' 0 CA--C 1.574 1.87 0 CA-C-N 119.086 0.857 . . . . 0.0 113.104 -177.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 91.7 m . . . . . 0 CA--C 1.581 2.159 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 168.291 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.5 m . . . . . 0 CA--C 1.566 1.59 0 CA-C-O 122.328 1.061 . . . . 0.0 111.067 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -147.42 -42.47 0.17 Allowed 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 118.34 -0.838 . . . . 0.0 111.662 155.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -62.89 -38.16 89.79 Favored 'General case' 0 N--CA 1.499 1.979 0 CA-C-N 121.048 1.749 . . . . 0.0 113.982 163.49 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -47.49 -42.89 23.92 Favored 'General case' 0 CA--C 1.576 1.948 0 N-CA-C 115.194 1.553 . . . . 0.0 115.194 161.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -72.71 -37.32 67.83 Favored 'General case' 0 CA--C 1.566 1.564 0 N-CA-C 115.035 1.494 . . . . 0.0 115.035 170.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 58.5 mtt-85 -52.81 -45.37 67.2 Favored 'General case' 0 CA--C 1.579 2.067 0 CA-C-N 121.537 1.971 . . . . 0.0 113.476 165.185 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 95.6 mt -63.45 -40.21 96.54 Favored 'General case' 0 CA--C 1.57 1.727 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 168.148 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.0 mmpt? -62.54 -38.03 88.4 Favored 'General case' 0 N--CA 1.497 1.915 0 CA-C-N 121.086 1.766 . . . . 0.0 114.883 172.588 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -60.96 -46.66 89.82 Favored 'General case' 0 CA--C 1.569 1.7 0 CA-C-N 119.957 1.253 . . . . 0.0 113.306 168.831 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.411 ' O ' ' HB3' ' A' ' 28' ' ' ARG . . . -60.17 -50.35 74.03 Favored 'General case' 0 CA--C 1.57 1.732 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 170.553 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 20.1 m-30 -56.57 -37.31 70.41 Favored 'General case' 0 CA--C 1.574 1.876 0 CA-C-N 120.925 1.693 . . . . 0.0 114.795 170.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -25.64 68.43 Favored 'General case' 0 CA--C 1.582 2.174 0 N-CA-C 115.084 1.513 . . . . 0.0 115.084 170.829 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.411 ' HB3' ' O ' ' A' ' 25' ' ' ALA . 7.5 tpm_? -56.25 -35.37 67.32 Favored 'General case' 0 CA--C 1.578 2.024 0 CA-C-N 121.982 2.173 . . . . 0.0 115.308 162.85 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -102.92 -43.9 5.4 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 124.246 1.019 . . . . 0.0 112.42 -171.591 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 86.2 m . . . . . 0 CA--C 1.574 1.866 0 CA-C-O 117.791 -1.099 . . . . 0.0 108.906 174.486 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 97.5 p . . . . . 0 CA--C 1.567 1.614 0 N-CA-C 116.225 1.935 . . . . 0.0 116.225 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.88 -38.0 89.5 Favored 'General case' 0 CA--C 1.571 1.785 0 N-CA-C 115.372 1.619 . . . . 0.0 115.372 171.795 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -63.92 -44.11 93.89 Favored 'General case' 0 CA--C 1.573 1.829 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 166.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 13.5 tp -58.17 -45.63 87.15 Favored 'General case' 0 CA--C 1.567 1.633 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 169.034 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -67.39 -39.59 85.62 Favored 'General case' 0 CA--C 1.562 1.433 0 N-CA-C 114.738 1.384 . . . . 0.0 114.738 173.223 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.9 ttp85 -49.4 -43.05 44.04 Favored 'General case' 0 CA--C 1.581 2.141 0 CA-C-N 121.484 1.947 . . . . 0.0 114.547 163.832 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 93.1 mt -67.97 -46.42 71.43 Favored 'General case' 0 CA--C 1.569 1.686 0 CA-C-O 117.594 -1.193 . . . . 0.0 113.642 168.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.6 mttm -66.14 -39.42 89.83 Favored 'General case' 0 N--CA 1.502 2.149 0 CA-C-N 121.8 2.091 . . . . 0.0 114.48 178.646 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -61.45 -33.59 74.0 Favored 'General case' 0 CA--C 1.571 1.773 0 N-CA-C 114.819 1.414 . . . . 0.0 114.819 169.551 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.11 -45.91 65.93 Favored 'General case' 0 CA--C 1.572 1.804 0 N-CA-C 115.056 1.502 . . . . 0.0 115.056 163.381 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 14.8 m-30 -69.98 -23.74 63.21 Favored 'General case' 0 CA--C 1.565 1.557 0 N-CA-C 116.413 2.005 . . . . 0.0 116.413 -178.404 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -72.72 73.28 1.08 Allowed 'General case' 0 CA--C 1.577 2.008 0 CA-C-N 121.445 1.929 . . . . 0.0 110.296 166.749 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.66 -55.76 0.03 OUTLIER 'General case' 0 CA--C 1.564 1.506 0 C-N-CA 125.757 1.623 . . . . 0.0 108.194 -169.78 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 24.7 p90 -75.32 -32.29 60.88 Favored 'General case' 0 CA--C 1.578 2.054 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 162.413 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 23.3 m . . . . . 0 CA--C 1.576 1.958 0 CA-C-N 120.469 1.486 . . . . 0.0 108.458 170.945 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 76.1 p . . . . . 0 CA--C 1.573 1.863 0 N-CA-C 115.678 1.733 . . . . 0.0 115.678 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.0 -42.95 84.14 Favored 'General case' 0 CA--C 1.571 1.776 0 CA-C-N 120.841 1.655 . . . . 0.0 114.877 164.193 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -67.28 -40.17 86.09 Favored 'General case' 0 CA--C 1.573 1.855 0 CA-C-N 120.44 1.473 . . . . 0.0 114.6 173.441 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.0 mp -56.12 -39.17 71.81 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 165.227 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.99 -34.12 61.95 Favored 'General case' 0 CA--C 1.569 1.706 0 CA-C-N 120.885 1.675 . . . . 0.0 115.213 172.562 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 74.8 ttt-85 -53.08 -44.35 67.47 Favored 'General case' 0 CA--C 1.578 2.053 0 CA-C-N 120.568 1.531 . . . . 0.0 114.243 159.071 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 94.7 mt -70.31 -39.97 74.47 Favored 'General case' 0 CA--C 1.569 1.699 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 171.218 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 61.0 tttm -69.05 -41.77 77.18 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-N 120.779 1.627 . . . . 0.0 114.227 -174.44 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -62.54 -31.19 71.94 Favored 'General case' 0 CA--C 1.58 2.115 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 168.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.24 -41.82 39.68 Favored 'General case' 0 CA--C 1.573 1.83 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 168.393 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 22.4 m-30 -57.91 -39.73 78.67 Favored 'General case' 0 CA--C 1.577 2.017 0 CA-C-N 121.451 1.932 . . . . 0.0 114.717 170.079 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 30.5 ttp180 -50.11 -38.31 38.18 Favored 'General case' 0 CA--C 1.579 2.087 0 N-CA-C 116.029 1.862 . . . . 0.0 116.029 157.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.6 tpm_? -76.34 -42.11 46.0 Favored 'General case' 0 CA--C 1.572 1.819 0 CA-C-N 121.424 1.92 . . . . 0.0 113.999 172.588 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -68.22 -18.59 64.61 Favored 'General case' 0 N--CA 1.503 2.21 0 N-CA-C 114.801 1.408 . . . . 0.0 114.801 174.146 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 17.8 m . . . . . 0 CA--C 1.583 2.22 0 C-N-CA 123.88 0.872 . . . . 0.0 108.858 159.715 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 59.6 p . . . . . 0 N--CA 1.498 1.97 0 CA-C-O 116.972 -1.49 . . . . 0.0 109.155 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . 62.13 -60.19 0.12 Allowed 'General case' 0 N--CA 1.508 2.435 0 N-CA-C 116.532 2.049 . . . . 0.0 116.532 169.387 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -65.69 -48.35 72.35 Favored 'General case' 0 N--CA 1.496 1.861 0 CA-C-N 120.5 1.5 . . . . 0.0 112.894 158.784 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 16.3 tp -50.68 -44.35 57.8 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 164.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -66.91 -39.81 87.52 Favored 'General case' 0 CA--C 1.564 1.502 0 N-CA-C 115.791 1.774 . . . . 0.0 115.791 173.232 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 78.9 mtt85 -54.04 -44.06 70.69 Favored 'General case' 0 CA--C 1.573 1.857 0 CA-C-N 121.571 1.987 . . . . 0.0 114.145 163.191 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 98.4 mt -64.42 -40.08 95.08 Favored 'General case' 0 CA--C 1.569 1.686 0 CA-C-O 117.222 -1.37 . . . . 0.0 113.726 169.159 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -66.01 -38.07 87.53 Favored 'General case' 0 N--CA 1.502 2.147 0 CA-C-N 122.159 2.254 . . . . 0.0 113.952 173.321 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -64.65 -38.18 90.11 Favored 'General case' 0 CA--C 1.577 2.011 0 N-CA-C 113.971 1.1 . . . . 0.0 113.971 170.115 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.93 -42.69 84.9 Favored 'General case' 0 CA--C 1.571 1.767 0 N-CA-C 115.885 1.809 . . . . 0.0 115.885 165.578 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 15.8 m-30 -75.26 -29.62 60.24 Favored 'General case' 0 CA--C 1.568 1.672 0 CA-C-N 120.5 1.5 . . . . 0.0 114.693 179.173 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -72.47 61.09 0.48 Allowed 'General case' 0 CA--C 1.581 2.168 0 CA-C-N 120.873 1.67 . . . . 0.0 112.394 165.246 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 94.4 mtt180 -158.27 -55.34 0.07 Allowed 'General case' 0 CA--C 1.567 1.632 0 C-N-CA 125.909 1.684 . . . . 0.0 109.608 -173.755 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 22.4 p90 -64.43 -35.28 80.41 Favored 'General case' 0 N--CA 1.502 2.147 0 N-CA-C 115.188 1.551 . . . . 0.0 115.188 -176.846 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.1 t . . . . . 0 CA--C 1.57 1.733 0 CA-C-N 120.315 1.416 . . . . 0.0 107.695 160.248 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.7 m . . . . . 0 N--CA 1.498 1.96 0 CA-C-O 117.973 -1.013 . . . . 0.0 111.935 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . 58.54 -72.55 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.98 0 C-N-CA 126.655 1.982 . . . . 0.0 115.498 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -63.23 -47.11 83.87 Favored 'General case' 0 N--CA 1.497 1.878 0 CA-C-N 120.776 1.625 . . . . 0.0 113.124 165.343 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.95 -42.35 68.79 Favored 'General case' 0 N--CA 1.496 1.872 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 165.292 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -66.67 -45.85 77.6 Favored 'General case' 0 CA--C 1.563 1.474 0 N-CA-C 114.83 1.419 . . . . 0.0 114.83 174.236 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.97 -38.62 57.29 Favored 'General case' 0 CA--C 1.576 1.96 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 167.813 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 82.7 mt -70.88 -41.93 70.7 Favored 'General case' 0 CA--C 1.571 1.785 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 166.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 34.8 ttpt -64.79 -44.58 89.51 Favored 'General case' 0 N--CA 1.494 1.744 0 CA-C-N 121.092 1.769 . . . . 0.0 114.34 -177.363 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -62.5 -35.86 80.7 Favored 'General case' 0 CA--C 1.575 1.905 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 173.593 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.12 -56.04 22.8 Favored 'General case' 0 CA--C 1.57 1.748 0 N-CA-C 113.982 1.105 . . . . 0.0 113.982 164.13 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -57.66 -41.28 81.17 Favored 'General case' 0 CA--C 1.571 1.757 0 CA-C-N 120.641 1.564 . . . . 0.0 115.192 176.351 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.7 tpm_? -64.89 -35.0 79.72 Favored 'General case' 0 CA--C 1.574 1.883 0 CA-C-N 120.453 1.479 . . . . 0.0 114.607 169.53 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.8 ttt180 -61.71 -38.42 87.79 Favored 'General case' 0 CA--C 1.573 1.834 0 CA-C-N 121.632 2.014 . . . . 0.0 114.409 169.808 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -102.14 10.88 39.08 Favored 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 114.741 1.386 . . . . 0.0 114.741 -177.891 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 78.7 m . . . . . 0 CA--C 1.574 1.899 0 CA-C-N 119.992 1.269 . . . . 0.0 108.011 172.414 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 CA--C 1.568 1.663 0 CA-C-O 121.182 0.515 . . . . 0.0 111.668 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . 65.01 -48.88 0.35 Allowed 'General case' 0 N--CA 1.508 2.45 0 N-CA-C 115.869 1.803 . . . . 0.0 115.869 175.101 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -57.58 -46.5 83.92 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 119.459 -2.025 . . . . 0.0 113.597 154.037 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 36.8 tp -50.67 -44.28 57.63 Favored 'General case' 0 CA--C 1.574 1.885 0 N-CA-C 115.203 1.557 . . . . 0.0 115.203 166.033 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -75.31 -34.59 61.27 Favored 'General case' 0 CA--C 1.567 1.613 0 N-CA-C 114.965 1.469 . . . . 0.0 114.965 174.772 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 58.4 mtm180 -55.17 -43.74 74.58 Favored 'General case' 0 CA--C 1.577 1.989 0 CA-C-N 121.458 1.935 . . . . 0.0 113.776 163.767 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.1 mt -65.18 -36.75 85.19 Favored 'General case' 0 CA--C 1.575 1.905 0 N-CA-C 114.775 1.398 . . . . 0.0 114.775 166.526 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 18.9 ttmm -69.15 -41.01 77.84 Favored 'General case' 0 N--CA 1.494 1.767 0 CA-C-N 120.101 1.319 . . . . 0.0 113.889 177.082 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.4 mm-40 -58.23 -45.93 86.81 Favored 'General case' 0 CA--C 1.565 1.542 0 CA-C-N 119.779 1.172 . . . . 0.0 114.03 164.532 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.88 -52.85 63.8 Favored 'General case' 0 CA--C 1.571 1.761 0 N-CA-C 114.491 1.293 . . . . 0.0 114.491 172.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -65.06 -34.99 79.73 Favored 'General case' 0 CA--C 1.572 1.809 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 172.503 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -68.36 -42.81 78.66 Favored 'General case' 0 N--CA 1.494 1.747 0 CA-C-N 121.198 1.817 . . . . 0.0 114.511 173.21 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 92.3 mtt180 -67.83 -41.85 82.4 Favored 'General case' 0 CA--C 1.575 1.912 0 CA-C-N 120.789 1.632 . . . . 0.0 113.992 167.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -129.38 74.48 1.59 Allowed 'General case' 0 CA--C 1.568 1.662 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 -166.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 2.7 m . . . . . 0 CA--C 1.573 1.839 0 O-C-N 120.714 -1.241 . . . . 0.0 108.128 -170.269 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 26.2 p . . . . . 0 CA--C 1.56 1.351 0 CA-C-O 121.463 0.649 . . . . 0.0 109.938 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -75.67 -59.94 2.53 Favored 'General case' 0 CA--C 1.568 1.648 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 -174.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.6 tmtm? -68.7 -17.98 64.17 Favored 'General case' 0 CA--C 1.579 2.086 0 N-CA-C 116.872 2.175 . . . . 0.0 116.872 -176.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 92.0 t -105.05 79.72 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 CA-C-N 120.331 1.423 . . . . 0.0 107.404 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 50.1 mttm -138.46 62.16 1.56 Allowed 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 168.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -134.15 87.49 0.26 Allowed Glycine 0 CA--C 1.545 1.951 0 O-C-N 120.966 -1.084 . . . . 0.0 114.666 -152.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 52.0 mm -98.45 131.25 45.93 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 2 CA-C-N 125.58 4.69 . . . . 0.0 108.006 -3.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 89.9 m -97.96 121.2 39.59 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.29 -0.881 . . . . 0.0 109.541 174.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 73.79 93.72 0.08 Allowed 'General case' 0 N--CA 1.501 2.084 0 C-N-CA 125.38 1.472 . . . . 0.0 110.628 -176.306 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -65.48 152.39 51.46 Favored Glycine 0 CA--C 1.561 2.928 1 O-C-N 116.026 -4.171 . . . . 0.0 118.111 -24.632 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -51.7 94.45 0.03 OUTLIER 'Trans proline' 0 CA--C 1.569 2.255 0 C-N-CA 124.485 3.457 . . . . 0.0 115.879 171.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 8.3 t30 48.0 49.96 16.47 Favored 'General case' 0 N--CA 1.505 2.286 0 C-N-CA 125.009 1.323 . . . . 0.0 113.931 -162.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 34.32 36.61 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.518 0 N-CA-C 117.953 2.575 . . . . 0.0 117.953 -165.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 36.7 m -73.29 -52.43 5.28 Favored Pre-proline 0 CA--C 1.573 1.851 0 CA-C-O 115.851 -2.023 . . . . 0.0 112.496 -173.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -65.31 -48.77 3.09 Favored 'Trans proline' 0 CA--C 1.567 2.16 0 CA-C-N 125.288 2.924 . . . . 0.0 114.485 161.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.2 t -57.34 -48.64 78.46 Favored 'General case' 0 CA--C 1.562 1.41 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 -170.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.19 -27.33 68.62 Favored 'General case' 0 CA--C 1.571 1.775 0 N-CA-C 116.233 1.938 . . . . 0.0 116.233 175.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -75.46 -46.86 30.02 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-N 120.168 1.349 . . . . 0.0 113.77 163.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -59.79 -30.35 68.84 Favored 'General case' 0 CA--C 1.572 1.81 0 N-CA-C 115.099 1.518 . . . . 0.0 115.099 171.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -72.77 -41.77 64.7 Favored 'General case' 0 CA--C 1.563 1.445 0 CA-C-N 121.605 2.002 . . . . 0.0 114.525 170.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 79.5 mtm180 -54.86 -38.2 67.18 Favored 'General case' 0 CA--C 1.578 2.026 0 CA-C-N 120.594 1.543 . . . . 0.0 114.439 163.084 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 97.4 mt -68.49 -40.65 80.83 Favored 'General case' 0 CA--C 1.571 1.761 0 CA-C-O 117.661 -1.162 . . . . 0.0 114.045 167.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -72.28 -35.44 68.71 Favored 'General case' 0 N--CA 1.498 1.972 0 CA-C-N 121.677 2.035 . . . . 0.0 114.271 -178.374 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -64.71 -35.94 82.67 Favored 'General case' 0 CA--C 1.575 1.925 0 CA-C-N 121.235 1.834 . . . . 0.0 114.09 167.407 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.8 -55.89 22.33 Favored 'General case' 0 CA--C 1.57 1.726 0 CA-C-N 120.051 1.296 . . . . 0.0 113.558 166.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 14.8 m-30 -59.24 -35.24 73.32 Favored 'General case' 0 CA--C 1.568 1.657 0 N-CA-C 115.125 1.528 . . . . 0.0 115.125 175.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 2.9 tpp180 -69.93 -24.07 63.3 Favored 'General case' 0 CA--C 1.57 1.739 0 N-CA-C 115.536 1.68 . . . . 0.0 115.536 167.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 49.9 tpt85 -63.37 -32.87 74.41 Favored 'General case' 0 CA--C 1.577 1.991 0 CA-C-N 121.291 1.86 . . . . 0.0 114.845 164.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 9.5 p90 -120.48 39.22 3.79 Favored 'General case' 0 CA--C 1.578 2.04 0 C-N-CA 124.262 1.025 . . . . 0.0 113.544 174.202 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 57.2 m -169.6 113.39 0.5 Allowed Pre-proline 0 CA--C 1.581 2.154 0 O-C-N 119.755 -1.84 . . . . 0.0 106.362 166.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -85.47 67.9 5.62 Favored 'Trans proline' 0 CA--C 1.57 2.305 0 C-N-CA 123.319 2.679 . . . . 0.0 114.526 -176.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 . . . . . 0 N--CA 1.503 2.202 0 CA-C-O 125.353 2.501 . . . . 0.0 111.137 -176.558 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 43.5 t . . . . . 0 CA--C 1.561 1.371 0 CA-C-O 121.405 0.622 . . . . 0.0 110.347 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.74 -22.57 62.4 Favored 'General case' 0 CA--C 1.572 1.806 0 N-CA-C 117.288 2.329 . . . . 0.0 117.288 -177.256 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.6 115.04 4.81 Favored 'General case' 0 CA--C 1.567 1.605 0 CA-C-N 120.228 1.376 . . . . 0.0 108.219 170.543 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.4 p -92.2 49.79 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.585 2.307 0 CA-C-O 122.572 1.177 . . . . 0.0 112.86 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -158.76 73.0 0.6 Allowed 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 104.945 -2.243 . . . . 0.0 104.945 167.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 172.46 69.32 0.04 OUTLIER Glycine 0 N--CA 1.481 1.683 0 C-N-CA 120.583 -0.818 . . . . 0.0 114.727 -155.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 42.4 mm -113.04 135.41 52.62 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 N-CA-C 106.418 -1.697 . . . . 0.0 106.418 173.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.2 m -55.32 -27.37 46.58 Favored 'General case' 0 N--CA 1.504 2.234 0 N-CA-C 116.991 2.219 . . . . 0.0 116.991 -166.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 41.6 mm-40 -136.63 44.96 2.33 Favored 'General case' 0 CA--C 1.567 1.597 0 CA-C-N 120.686 1.584 . . . . 0.0 110.113 164.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -170.95 41.5 0.19 Allowed Glycine 0 CA--C 1.559 2.822 0 N-CA-C 120.975 3.15 . . . . 0.0 120.975 -166.074 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -77.02 68.88 7.22 Favored 'Trans proline' 0 CA--C 1.575 2.526 1 CA-C-N 125.88 4.84 . . . . 0.0 114.724 179.734 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 23.9 m120 61.77 79.15 0.26 Allowed 'General case' 0 N--CA 1.505 2.306 0 C-N-CA 125.652 1.581 . . . . 0.0 110.789 -165.317 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -92.16 -22.24 19.96 Favored 'General case' 0 N--CA 1.498 1.961 0 N-CA-C 117.764 2.505 . . . . 0.0 117.764 -169.245 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 73.5 p -61.38 -39.18 60.18 Favored Pre-proline 0 CA--C 1.58 2.132 0 CA-C-O 114.407 -2.711 . . . . 0.0 115.768 169.264 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -66.31 -54.73 0.45 Allowed 'Trans proline' 0 CA--C 1.568 2.201 0 CA-C-N 127.141 3.586 . . . . 0.0 114.755 169.234 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.4 m -170.68 84.27 0.1 Allowed 'General case' 0 CA--C 1.568 1.656 0 CA-C-N 120.878 1.672 . . . . 0.0 110.899 172.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -148.53 -37.88 0.18 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.028 -1.045 . . . . 0.0 112.396 158.122 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -71.54 -42.2 68.2 Favored 'General case' 0 N--CA 1.5 2.072 0 CA-C-N 121.369 1.895 . . . . 0.0 112.92 161.084 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.6 mp -51.79 -46.46 64.21 Favored 'General case' 0 CA--C 1.574 1.902 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 164.496 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 82.8 mt-10 -64.47 -40.5 95.8 Favored 'General case' 0 CA--C 1.565 1.546 0 N-CA-C 116.015 1.858 . . . . 0.0 116.015 171.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 71.2 mtm180 -55.79 -37.34 68.47 Favored 'General case' 0 CA--C 1.577 1.988 0 CA-C-N 121.379 1.9 . . . . 0.0 114.44 166.136 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 93.6 mt -67.94 -39.1 83.51 Favored 'General case' 0 CA--C 1.573 1.853 0 CA-C-O 117.56 -1.21 . . . . 0.0 113.854 166.138 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -64.68 -42.02 95.64 Favored 'General case' 0 N--CA 1.5 2.039 0 CA-C-N 121.849 2.113 . . . . 0.0 114.368 177.095 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -69.47 -35.57 75.73 Favored 'General case' 0 CA--C 1.571 1.77 0 CA-C-N 120.018 1.281 . . . . 0.0 114.276 171.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.79 -51.42 69.41 Favored 'General case' 0 CA--C 1.574 1.866 0 CA-C-N 120.817 1.644 . . . . 0.0 114.465 167.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 34.8 m-85 -72.78 -7.25 49.78 Favored 'General case' 0 CA--C 1.576 1.946 0 N-CA-C 116.218 1.932 . . . . 0.0 116.218 172.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -105.1 54.0 0.71 Allowed 'General case' 0 CA--C 1.571 1.781 0 CA-C-N 121.675 2.034 . . . . 0.0 111.626 162.042 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 34.3 ttp-105 -169.41 -37.5 0.02 OUTLIER 'General case' 0 CA--C 1.569 1.707 0 C-N-CA 124.819 1.248 . . . . 0.0 111.883 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -54.51 -28.94 48.67 Favored 'General case' 0 CA--C 1.581 2.141 0 N-CA-C 117.471 2.397 . . . . 0.0 117.471 178.743 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.2 t -94.38 131.17 31.74 Favored Pre-proline 0 CA--C 1.579 2.079 0 CA-C-N 120.112 1.324 . . . . 0.0 108.912 159.082 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -66.61 -34.93 31.02 Favored 'Trans proline' 0 CA--C 1.571 2.351 0 CA-C-N 122.83 2.046 . . . . 0.0 116.121 176.335 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 . . . . . 0 N--CA 1.488 1.431 0 CA-C-O 125.34 2.495 . . . . 0.0 109.393 169.013 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 72.3 m . . . . . 0 CA--C 1.561 1.374 0 CA-C-O 121.099 0.476 . . . . 0.0 110.448 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -88.33 75.48 8.5 Favored 'General case' 0 CA--C 1.57 1.719 0 CA-C-O 122.209 1.005 . . . . 0.0 112.579 -176.029 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 85.3 tttt 66.98 -79.05 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.028 0 C-N-CA 126.017 1.727 . . . . 0.0 111.653 -176.332 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 94.8 t -127.17 88.12 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 N-CA-C 104.99 -2.226 . . . . 0.0 104.99 167.302 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 179.57 81.7 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 103.811 -2.662 . . . . 0.0 103.811 -177.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -164.91 -141.66 3.19 Favored Glycine 0 N--CA 1.483 1.83 0 N-CA-C 114.822 0.689 . . . . 0.0 114.822 -160.226 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 36.1 mm -72.37 93.9 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.127 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 -177.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 12.8 p -143.3 -73.54 0.28 Allowed 'General case' 0 N--CA 1.499 2.019 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 -159.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -146.11 65.1 1.21 Allowed 'General case' 0 CA--C 1.568 1.661 0 N-CA-C 106.386 -1.709 . . . . 0.0 106.386 165.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 148.82 80.24 0.03 OUTLIER Glycine 0 CA--C 1.551 2.316 0 CA-C-O 117.411 -1.771 . . . . 0.0 111.966 -147.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -78.27 89.53 1.34 Allowed 'Trans proline' 0 CA--C 1.565 2.042 0 CA-C-N 122.286 3.043 . . . . 0.0 112.949 -176.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 12.2 p-10 -64.1 -29.19 70.34 Favored 'General case' 0 CA--C 1.576 1.956 0 N-CA-C 116.896 2.184 . . . . 0.0 116.896 -174.344 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -81.25 76.54 8.19 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-O 122.956 1.36 . . . . 0.0 109.775 173.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 47.0 t -118.65 46.67 0.76 Allowed Pre-proline 0 CA--C 1.59 2.5 0 N-CA-C 115.701 1.741 . . . . 0.0 115.701 169.358 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 0.2 OUTLIER -92.2 -156.16 0.65 Allowed 'Cis proline' 0 CA--C 1.583 2.949 0 CA-C-N 124.844 2.766 . . . . 0.0 113.497 -6.467 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.4 t 16.99 44.6 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.222 1 N-CA-C 123.456 4.613 . . . . 0.0 123.456 158.82 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -77.02 141.49 40.31 Favored 'General case' 0 CA--C 1.566 1.578 0 O-C-N 119.789 -1.82 . . . . 0.0 111.185 161.56 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 37.4 t80 68.58 -47.57 0.55 Allowed 'General case' 0 N--CA 1.512 2.64 0 C-N-CA 124.967 1.307 . . . . 0.0 113.319 -161.229 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -63.09 -21.37 66.13 Favored 'General case' 0 CA--C 1.574 1.885 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 172.053 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -73.87 -37.41 64.74 Favored 'General case' 0 CA--C 1.565 1.527 0 CA-C-N 121.795 2.089 . . . . 0.0 115.454 163.105 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 74.8 mmt-85 -60.06 -38.49 82.99 Favored 'General case' 0 CA--C 1.569 1.684 0 CA-C-N 120.506 1.503 . . . . 0.0 114.178 165.256 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 95.7 mt -68.09 -37.5 81.28 Favored 'General case' 0 CA--C 1.571 1.769 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 166.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.8 ttmp? -73.49 -38.96 65.21 Favored 'General case' 0 N--CA 1.501 2.076 0 CA-C-N 121.403 1.911 . . . . 0.0 114.375 -177.253 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -64.39 -38.19 90.18 Favored 'General case' 0 CA--C 1.577 1.998 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 167.243 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.39 -47.3 84.73 Favored 'General case' 0 CA--C 1.571 1.774 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 167.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -59.44 -28.19 66.75 Favored 'General case' 0 CA--C 1.569 1.693 0 N-CA-C 115.969 1.84 . . . . 0.0 115.969 169.049 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.2 -3.99 42.43 Favored 'General case' 0 CA--C 1.578 2.02 0 N-CA-C 115.989 1.848 . . . . 0.0 115.989 165.28 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 66.5 mmt-85 -79.63 -45.25 19.44 Favored 'General case' 0 CA--C 1.569 1.678 0 CA-C-N 121.686 2.039 . . . . 0.0 112.341 152.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -67.8 -48.47 66.19 Favored 'General case' 0 CA--C 1.574 1.87 0 CA-C-N 119.086 0.857 . . . . 0.0 113.104 -177.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 91.7 m -119.65 95.85 49.4 Favored Pre-proline 0 CA--C 1.581 2.159 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 168.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -84.66 62.41 6.36 Favored 'Trans proline' 0 CA--C 1.57 2.286 0 C-N-CA 123.51 2.807 . . . . 0.0 114.884 -176.29 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 78.7 m-85 . . . . . 0 N--CA 1.493 1.705 0 CA-C-O 124.923 2.297 . . . . 0.0 109.868 -169.8 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 86.6 m . . . . . 0 CA--C 1.563 1.457 0 CA-C-O 118.37 -0.824 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -81.63 78.27 8.39 Favored 'General case' 0 CA--C 1.569 1.7 0 CA-C-N 120.888 1.676 . . . . 0.0 112.133 -178.27 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 67.6 mttm 53.38 70.05 0.64 Allowed 'General case' 0 N--CA 1.505 2.296 0 C-N-CA 125.171 1.388 . . . . 0.0 111.711 -169.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.4 m 46.4 90.38 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.471 0 C-N-CA 126.209 1.804 . . . . 0.0 112.094 -163.765 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.23 82.5 1.31 Allowed 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 105.466 -2.049 . . . . 0.0 105.466 177.717 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -153.62 -142.33 3.44 Favored Glycine 0 CA--C 1.542 1.769 0 N-CA-C 114.791 0.676 . . . . 0.0 114.791 -156.309 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 10.1 tp -96.21 123.75 48.6 Favored 'Isoleucine or valine' 0 CA--C 1.573 1.842 0 CA-C-O 122.199 0.999 . . . . 0.0 110.587 -169.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.7 m -76.21 -45.63 32.18 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -166.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -128.82 77.39 1.78 Allowed 'General case' 0 CA--C 1.563 1.464 0 CA-C-N 120.639 1.563 . . . . 0.0 113.129 179.289 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 171.99 70.37 0.04 OUTLIER Glycine 0 N--CA 1.488 2.142 1 O-C-N 115.278 -4.639 . . . . 0.0 117.243 -29.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -78.04 45.86 1.92 Allowed 'Trans proline' 0 CA--C 1.576 2.598 0 CA-C-N 123.267 3.534 . . . . 0.0 116.134 169.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -85.99 76.04 9.88 Favored 'General case' 0 CA--C 1.569 1.707 0 O-C-N 120.609 -1.307 . . . . 0.0 109.373 170.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 18.2 pt-20 -101.33 -5.99 24.69 Favored 'General case' 0 N--CA 1.497 1.892 0 N-CA-C 118.259 2.689 . . . . 0.0 118.259 -159.364 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.5 t -60.39 -35.54 27.86 Favored Pre-proline 0 CA--C 1.581 2.163 0 CA-C-O 114.422 -2.704 . . . . 0.0 116.735 166.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -70.11 -57.29 0.12 Allowed 'Trans proline' 0 CA--C 1.564 1.989 0 CA-C-N 127.117 3.578 . . . . 0.0 114.745 172.187 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.5 m -164.19 80.59 0.4 Allowed 'General case' 0 CA--C 1.566 1.59 0 CA-C-N 119.641 1.109 . . . . 0.0 111.067 173.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -147.42 -42.47 0.17 Allowed 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 118.34 -0.838 . . . . 0.0 111.662 155.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -62.89 -38.16 89.79 Favored 'General case' 0 N--CA 1.499 1.979 0 CA-C-N 121.048 1.749 . . . . 0.0 113.982 163.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -47.49 -42.89 23.92 Favored 'General case' 0 CA--C 1.576 1.948 0 N-CA-C 115.194 1.553 . . . . 0.0 115.194 161.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -72.71 -37.32 67.83 Favored 'General case' 0 CA--C 1.566 1.564 0 N-CA-C 115.035 1.494 . . . . 0.0 115.035 170.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 58.5 mtt-85 -52.81 -45.37 67.2 Favored 'General case' 0 CA--C 1.579 2.067 0 CA-C-N 121.537 1.971 . . . . 0.0 113.476 165.185 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 95.6 mt -63.45 -40.21 96.54 Favored 'General case' 0 CA--C 1.57 1.727 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 168.148 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.0 mmpt? -62.54 -38.03 88.4 Favored 'General case' 0 N--CA 1.497 1.915 0 CA-C-N 121.086 1.766 . . . . 0.0 114.883 172.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -60.96 -46.66 89.82 Favored 'General case' 0 CA--C 1.569 1.7 0 CA-C-N 119.957 1.253 . . . . 0.0 113.306 168.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.411 ' O ' ' HB3' ' A' ' 28' ' ' ARG . . . -60.17 -50.35 74.03 Favored 'General case' 0 CA--C 1.57 1.732 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 170.553 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 20.1 m-30 -56.57 -37.31 70.41 Favored 'General case' 0 CA--C 1.574 1.876 0 CA-C-N 120.925 1.693 . . . . 0.0 114.795 170.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -25.64 68.43 Favored 'General case' 0 CA--C 1.582 2.174 0 N-CA-C 115.084 1.513 . . . . 0.0 115.084 170.829 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.411 ' HB3' ' O ' ' A' ' 25' ' ' ALA . 7.5 tpm_? -56.25 -35.37 67.32 Favored 'General case' 0 CA--C 1.578 2.024 0 CA-C-N 121.982 2.173 . . . . 0.0 115.308 162.85 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -102.92 -43.9 5.4 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 124.246 1.019 . . . . 0.0 112.42 -171.591 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 86.2 m -115.01 135.56 22.49 Favored Pre-proline 0 CA--C 1.574 1.866 0 CA-C-O 117.791 -1.099 . . . . 0.0 108.906 174.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -48.65 -35.34 29.5 Favored 'Trans proline' 0 CA--C 1.57 2.286 0 N-CA-C 119.077 2.684 . . . . 0.0 119.077 178.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 38.9 p90 . . . . . 0 CA--C 1.569 1.709 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 170.57 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 32.0 p . . . . . 0 CA--C 1.565 1.544 0 CA-C-O 122.11 0.957 . . . . 0.0 110.712 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -145.33 143.25 30.05 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.309 -0.87 . . . . 0.0 111.638 -176.03 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 28.4 mtmm 91.91 107.49 0.03 OUTLIER 'General case' 0 N--CA 1.51 2.555 0 C-N-CA 127.302 2.241 . . . . 0.0 107.403 -172.553 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.6 m -104.03 68.07 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 CA-C-O 122.784 1.278 . . . . 0.0 110.509 -172.013 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -133.41 70.43 1.46 Allowed 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 105.996 -1.853 . . . . 0.0 105.996 160.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 145.02 151.76 5.48 Favored Glycine 0 CA--C 1.544 1.853 0 C-N-CA 120.43 -0.891 . . . . 0.0 113.182 -141.379 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 16.7 tt -75.76 133.79 30.51 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.022 0 CA-C-O 121.821 0.82 . . . . 0.0 110.507 174.546 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.2 p -131.93 61.96 1.64 Allowed 'General case' 0 N--CA 1.503 2.183 0 CA-C-O 121.952 0.882 . . . . 0.0 110.198 177.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -145.06 70.85 1.28 Allowed 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 165.135 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.56 104.71 1.41 Allowed Glycine 0 CA--C 1.553 2.456 0 CA-C-O 116.519 -2.267 . . . . 0.0 111.768 -132.175 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -69.18 148.66 69.35 Favored 'Trans proline' 0 CA--C 1.56 1.786 0 CA-C-N 123.207 3.503 . . . . 0.0 114.429 -178.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -62.51 -35.61 79.94 Favored 'General case' 0 CA--C 1.576 1.978 0 CA-C-N 113.193 -1.821 . . . . 0.0 115.721 -178.098 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 65.19 -15.3 0.1 Allowed 'General case' 0 N--CA 1.509 2.522 0 N-CA-C 118.026 2.602 . . . . 0.0 118.026 164.582 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 45.6 t -54.32 -49.92 87.81 Favored Pre-proline 0 CA--C 1.584 2.288 0 CA-C-N 122.589 2.45 . . . . 0.0 115.827 -178.185 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -75.21 -8.58 19.95 Favored 'Trans proline' 0 CA--C 1.573 2.449 0 CA-C-N 125.995 3.177 . . . . 0.0 117.586 169.209 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 97.5 p -60.92 -43.15 99.0 Favored 'General case' 0 CA--C 1.567 1.614 0 N-CA-C 116.225 1.935 . . . . 0.0 116.225 -169.546 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.88 -38.0 89.5 Favored 'General case' 0 CA--C 1.571 1.785 0 N-CA-C 115.372 1.619 . . . . 0.0 115.372 171.795 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -63.92 -44.11 93.89 Favored 'General case' 0 CA--C 1.573 1.829 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 166.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 13.5 tp -58.17 -45.63 87.15 Favored 'General case' 0 CA--C 1.567 1.633 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 169.034 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -67.39 -39.59 85.62 Favored 'General case' 0 CA--C 1.562 1.433 0 N-CA-C 114.738 1.384 . . . . 0.0 114.738 173.223 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.9 ttp85 -49.4 -43.05 44.04 Favored 'General case' 0 CA--C 1.581 2.141 0 CA-C-N 121.484 1.947 . . . . 0.0 114.547 163.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 93.1 mt -67.97 -46.42 71.43 Favored 'General case' 0 CA--C 1.569 1.686 0 CA-C-O 117.594 -1.193 . . . . 0.0 113.642 168.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.6 mttm -66.14 -39.42 89.83 Favored 'General case' 0 N--CA 1.502 2.149 0 CA-C-N 121.8 2.091 . . . . 0.0 114.48 178.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -61.45 -33.59 74.0 Favored 'General case' 0 CA--C 1.571 1.773 0 N-CA-C 114.819 1.414 . . . . 0.0 114.819 169.551 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.11 -45.91 65.93 Favored 'General case' 0 CA--C 1.572 1.804 0 N-CA-C 115.056 1.502 . . . . 0.0 115.056 163.381 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 14.8 m-30 -69.98 -23.74 63.21 Favored 'General case' 0 CA--C 1.565 1.557 0 N-CA-C 116.413 2.005 . . . . 0.0 116.413 -178.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -72.72 73.28 1.08 Allowed 'General case' 0 CA--C 1.577 2.008 0 CA-C-N 121.445 1.929 . . . . 0.0 110.296 166.749 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.66 -55.76 0.03 OUTLIER 'General case' 0 CA--C 1.564 1.506 0 C-N-CA 125.757 1.623 . . . . 0.0 108.194 -169.78 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 24.7 p90 -75.32 -32.29 60.88 Favored 'General case' 0 CA--C 1.578 2.054 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 162.413 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 23.3 m -106.58 130.81 22.36 Favored Pre-proline 0 CA--C 1.576 1.958 0 CA-C-N 120.469 1.486 . . . . 0.0 108.458 170.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_exo -56.06 -35.1 94.31 Favored 'Trans proline' 0 CA--C 1.568 2.219 0 C-N-CA 122.985 2.457 . . . . 0.0 118.438 176.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 . . . . . 0 N--CA 1.488 1.447 0 CA-C-O 124.736 2.207 . . . . 0.0 107.802 169.393 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 42.2 t . . . . . 0 CA--C 1.559 1.321 0 CA-C-O 121.164 0.506 . . . . 0.0 109.991 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.26 31.04 5.43 Favored 'General case' 0 CA--C 1.574 1.891 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 -177.399 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -74.36 100.93 3.92 Favored 'General case' 0 CA--C 1.569 1.693 0 O-C-N 120.333 -1.48 . . . . 0.0 111.359 -174.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.8 m 42.91 47.54 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.516 2.845 0 C-N-CA 125.558 1.543 . . . . 0.0 114.56 -166.114 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -165.86 77.6 0.25 Allowed 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 179.659 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -78.66 -87.39 0.48 Allowed Glycine 0 N--CA 1.488 2.111 0 N-CA-C 116.495 1.358 . . . . 0.0 116.495 -155.292 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 44.7 mt -89.8 87.7 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.072 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 -177.101 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 76.7 p -118.92 85.12 2.31 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 -172.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -155.32 66.52 0.64 Allowed 'General case' 0 CA--C 1.566 1.574 0 N-CA-C 105.342 -2.095 . . . . 0.0 105.342 160.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.82 94.34 0.89 Allowed Glycine 0 CA--C 1.557 2.668 0 CA-C-O 116.957 -2.024 . . . . 0.0 113.787 -137.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_exo -56.56 105.26 0.16 Allowed 'Trans proline' 0 CA--C 1.56 1.792 0 CA-C-N 122.272 3.036 . . . . 0.0 114.889 175.231 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -72.4 -33.64 67.3 Favored 'General case' 0 N--CA 1.499 2.014 0 N-CA-C 116.357 1.984 . . . . 0.0 116.357 -171.662 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -80.67 -39.38 27.36 Favored 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 115.093 1.516 . . . . 0.0 115.093 -169.011 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 30.1 t -57.3 -51.63 80.22 Favored Pre-proline 0 CA--C 1.584 2.265 0 CA-C-O 115.425 -2.226 . . . . 0.0 114.282 171.022 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -64.71 -47.12 5.69 Favored 'Trans proline' 0 CA--C 1.562 1.919 0 CA-C-N 125.718 3.078 . . . . 0.0 114.949 169.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 76.1 p -65.06 -34.19 77.83 Favored 'General case' 0 CA--C 1.573 1.863 0 CA-C-N 122.77 2.532 . . . . 0.0 115.678 -178.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.0 -42.95 84.14 Favored 'General case' 0 CA--C 1.571 1.776 0 CA-C-N 120.841 1.655 . . . . 0.0 114.877 164.193 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -67.28 -40.17 86.09 Favored 'General case' 0 CA--C 1.573 1.855 0 CA-C-N 120.44 1.473 . . . . 0.0 114.6 173.441 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.0 mp -56.12 -39.17 71.81 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 165.227 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.99 -34.12 61.95 Favored 'General case' 0 CA--C 1.569 1.706 0 CA-C-N 120.885 1.675 . . . . 0.0 115.213 172.562 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 74.8 ttt-85 -53.08 -44.35 67.47 Favored 'General case' 0 CA--C 1.578 2.053 0 CA-C-N 120.568 1.531 . . . . 0.0 114.243 159.071 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 94.7 mt -70.31 -39.97 74.47 Favored 'General case' 0 CA--C 1.569 1.699 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 171.218 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 61.0 tttm -69.05 -41.77 77.18 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-N 120.779 1.627 . . . . 0.0 114.227 -174.44 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -62.54 -31.19 71.94 Favored 'General case' 0 CA--C 1.58 2.115 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 168.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.24 -41.82 39.68 Favored 'General case' 0 CA--C 1.573 1.83 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 168.393 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 22.4 m-30 -57.91 -39.73 78.67 Favored 'General case' 0 CA--C 1.577 2.017 0 CA-C-N 121.451 1.932 . . . . 0.0 114.717 170.079 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 30.5 ttp180 -50.11 -38.31 38.18 Favored 'General case' 0 CA--C 1.579 2.087 0 N-CA-C 116.029 1.862 . . . . 0.0 116.029 157.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.6 tpm_? -76.34 -42.11 46.0 Favored 'General case' 0 CA--C 1.572 1.819 0 CA-C-N 121.424 1.92 . . . . 0.0 113.999 172.588 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -68.22 -18.59 64.61 Favored 'General case' 0 N--CA 1.503 2.21 0 N-CA-C 114.801 1.408 . . . . 0.0 114.801 174.146 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 17.8 m -69.28 124.8 91.21 Favored Pre-proline 0 CA--C 1.583 2.22 0 C-N-CA 123.88 0.872 . . . . 0.0 108.858 159.715 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -76.55 -22.57 12.09 Favored 'Trans proline' 0 CA--C 1.567 2.169 0 N-CA-C 117.925 2.24 . . . . 0.0 117.925 -162.521 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 124.597 2.141 . . . . 0.0 112.302 -160.433 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 53.3 t . . . . . 0 CA--C 1.564 1.483 0 CA-C-O 118.134 -0.936 . . . . 0.0 108.81 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -145.37 89.85 1.97 Allowed 'General case' 0 CA--C 1.571 1.765 0 CA-C-N 120.304 1.411 . . . . 0.0 110.272 175.002 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 42.3 tptt -141.0 127.87 20.46 Favored 'General case' 0 CA--C 1.563 1.477 1 O-C-N 114.76 -4.962 . . . . 0.0 110.213 -22.827 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.3 p -94.99 84.26 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.569 1.703 0 CA-C-O 123.765 1.745 . . . . 0.0 108.014 179.298 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.91 78.71 1.49 Allowed 'General case' 0 CA--C 1.567 1.602 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 168.733 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -128.71 112.0 1.33 Allowed Glycine 0 N--CA 1.483 1.774 0 O-C-N 121.023 -1.048 . . . . 0.0 114.587 -145.094 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 90.9 mt -129.95 101.39 6.01 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 N-CA-C 104.805 -2.294 . . . . 0.0 104.805 173.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 99.0 m -155.75 -62.63 0.11 Allowed 'General case' 0 N--CA 1.504 2.239 0 O-C-N 120.308 -1.495 . . . . 0.0 110.898 -177.337 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -141.11 63.49 1.44 Allowed 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 106.216 -1.772 . . . . 0.0 106.216 174.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 65.64 -171.87 24.88 Favored Glycine 0 CA--C 1.57 3.493 0 N-CA-C 116.571 1.389 . . . . 0.0 116.571 -135.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -63.06 84.5 0.11 Allowed 'Trans proline' 0 CA--C 1.568 2.217 0 C-N-CA 123.641 2.894 . . . . 0.0 115.044 164.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -92.61 28.48 2.0 Allowed 'General case' 0 CA--C 1.579 2.06 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 -165.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -167.26 146.08 5.03 Favored 'General case' 0 CA--C 1.566 1.569 0 O-C-N 120.385 -1.447 . . . . 0.0 110.928 -172.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 30.4 t -121.82 -69.2 0.02 OUTLIER Pre-proline 0 CA--C 1.572 1.827 0 CA-C-O 115.419 -2.229 . . . . 0.0 107.35 144.363 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -81.36 19.62 1.15 Allowed 'Trans proline' 0 CA--C 1.58 2.795 0 CA-C-N 126.034 3.191 . . . . 0.0 117.167 169.129 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 59.6 p 66.64 -110.21 0.15 Allowed 'General case' 0 N--CA 1.498 1.97 0 C-N-CA 126.456 1.902 . . . . 0.0 109.155 -157.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . 62.13 -60.19 0.12 Allowed 'General case' 0 N--CA 1.508 2.435 0 N-CA-C 116.532 2.049 . . . . 0.0 116.532 169.387 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -65.69 -48.35 72.35 Favored 'General case' 0 N--CA 1.496 1.861 0 CA-C-N 120.5 1.5 . . . . 0.0 112.894 158.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 16.3 tp -50.68 -44.35 57.8 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 164.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -66.91 -39.81 87.52 Favored 'General case' 0 CA--C 1.564 1.502 0 N-CA-C 115.791 1.774 . . . . 0.0 115.791 173.232 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 78.9 mtt85 -54.04 -44.06 70.69 Favored 'General case' 0 CA--C 1.573 1.857 0 CA-C-N 121.571 1.987 . . . . 0.0 114.145 163.191 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 98.4 mt -64.42 -40.08 95.08 Favored 'General case' 0 CA--C 1.569 1.686 0 CA-C-O 117.222 -1.37 . . . . 0.0 113.726 169.159 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -66.01 -38.07 87.53 Favored 'General case' 0 N--CA 1.502 2.147 0 CA-C-N 122.159 2.254 . . . . 0.0 113.952 173.321 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -64.65 -38.18 90.11 Favored 'General case' 0 CA--C 1.577 2.011 0 N-CA-C 113.971 1.1 . . . . 0.0 113.971 170.115 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.93 -42.69 84.9 Favored 'General case' 0 CA--C 1.571 1.767 0 N-CA-C 115.885 1.809 . . . . 0.0 115.885 165.578 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 15.8 m-30 -75.26 -29.62 60.24 Favored 'General case' 0 CA--C 1.568 1.672 0 CA-C-N 120.5 1.5 . . . . 0.0 114.693 179.173 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -72.47 61.09 0.48 Allowed 'General case' 0 CA--C 1.581 2.168 0 CA-C-N 120.873 1.67 . . . . 0.0 112.394 165.246 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 94.4 mtt180 -158.27 -55.34 0.07 Allowed 'General case' 0 CA--C 1.567 1.632 0 C-N-CA 125.909 1.684 . . . . 0.0 109.608 -173.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 22.4 p90 -64.43 -35.28 80.41 Favored 'General case' 0 N--CA 1.502 2.147 0 N-CA-C 115.188 1.551 . . . . 0.0 115.188 -176.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.1 t -110.46 104.47 55.92 Favored Pre-proline 0 CA--C 1.57 1.733 0 CA-C-N 120.315 1.416 . . . . 0.0 107.695 160.248 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_exo -52.01 -43.12 54.63 Favored 'Trans proline' 0 CA--C 1.567 2.144 0 C-N-CA 123.097 2.531 . . . . 0.0 116.065 168.273 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 . . . . . 0 N--CA 1.489 1.509 0 CA-C-O 125.466 2.555 . . . . 0.0 111.719 170.029 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 50.7 t . . . . . 0 CA--C 1.563 1.474 0 CA-C-O 118.325 -0.845 . . . . 0.0 108.855 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -92.62 76.14 5.02 Favored 'General case' 0 CA--C 1.566 1.558 0 CA-C-N 120.792 1.633 . . . . 0.0 111.636 176.256 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -163.16 104.34 0.99 Allowed 'General case' 0 CA--C 1.568 1.637 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 174.245 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.0 p 44.42 70.72 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.473 0 C-N-CA 127.078 2.151 . . . . 0.0 116.525 170.359 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.42 72.37 0.47 Allowed 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 155.52 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -176.23 94.05 0.1 OUTLIER Glycine 0 N--CA 1.48 1.583 0 O-C-N 121.318 -0.864 . . . . 0.0 114.083 -158.362 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 42.1 mm -77.94 129.57 37.3 Favored 'Isoleucine or valine' 0 CA--C 1.576 1.964 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 175.096 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 56.3 m -73.73 107.57 6.06 Favored 'General case' 0 CA--C 1.572 1.819 0 O-C-N 121.563 -0.711 . . . . 0.0 112.366 -163.383 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 50.54 75.87 0.17 Allowed 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 116.311 1.967 . . . . 0.0 116.311 173.028 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -159.54 68.44 0.26 Allowed Glycine 0 CA--C 1.548 2.101 1 O-C-N 115.589 -4.444 . . . . 0.0 115.516 -36.048 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -79.38 67.62 8.54 Favored 'Trans proline' 0 CA--C 1.571 2.375 0 CA-C-N 122.517 3.158 . . . . 0.0 114.321 174.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -92.72 65.8 4.31 Favored 'General case' 0 CA--C 1.57 1.731 0 O-C-N 121.125 -0.985 . . . . 0.0 110.348 179.035 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 50.16 54.08 11.72 Favored 'General case' 0 N--CA 1.507 2.397 0 C-N-CA 124.583 1.153 . . . . 0.0 113.879 -162.438 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 36.1 t -65.64 -51.36 50.49 Favored Pre-proline 0 CA--C 1.579 2.068 0 CA-C-O 115.601 -2.143 . . . . 0.0 113.344 175.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -65.85 -22.51 56.27 Favored 'Trans proline' 0 CA--C 1.575 2.564 0 CA-C-N 125.667 3.06 . . . . 0.0 116.63 161.049 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.7 m 66.3 -89.14 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 125.826 1.65 . . . . 0.0 111.935 171.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . 58.54 -72.55 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.98 0 C-N-CA 126.655 1.982 . . . . 0.0 115.498 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -63.23 -47.11 83.87 Favored 'General case' 0 N--CA 1.497 1.878 0 CA-C-N 120.776 1.625 . . . . 0.0 113.124 165.343 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.95 -42.35 68.79 Favored 'General case' 0 N--CA 1.496 1.872 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 165.292 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -66.67 -45.85 77.6 Favored 'General case' 0 CA--C 1.563 1.474 0 N-CA-C 114.83 1.419 . . . . 0.0 114.83 174.236 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.97 -38.62 57.29 Favored 'General case' 0 CA--C 1.576 1.96 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 167.813 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 82.7 mt -70.88 -41.93 70.7 Favored 'General case' 0 CA--C 1.571 1.785 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 166.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 34.8 ttpt -64.79 -44.58 89.51 Favored 'General case' 0 N--CA 1.494 1.744 0 CA-C-N 121.092 1.769 . . . . 0.0 114.34 -177.363 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -62.5 -35.86 80.7 Favored 'General case' 0 CA--C 1.575 1.905 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 173.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.12 -56.04 22.8 Favored 'General case' 0 CA--C 1.57 1.748 0 N-CA-C 113.982 1.105 . . . . 0.0 113.982 164.13 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -57.66 -41.28 81.17 Favored 'General case' 0 CA--C 1.571 1.757 0 CA-C-N 120.641 1.564 . . . . 0.0 115.192 176.351 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.7 tpm_? -64.89 -35.0 79.72 Favored 'General case' 0 CA--C 1.574 1.883 0 CA-C-N 120.453 1.479 . . . . 0.0 114.607 169.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.8 ttt180 -61.71 -38.42 87.79 Favored 'General case' 0 CA--C 1.573 1.834 0 CA-C-N 121.632 2.014 . . . . 0.0 114.409 169.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -102.14 10.88 39.08 Favored 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 114.741 1.386 . . . . 0.0 114.741 -177.891 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 78.7 m -99.24 130.17 27.75 Favored Pre-proline 0 CA--C 1.574 1.899 0 CA-C-N 119.992 1.269 . . . . 0.0 108.011 172.414 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_endo -74.3 -22.61 16.28 Favored 'Trans proline' 0 CA--C 1.569 2.253 0 C-N-CA 122.58 2.186 . . . . 0.0 117.136 -177.085 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 125.023 2.344 . . . . 0.0 110.797 -173.518 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 99.9 m . . . . . 0 CA--C 1.56 1.331 0 CA-C-O 120.809 0.338 . . . . 0.0 110.202 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -89.68 37.5 0.88 Allowed 'General case' 0 CA--C 1.576 1.945 0 N-CA-C 115.347 1.61 . . . . 0.0 115.347 175.675 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.2 tptt -162.94 -59.62 0.04 OUTLIER 'General case' 0 CA--C 1.567 1.609 0 O-C-N 120.696 -1.253 . . . . 0.0 110.43 174.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 48.9 t -93.43 70.39 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.575 1.914 0 CA-C-O 122.746 1.26 . . . . 0.0 108.759 -177.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.2 pttm -157.05 44.29 0.37 Allowed 'General case' 0 CA--C 1.575 1.906 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 149.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 72.84 50.3 14.3 Favored Glycine 0 CA--C 1.55 2.273 0 N-CA-C 120.766 3.066 . . . . 0.0 120.766 -165.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 72.6 mt -131.47 113.11 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 176.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 36.6 p -105.42 -80.42 0.55 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 120.906 -1.121 . . . . 0.0 108.497 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 34.4 tp60 -150.42 82.18 1.36 Allowed 'General case' 0 CA--C 1.552 1.044 0 CA-C-N 120.967 1.712 . . . . 0.0 110.469 178.179 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -95.01 -70.22 1.08 Allowed Glycine 0 N--CA 1.496 2.694 1 O-C-N 115.545 -4.472 . . . . 0.0 116.652 -24.206 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -77.15 91.32 1.18 Allowed 'Trans proline' 0 CA--C 1.566 2.121 0 CA-C-N 122.726 3.263 . . . . 0.0 114.278 -167.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -76.3 -45.61 31.66 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 114.667 1.358 . . . . 0.0 114.667 -174.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -84.07 7.89 17.2 Favored 'General case' 0 CA--C 1.574 1.896 0 N-CA-C 117.461 2.393 . . . . 0.0 117.461 -168.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 38.8 t -87.15 -56.06 0.34 Allowed Pre-proline 0 CA--C 1.579 2.063 0 CA-C-O 115.326 -2.274 . . . . 0.0 111.688 162.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -68.3 -41.85 6.34 Favored 'Trans proline' 0 CA--C 1.572 2.378 0 CA-C-N 126.089 3.21 . . . . 0.0 116.174 173.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.2 t -104.44 174.06 6.04 Favored 'General case' 0 CA--C 1.568 1.663 0 CA-C-N 119.499 1.045 . . . . 0.0 111.668 167.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . 65.01 -48.88 0.35 Allowed 'General case' 0 N--CA 1.508 2.45 0 N-CA-C 115.869 1.803 . . . . 0.0 115.869 175.101 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -57.58 -46.5 83.92 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 119.459 -2.025 . . . . 0.0 113.597 154.037 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 36.8 tp -50.67 -44.28 57.63 Favored 'General case' 0 CA--C 1.574 1.885 0 N-CA-C 115.203 1.557 . . . . 0.0 115.203 166.033 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -75.31 -34.59 61.27 Favored 'General case' 0 CA--C 1.567 1.613 0 N-CA-C 114.965 1.469 . . . . 0.0 114.965 174.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 58.4 mtm180 -55.17 -43.74 74.58 Favored 'General case' 0 CA--C 1.577 1.989 0 CA-C-N 121.458 1.935 . . . . 0.0 113.776 163.767 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.1 mt -65.18 -36.75 85.19 Favored 'General case' 0 CA--C 1.575 1.905 0 N-CA-C 114.775 1.398 . . . . 0.0 114.775 166.526 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 18.9 ttmm -69.15 -41.01 77.84 Favored 'General case' 0 N--CA 1.494 1.767 0 CA-C-N 120.101 1.319 . . . . 0.0 113.889 177.082 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.4 mm-40 -58.23 -45.93 86.81 Favored 'General case' 0 CA--C 1.565 1.542 0 CA-C-N 119.779 1.172 . . . . 0.0 114.03 164.532 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.88 -52.85 63.8 Favored 'General case' 0 CA--C 1.571 1.761 0 N-CA-C 114.491 1.293 . . . . 0.0 114.491 172.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -65.06 -34.99 79.73 Favored 'General case' 0 CA--C 1.572 1.809 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 172.503 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -68.36 -42.81 78.66 Favored 'General case' 0 N--CA 1.494 1.747 0 CA-C-N 121.198 1.817 . . . . 0.0 114.511 173.21 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 92.3 mtt180 -67.83 -41.85 82.4 Favored 'General case' 0 CA--C 1.575 1.912 0 CA-C-N 120.789 1.632 . . . . 0.0 113.992 167.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -129.38 74.48 1.59 Allowed 'General case' 0 CA--C 1.568 1.662 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 -166.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 2.7 m -91.54 112.23 53.26 Favored Pre-proline 0 CA--C 1.573 1.839 0 O-C-N 120.714 -1.241 . . . . 0.0 108.128 -170.269 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -89.7 61.77 2.09 Favored 'Trans proline' 0 CA--C 1.571 2.352 0 CA-C-N 122.756 2.02 . . . . 0.0 115.2 -158.141 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 124.856 2.265 . . . . 0.0 108.561 -171.722 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.2 t . . . . . 0 CA--C 1.562 1.41 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.19 -27.33 68.62 Favored 'General case' 0 CA--C 1.571 1.775 0 N-CA-C 116.233 1.938 . . . . 0.0 116.233 175.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -75.46 -46.86 30.02 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-N 120.168 1.349 . . . . 0.0 113.77 163.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -59.79 -30.35 68.84 Favored 'General case' 0 CA--C 1.572 1.81 0 N-CA-C 115.099 1.518 . . . . 0.0 115.099 171.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -72.77 -41.77 64.7 Favored 'General case' 0 CA--C 1.563 1.445 0 CA-C-N 121.605 2.002 . . . . 0.0 114.525 170.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 79.5 mtm180 -54.86 -38.2 67.18 Favored 'General case' 0 CA--C 1.578 2.026 0 CA-C-N 120.594 1.543 . . . . 0.0 114.439 163.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 97.4 mt -68.49 -40.65 80.83 Favored 'General case' 0 CA--C 1.571 1.761 0 CA-C-O 117.661 -1.162 . . . . 0.0 114.045 167.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -72.28 -35.44 68.71 Favored 'General case' 0 N--CA 1.498 1.972 0 CA-C-N 121.677 2.035 . . . . 0.0 114.271 -178.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -64.71 -35.94 82.67 Favored 'General case' 0 CA--C 1.575 1.925 0 CA-C-N 121.235 1.834 . . . . 0.0 114.09 167.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.8 -55.89 22.33 Favored 'General case' 0 CA--C 1.57 1.726 0 CA-C-N 120.051 1.296 . . . . 0.0 113.558 166.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 14.8 m-30 -59.24 -35.24 73.32 Favored 'General case' 0 CA--C 1.568 1.657 0 N-CA-C 115.125 1.528 . . . . 0.0 115.125 175.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 2.9 tpp180 -69.93 -24.07 63.3 Favored 'General case' 0 CA--C 1.57 1.739 0 N-CA-C 115.536 1.68 . . . . 0.0 115.536 167.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 49.9 tpt85 -63.37 -32.87 74.41 Favored 'General case' 0 CA--C 1.577 1.991 0 CA-C-N 121.291 1.86 . . . . 0.0 114.845 164.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 9.5 p90 -120.48 39.22 3.79 Favored 'General case' 0 CA--C 1.578 2.04 0 C-N-CA 124.262 1.025 . . . . 0.0 113.544 174.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 57.2 m . . . . . 0 CA--C 1.581 2.154 0 O-C-N 119.755 -1.84 . . . . 0.0 106.362 166.838 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.4 m . . . . . 0 CA--C 1.568 1.656 0 CA-C-O 121.875 0.845 . . . . 0.0 110.899 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -148.53 -37.88 0.18 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.028 -1.045 . . . . 0.0 112.396 158.122 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -71.54 -42.2 68.2 Favored 'General case' 0 N--CA 1.5 2.072 0 CA-C-N 121.369 1.895 . . . . 0.0 112.92 161.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.6 mp -51.79 -46.46 64.21 Favored 'General case' 0 CA--C 1.574 1.902 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 164.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 82.8 mt-10 -64.47 -40.5 95.8 Favored 'General case' 0 CA--C 1.565 1.546 0 N-CA-C 116.015 1.858 . . . . 0.0 116.015 171.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 71.2 mtm180 -55.79 -37.34 68.47 Favored 'General case' 0 CA--C 1.577 1.988 0 CA-C-N 121.379 1.9 . . . . 0.0 114.44 166.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 93.6 mt -67.94 -39.1 83.51 Favored 'General case' 0 CA--C 1.573 1.853 0 CA-C-O 117.56 -1.21 . . . . 0.0 113.854 166.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -64.68 -42.02 95.64 Favored 'General case' 0 N--CA 1.5 2.039 0 CA-C-N 121.849 2.113 . . . . 0.0 114.368 177.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -69.47 -35.57 75.73 Favored 'General case' 0 CA--C 1.571 1.77 0 CA-C-N 120.018 1.281 . . . . 0.0 114.276 171.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.79 -51.42 69.41 Favored 'General case' 0 CA--C 1.574 1.866 0 CA-C-N 120.817 1.644 . . . . 0.0 114.465 167.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 34.8 m-85 -72.78 -7.25 49.78 Favored 'General case' 0 CA--C 1.576 1.946 0 N-CA-C 116.218 1.932 . . . . 0.0 116.218 172.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -105.1 54.0 0.71 Allowed 'General case' 0 CA--C 1.571 1.781 0 CA-C-N 121.675 2.034 . . . . 0.0 111.626 162.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 34.3 ttp-105 -169.41 -37.5 0.02 OUTLIER 'General case' 0 CA--C 1.569 1.707 0 C-N-CA 124.819 1.248 . . . . 0.0 111.883 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -54.51 -28.94 48.67 Favored 'General case' 0 CA--C 1.581 2.141 0 N-CA-C 117.471 2.397 . . . . 0.0 117.471 178.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.2 t . . . . . 0 CA--C 1.579 2.079 0 CA-C-N 120.112 1.324 . . . . 0.0 108.912 159.082 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.4 t . . . . . 0 N--CA 1.503 2.222 1 N-CA-C 123.456 4.613 . . . . 0.0 123.456 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -77.02 141.49 40.31 Favored 'General case' 0 CA--C 1.566 1.578 0 O-C-N 119.789 -1.82 . . . . 0.0 111.185 161.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 37.4 t80 68.58 -47.57 0.55 Allowed 'General case' 0 N--CA 1.512 2.64 0 C-N-CA 124.967 1.307 . . . . 0.0 113.319 -161.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -63.09 -21.37 66.13 Favored 'General case' 0 CA--C 1.574 1.885 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 172.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -73.87 -37.41 64.74 Favored 'General case' 0 CA--C 1.565 1.527 0 CA-C-N 121.795 2.089 . . . . 0.0 115.454 163.105 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 74.8 mmt-85 -60.06 -38.49 82.99 Favored 'General case' 0 CA--C 1.569 1.684 0 CA-C-N 120.506 1.503 . . . . 0.0 114.178 165.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 95.7 mt -68.09 -37.5 81.28 Favored 'General case' 0 CA--C 1.571 1.769 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 166.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.8 ttmp? -73.49 -38.96 65.21 Favored 'General case' 0 N--CA 1.501 2.076 0 CA-C-N 121.403 1.911 . . . . 0.0 114.375 -177.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -64.39 -38.19 90.18 Favored 'General case' 0 CA--C 1.577 1.998 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 167.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.39 -47.3 84.73 Favored 'General case' 0 CA--C 1.571 1.774 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 167.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -59.44 -28.19 66.75 Favored 'General case' 0 CA--C 1.569 1.693 0 N-CA-C 115.969 1.84 . . . . 0.0 115.969 169.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.2 -3.99 42.43 Favored 'General case' 0 CA--C 1.578 2.02 0 N-CA-C 115.989 1.848 . . . . 0.0 115.989 165.28 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 66.5 mmt-85 -79.63 -45.25 19.44 Favored 'General case' 0 CA--C 1.569 1.678 0 CA-C-N 121.686 2.039 . . . . 0.0 112.341 152.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -67.8 -48.47 66.19 Favored 'General case' 0 CA--C 1.574 1.87 0 CA-C-N 119.086 0.857 . . . . 0.0 113.104 -177.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 91.7 m . . . . . 0 CA--C 1.581 2.159 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 168.291 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.5 m . . . . . 0 CA--C 1.566 1.59 0 CA-C-O 122.328 1.061 . . . . 0.0 111.067 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -147.42 -42.47 0.17 Allowed 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 118.34 -0.838 . . . . 0.0 111.662 155.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -62.89 -38.16 89.79 Favored 'General case' 0 N--CA 1.499 1.979 0 CA-C-N 121.048 1.749 . . . . 0.0 113.982 163.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -47.49 -42.89 23.92 Favored 'General case' 0 CA--C 1.576 1.948 0 N-CA-C 115.194 1.553 . . . . 0.0 115.194 161.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -72.71 -37.32 67.83 Favored 'General case' 0 CA--C 1.566 1.564 0 N-CA-C 115.035 1.494 . . . . 0.0 115.035 170.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 58.5 mtt-85 -52.81 -45.37 67.2 Favored 'General case' 0 CA--C 1.579 2.067 0 CA-C-N 121.537 1.971 . . . . 0.0 113.476 165.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 95.6 mt -63.45 -40.21 96.54 Favored 'General case' 0 CA--C 1.57 1.727 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 168.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.0 mmpt? -62.54 -38.03 88.4 Favored 'General case' 0 N--CA 1.497 1.915 0 CA-C-N 121.086 1.766 . . . . 0.0 114.883 172.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -60.96 -46.66 89.82 Favored 'General case' 0 CA--C 1.569 1.7 0 CA-C-N 119.957 1.253 . . . . 0.0 113.306 168.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.411 ' O ' ' HB3' ' A' ' 28' ' ' ARG . . . -60.17 -50.35 74.03 Favored 'General case' 0 CA--C 1.57 1.732 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 170.553 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 20.1 m-30 -56.57 -37.31 70.41 Favored 'General case' 0 CA--C 1.574 1.876 0 CA-C-N 120.925 1.693 . . . . 0.0 114.795 170.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -25.64 68.43 Favored 'General case' 0 CA--C 1.582 2.174 0 N-CA-C 115.084 1.513 . . . . 0.0 115.084 170.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.411 ' HB3' ' O ' ' A' ' 25' ' ' ALA . 7.5 tpm_? -56.25 -35.37 67.32 Favored 'General case' 0 CA--C 1.578 2.024 0 CA-C-N 121.982 2.173 . . . . 0.0 115.308 162.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -102.92 -43.9 5.4 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 124.246 1.019 . . . . 0.0 112.42 -171.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 86.2 m . . . . . 0 CA--C 1.574 1.866 0 CA-C-O 117.791 -1.099 . . . . 0.0 108.906 174.486 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 97.5 p . . . . . 0 CA--C 1.567 1.614 0 N-CA-C 116.225 1.935 . . . . 0.0 116.225 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.88 -38.0 89.5 Favored 'General case' 0 CA--C 1.571 1.785 0 N-CA-C 115.372 1.619 . . . . 0.0 115.372 171.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -63.92 -44.11 93.89 Favored 'General case' 0 CA--C 1.573 1.829 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 166.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 13.5 tp -58.17 -45.63 87.15 Favored 'General case' 0 CA--C 1.567 1.633 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 169.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -67.39 -39.59 85.62 Favored 'General case' 0 CA--C 1.562 1.433 0 N-CA-C 114.738 1.384 . . . . 0.0 114.738 173.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.9 ttp85 -49.4 -43.05 44.04 Favored 'General case' 0 CA--C 1.581 2.141 0 CA-C-N 121.484 1.947 . . . . 0.0 114.547 163.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 93.1 mt -67.97 -46.42 71.43 Favored 'General case' 0 CA--C 1.569 1.686 0 CA-C-O 117.594 -1.193 . . . . 0.0 113.642 168.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.6 mttm -66.14 -39.42 89.83 Favored 'General case' 0 N--CA 1.502 2.149 0 CA-C-N 121.8 2.091 . . . . 0.0 114.48 178.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -61.45 -33.59 74.0 Favored 'General case' 0 CA--C 1.571 1.773 0 N-CA-C 114.819 1.414 . . . . 0.0 114.819 169.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.11 -45.91 65.93 Favored 'General case' 0 CA--C 1.572 1.804 0 N-CA-C 115.056 1.502 . . . . 0.0 115.056 163.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 14.8 m-30 -69.98 -23.74 63.21 Favored 'General case' 0 CA--C 1.565 1.557 0 N-CA-C 116.413 2.005 . . . . 0.0 116.413 -178.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -72.72 73.28 1.08 Allowed 'General case' 0 CA--C 1.577 2.008 0 CA-C-N 121.445 1.929 . . . . 0.0 110.296 166.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.66 -55.76 0.03 OUTLIER 'General case' 0 CA--C 1.564 1.506 0 C-N-CA 125.757 1.623 . . . . 0.0 108.194 -169.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 24.7 p90 -75.32 -32.29 60.88 Favored 'General case' 0 CA--C 1.578 2.054 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 162.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 23.3 m . . . . . 0 CA--C 1.576 1.958 0 CA-C-N 120.469 1.486 . . . . 0.0 108.458 170.945 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 76.1 p . . . . . 0 CA--C 1.573 1.863 0 N-CA-C 115.678 1.733 . . . . 0.0 115.678 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.0 -42.95 84.14 Favored 'General case' 0 CA--C 1.571 1.776 0 CA-C-N 120.841 1.655 . . . . 0.0 114.877 164.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -67.28 -40.17 86.09 Favored 'General case' 0 CA--C 1.573 1.855 0 CA-C-N 120.44 1.473 . . . . 0.0 114.6 173.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.0 mp -56.12 -39.17 71.81 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 165.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.99 -34.12 61.95 Favored 'General case' 0 CA--C 1.569 1.706 0 CA-C-N 120.885 1.675 . . . . 0.0 115.213 172.562 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 74.8 ttt-85 -53.08 -44.35 67.47 Favored 'General case' 0 CA--C 1.578 2.053 0 CA-C-N 120.568 1.531 . . . . 0.0 114.243 159.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 94.7 mt -70.31 -39.97 74.47 Favored 'General case' 0 CA--C 1.569 1.699 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 171.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 61.0 tttm -69.05 -41.77 77.18 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-N 120.779 1.627 . . . . 0.0 114.227 -174.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -62.54 -31.19 71.94 Favored 'General case' 0 CA--C 1.58 2.115 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 168.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.24 -41.82 39.68 Favored 'General case' 0 CA--C 1.573 1.83 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 168.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 22.4 m-30 -57.91 -39.73 78.67 Favored 'General case' 0 CA--C 1.577 2.017 0 CA-C-N 121.451 1.932 . . . . 0.0 114.717 170.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 30.5 ttp180 -50.11 -38.31 38.18 Favored 'General case' 0 CA--C 1.579 2.087 0 N-CA-C 116.029 1.862 . . . . 0.0 116.029 157.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.6 tpm_? -76.34 -42.11 46.0 Favored 'General case' 0 CA--C 1.572 1.819 0 CA-C-N 121.424 1.92 . . . . 0.0 113.999 172.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -68.22 -18.59 64.61 Favored 'General case' 0 N--CA 1.503 2.21 0 N-CA-C 114.801 1.408 . . . . 0.0 114.801 174.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 17.8 m . . . . . 0 CA--C 1.583 2.22 0 C-N-CA 123.88 0.872 . . . . 0.0 108.858 159.715 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 59.6 p . . . . . 0 N--CA 1.498 1.97 0 CA-C-O 116.972 -1.49 . . . . 0.0 109.155 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . 62.13 -60.19 0.12 Allowed 'General case' 0 N--CA 1.508 2.435 0 N-CA-C 116.532 2.049 . . . . 0.0 116.532 169.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -65.69 -48.35 72.35 Favored 'General case' 0 N--CA 1.496 1.861 0 CA-C-N 120.5 1.5 . . . . 0.0 112.894 158.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 16.3 tp -50.68 -44.35 57.8 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 164.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -66.91 -39.81 87.52 Favored 'General case' 0 CA--C 1.564 1.502 0 N-CA-C 115.791 1.774 . . . . 0.0 115.791 173.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 78.9 mtt85 -54.04 -44.06 70.69 Favored 'General case' 0 CA--C 1.573 1.857 0 CA-C-N 121.571 1.987 . . . . 0.0 114.145 163.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 98.4 mt -64.42 -40.08 95.08 Favored 'General case' 0 CA--C 1.569 1.686 0 CA-C-O 117.222 -1.37 . . . . 0.0 113.726 169.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -66.01 -38.07 87.53 Favored 'General case' 0 N--CA 1.502 2.147 0 CA-C-N 122.159 2.254 . . . . 0.0 113.952 173.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -64.65 -38.18 90.11 Favored 'General case' 0 CA--C 1.577 2.011 0 N-CA-C 113.971 1.1 . . . . 0.0 113.971 170.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.93 -42.69 84.9 Favored 'General case' 0 CA--C 1.571 1.767 0 N-CA-C 115.885 1.809 . . . . 0.0 115.885 165.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 15.8 m-30 -75.26 -29.62 60.24 Favored 'General case' 0 CA--C 1.568 1.672 0 CA-C-N 120.5 1.5 . . . . 0.0 114.693 179.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -72.47 61.09 0.48 Allowed 'General case' 0 CA--C 1.581 2.168 0 CA-C-N 120.873 1.67 . . . . 0.0 112.394 165.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 94.4 mtt180 -158.27 -55.34 0.07 Allowed 'General case' 0 CA--C 1.567 1.632 0 C-N-CA 125.909 1.684 . . . . 0.0 109.608 -173.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 22.4 p90 -64.43 -35.28 80.41 Favored 'General case' 0 N--CA 1.502 2.147 0 N-CA-C 115.188 1.551 . . . . 0.0 115.188 -176.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.1 t . . . . . 0 CA--C 1.57 1.733 0 CA-C-N 120.315 1.416 . . . . 0.0 107.695 160.248 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.7 m . . . . . 0 N--CA 1.498 1.96 0 CA-C-O 117.973 -1.013 . . . . 0.0 111.935 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . 58.54 -72.55 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.98 0 C-N-CA 126.655 1.982 . . . . 0.0 115.498 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -63.23 -47.11 83.87 Favored 'General case' 0 N--CA 1.497 1.878 0 CA-C-N 120.776 1.625 . . . . 0.0 113.124 165.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.95 -42.35 68.79 Favored 'General case' 0 N--CA 1.496 1.872 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 165.292 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -66.67 -45.85 77.6 Favored 'General case' 0 CA--C 1.563 1.474 0 N-CA-C 114.83 1.419 . . . . 0.0 114.83 174.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.97 -38.62 57.29 Favored 'General case' 0 CA--C 1.576 1.96 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 167.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 82.7 mt -70.88 -41.93 70.7 Favored 'General case' 0 CA--C 1.571 1.785 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 166.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 34.8 ttpt -64.79 -44.58 89.51 Favored 'General case' 0 N--CA 1.494 1.744 0 CA-C-N 121.092 1.769 . . . . 0.0 114.34 -177.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -62.5 -35.86 80.7 Favored 'General case' 0 CA--C 1.575 1.905 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 173.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.12 -56.04 22.8 Favored 'General case' 0 CA--C 1.57 1.748 0 N-CA-C 113.982 1.105 . . . . 0.0 113.982 164.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -57.66 -41.28 81.17 Favored 'General case' 0 CA--C 1.571 1.757 0 CA-C-N 120.641 1.564 . . . . 0.0 115.192 176.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.7 tpm_? -64.89 -35.0 79.72 Favored 'General case' 0 CA--C 1.574 1.883 0 CA-C-N 120.453 1.479 . . . . 0.0 114.607 169.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.8 ttt180 -61.71 -38.42 87.79 Favored 'General case' 0 CA--C 1.573 1.834 0 CA-C-N 121.632 2.014 . . . . 0.0 114.409 169.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -102.14 10.88 39.08 Favored 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 114.741 1.386 . . . . 0.0 114.741 -177.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 78.7 m . . . . . 0 CA--C 1.574 1.899 0 CA-C-N 119.992 1.269 . . . . 0.0 108.011 172.414 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 CA--C 1.568 1.663 0 CA-C-O 121.182 0.515 . . . . 0.0 111.668 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . 65.01 -48.88 0.35 Allowed 'General case' 0 N--CA 1.508 2.45 0 N-CA-C 115.869 1.803 . . . . 0.0 115.869 175.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -57.58 -46.5 83.92 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 119.459 -2.025 . . . . 0.0 113.597 154.037 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 36.8 tp -50.67 -44.28 57.63 Favored 'General case' 0 CA--C 1.574 1.885 0 N-CA-C 115.203 1.557 . . . . 0.0 115.203 166.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -75.31 -34.59 61.27 Favored 'General case' 0 CA--C 1.567 1.613 0 N-CA-C 114.965 1.469 . . . . 0.0 114.965 174.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 58.4 mtm180 -55.17 -43.74 74.58 Favored 'General case' 0 CA--C 1.577 1.989 0 CA-C-N 121.458 1.935 . . . . 0.0 113.776 163.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.1 mt -65.18 -36.75 85.19 Favored 'General case' 0 CA--C 1.575 1.905 0 N-CA-C 114.775 1.398 . . . . 0.0 114.775 166.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 18.9 ttmm -69.15 -41.01 77.84 Favored 'General case' 0 N--CA 1.494 1.767 0 CA-C-N 120.101 1.319 . . . . 0.0 113.889 177.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.4 mm-40 -58.23 -45.93 86.81 Favored 'General case' 0 CA--C 1.565 1.542 0 CA-C-N 119.779 1.172 . . . . 0.0 114.03 164.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.88 -52.85 63.8 Favored 'General case' 0 CA--C 1.571 1.761 0 N-CA-C 114.491 1.293 . . . . 0.0 114.491 172.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -65.06 -34.99 79.73 Favored 'General case' 0 CA--C 1.572 1.809 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 172.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -68.36 -42.81 78.66 Favored 'General case' 0 N--CA 1.494 1.747 0 CA-C-N 121.198 1.817 . . . . 0.0 114.511 173.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 92.3 mtt180 -67.83 -41.85 82.4 Favored 'General case' 0 CA--C 1.575 1.912 0 CA-C-N 120.789 1.632 . . . . 0.0 113.992 167.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -129.38 74.48 1.59 Allowed 'General case' 0 CA--C 1.568 1.662 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 -166.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 2.7 m . . . . . 0 CA--C 1.573 1.839 0 O-C-N 120.714 -1.241 . . . . 0.0 108.128 -170.269 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 26.2 p . . . . . 0 CA--C 1.56 1.351 0 CA-C-O 121.463 0.649 . . . . 0.0 109.938 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -75.67 -59.94 2.53 Favored 'General case' 0 CA--C 1.568 1.648 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 -174.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.6 tmtm? -68.7 -17.98 64.17 Favored 'General case' 0 CA--C 1.579 2.086 0 N-CA-C 116.872 2.175 . . . . 0.0 116.872 -176.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 92.0 t -105.05 79.72 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 CA-C-N 120.331 1.423 . . . . 0.0 107.404 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 50.1 mttm -138.46 62.16 1.56 Allowed 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 168.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -134.15 87.49 0.26 Allowed Glycine 0 CA--C 1.545 1.951 0 O-C-N 120.966 -1.084 . . . . 0.0 114.666 -152.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 52.0 mm -98.45 131.25 45.93 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 2 CA-C-N 125.58 4.69 . . . . 0.0 108.006 -3.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 89.9 m -97.96 121.2 39.59 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.29 -0.881 . . . . 0.0 109.541 174.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 73.79 93.72 0.08 Allowed 'General case' 0 N--CA 1.501 2.084 0 C-N-CA 125.38 1.472 . . . . 0.0 110.628 -176.306 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -65.48 152.39 51.46 Favored Glycine 0 CA--C 1.561 2.928 1 O-C-N 116.026 -4.171 . . . . 0.0 118.111 -24.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -51.7 94.45 0.03 OUTLIER 'Trans proline' 0 CA--C 1.569 2.255 0 C-N-CA 124.485 3.457 . . . . 0.0 115.879 171.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 8.3 t30 48.0 49.96 16.47 Favored 'General case' 0 N--CA 1.505 2.286 0 C-N-CA 125.009 1.323 . . . . 0.0 113.931 -162.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 34.32 36.61 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.518 0 N-CA-C 117.953 2.575 . . . . 0.0 117.953 -165.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 36.7 m -73.29 -52.43 5.28 Favored Pre-proline 0 CA--C 1.573 1.851 0 CA-C-O 115.851 -2.023 . . . . 0.0 112.496 -173.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -65.31 -48.77 3.09 Favored 'Trans proline' 0 CA--C 1.567 2.16 0 CA-C-N 125.288 2.924 . . . . 0.0 114.485 161.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.2 t -57.34 -48.64 78.46 Favored 'General case' 0 CA--C 1.562 1.41 0 N-CA-C 115.68 1.733 . . . . 0.0 115.68 -170.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.19 -27.33 68.62 Favored 'General case' 0 CA--C 1.571 1.775 0 N-CA-C 116.233 1.938 . . . . 0.0 116.233 175.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -75.46 -46.86 30.02 Favored 'General case' 0 N--CA 1.494 1.751 0 CA-C-N 120.168 1.349 . . . . 0.0 113.77 163.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -59.79 -30.35 68.84 Favored 'General case' 0 CA--C 1.572 1.81 0 N-CA-C 115.099 1.518 . . . . 0.0 115.099 171.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -72.77 -41.77 64.7 Favored 'General case' 0 CA--C 1.563 1.445 0 CA-C-N 121.605 2.002 . . . . 0.0 114.525 170.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 79.5 mtm180 -54.86 -38.2 67.18 Favored 'General case' 0 CA--C 1.578 2.026 0 CA-C-N 120.594 1.543 . . . . 0.0 114.439 163.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 97.4 mt -68.49 -40.65 80.83 Favored 'General case' 0 CA--C 1.571 1.761 0 CA-C-O 117.661 -1.162 . . . . 0.0 114.045 167.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -72.28 -35.44 68.71 Favored 'General case' 0 N--CA 1.498 1.972 0 CA-C-N 121.677 2.035 . . . . 0.0 114.271 -178.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -64.71 -35.94 82.67 Favored 'General case' 0 CA--C 1.575 1.925 0 CA-C-N 121.235 1.834 . . . . 0.0 114.09 167.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.8 -55.89 22.33 Favored 'General case' 0 CA--C 1.57 1.726 0 CA-C-N 120.051 1.296 . . . . 0.0 113.558 166.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 14.8 m-30 -59.24 -35.24 73.32 Favored 'General case' 0 CA--C 1.568 1.657 0 N-CA-C 115.125 1.528 . . . . 0.0 115.125 175.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 2.9 tpp180 -69.93 -24.07 63.3 Favored 'General case' 0 CA--C 1.57 1.739 0 N-CA-C 115.536 1.68 . . . . 0.0 115.536 167.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 49.9 tpt85 -63.37 -32.87 74.41 Favored 'General case' 0 CA--C 1.577 1.991 0 CA-C-N 121.291 1.86 . . . . 0.0 114.845 164.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 9.5 p90 -120.48 39.22 3.79 Favored 'General case' 0 CA--C 1.578 2.04 0 C-N-CA 124.262 1.025 . . . . 0.0 113.544 174.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 57.2 m -169.6 113.39 0.5 Allowed Pre-proline 0 CA--C 1.581 2.154 0 O-C-N 119.755 -1.84 . . . . 0.0 106.362 166.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -85.47 67.9 5.62 Favored 'Trans proline' 0 CA--C 1.57 2.305 0 C-N-CA 123.319 2.679 . . . . 0.0 114.526 -176.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 . . . . . 0 N--CA 1.503 2.202 0 CA-C-O 125.353 2.501 . . . . 0.0 111.137 -176.558 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 43.5 t . . . . . 0 CA--C 1.561 1.371 0 CA-C-O 121.405 0.622 . . . . 0.0 110.347 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.74 -22.57 62.4 Favored 'General case' 0 CA--C 1.572 1.806 0 N-CA-C 117.288 2.329 . . . . 0.0 117.288 -177.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.6 115.04 4.81 Favored 'General case' 0 CA--C 1.567 1.605 0 CA-C-N 120.228 1.376 . . . . 0.0 108.219 170.543 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.4 p -92.2 49.79 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.585 2.307 0 CA-C-O 122.572 1.177 . . . . 0.0 112.86 -179.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -158.76 73.0 0.6 Allowed 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 104.945 -2.243 . . . . 0.0 104.945 167.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 172.46 69.32 0.04 OUTLIER Glycine 0 N--CA 1.481 1.683 0 C-N-CA 120.583 -0.818 . . . . 0.0 114.727 -155.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 42.4 mm -113.04 135.41 52.62 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 N-CA-C 106.418 -1.697 . . . . 0.0 106.418 173.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.2 m -55.32 -27.37 46.58 Favored 'General case' 0 N--CA 1.504 2.234 0 N-CA-C 116.991 2.219 . . . . 0.0 116.991 -166.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 41.6 mm-40 -136.63 44.96 2.33 Favored 'General case' 0 CA--C 1.567 1.597 0 CA-C-N 120.686 1.584 . . . . 0.0 110.113 164.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -170.95 41.5 0.19 Allowed Glycine 0 CA--C 1.559 2.822 0 N-CA-C 120.975 3.15 . . . . 0.0 120.975 -166.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -77.02 68.88 7.22 Favored 'Trans proline' 0 CA--C 1.575 2.526 1 CA-C-N 125.88 4.84 . . . . 0.0 114.724 179.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 23.9 m120 61.77 79.15 0.26 Allowed 'General case' 0 N--CA 1.505 2.306 0 C-N-CA 125.652 1.581 . . . . 0.0 110.789 -165.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -92.16 -22.24 19.96 Favored 'General case' 0 N--CA 1.498 1.961 0 N-CA-C 117.764 2.505 . . . . 0.0 117.764 -169.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 73.5 p -61.38 -39.18 60.18 Favored Pre-proline 0 CA--C 1.58 2.132 0 CA-C-O 114.407 -2.711 . . . . 0.0 115.768 169.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -66.31 -54.73 0.45 Allowed 'Trans proline' 0 CA--C 1.568 2.201 0 CA-C-N 127.141 3.586 . . . . 0.0 114.755 169.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.4 m -170.68 84.27 0.1 Allowed 'General case' 0 CA--C 1.568 1.656 0 CA-C-N 120.878 1.672 . . . . 0.0 110.899 172.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -148.53 -37.88 0.18 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.028 -1.045 . . . . 0.0 112.396 158.122 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -71.54 -42.2 68.2 Favored 'General case' 0 N--CA 1.5 2.072 0 CA-C-N 121.369 1.895 . . . . 0.0 112.92 161.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.6 mp -51.79 -46.46 64.21 Favored 'General case' 0 CA--C 1.574 1.902 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 164.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 82.8 mt-10 -64.47 -40.5 95.8 Favored 'General case' 0 CA--C 1.565 1.546 0 N-CA-C 116.015 1.858 . . . . 0.0 116.015 171.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 71.2 mtm180 -55.79 -37.34 68.47 Favored 'General case' 0 CA--C 1.577 1.988 0 CA-C-N 121.379 1.9 . . . . 0.0 114.44 166.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 93.6 mt -67.94 -39.1 83.51 Favored 'General case' 0 CA--C 1.573 1.853 0 CA-C-O 117.56 -1.21 . . . . 0.0 113.854 166.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp -64.68 -42.02 95.64 Favored 'General case' 0 N--CA 1.5 2.039 0 CA-C-N 121.849 2.113 . . . . 0.0 114.368 177.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -69.47 -35.57 75.73 Favored 'General case' 0 CA--C 1.571 1.77 0 CA-C-N 120.018 1.281 . . . . 0.0 114.276 171.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.79 -51.42 69.41 Favored 'General case' 0 CA--C 1.574 1.866 0 CA-C-N 120.817 1.644 . . . . 0.0 114.465 167.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 34.8 m-85 -72.78 -7.25 49.78 Favored 'General case' 0 CA--C 1.576 1.946 0 N-CA-C 116.218 1.932 . . . . 0.0 116.218 172.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -105.1 54.0 0.71 Allowed 'General case' 0 CA--C 1.571 1.781 0 CA-C-N 121.675 2.034 . . . . 0.0 111.626 162.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 34.3 ttp-105 -169.41 -37.5 0.02 OUTLIER 'General case' 0 CA--C 1.569 1.707 0 C-N-CA 124.819 1.248 . . . . 0.0 111.883 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -54.51 -28.94 48.67 Favored 'General case' 0 CA--C 1.581 2.141 0 N-CA-C 117.471 2.397 . . . . 0.0 117.471 178.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.2 t -94.38 131.17 31.74 Favored Pre-proline 0 CA--C 1.579 2.079 0 CA-C-N 120.112 1.324 . . . . 0.0 108.912 159.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -66.61 -34.93 31.02 Favored 'Trans proline' 0 CA--C 1.571 2.351 0 CA-C-N 122.83 2.046 . . . . 0.0 116.121 176.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 . . . . . 0 N--CA 1.488 1.431 0 CA-C-O 125.34 2.495 . . . . 0.0 109.393 169.013 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 72.3 m . . . . . 0 CA--C 1.561 1.374 0 CA-C-O 121.099 0.476 . . . . 0.0 110.448 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -88.33 75.48 8.5 Favored 'General case' 0 CA--C 1.57 1.719 0 CA-C-O 122.209 1.005 . . . . 0.0 112.579 -176.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 85.3 tttt 66.98 -79.05 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.028 0 C-N-CA 126.017 1.727 . . . . 0.0 111.653 -176.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 94.8 t -127.17 88.12 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 N-CA-C 104.99 -2.226 . . . . 0.0 104.99 167.302 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 179.57 81.7 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 103.811 -2.662 . . . . 0.0 103.811 -177.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -164.91 -141.66 3.19 Favored Glycine 0 N--CA 1.483 1.83 0 N-CA-C 114.822 0.689 . . . . 0.0 114.822 -160.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 36.1 mm -72.37 93.9 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.127 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 -177.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 12.8 p -143.3 -73.54 0.28 Allowed 'General case' 0 N--CA 1.499 2.019 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 -159.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -146.11 65.1 1.21 Allowed 'General case' 0 CA--C 1.568 1.661 0 N-CA-C 106.386 -1.709 . . . . 0.0 106.386 165.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 148.82 80.24 0.03 OUTLIER Glycine 0 CA--C 1.551 2.316 0 CA-C-O 117.411 -1.771 . . . . 0.0 111.966 -147.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -78.27 89.53 1.34 Allowed 'Trans proline' 0 CA--C 1.565 2.042 0 CA-C-N 122.286 3.043 . . . . 0.0 112.949 -176.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 12.2 p-10 -64.1 -29.19 70.34 Favored 'General case' 0 CA--C 1.576 1.956 0 N-CA-C 116.896 2.184 . . . . 0.0 116.896 -174.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -81.25 76.54 8.19 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-O 122.956 1.36 . . . . 0.0 109.775 173.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 47.0 t -118.65 46.67 0.76 Allowed Pre-proline 0 CA--C 1.59 2.5 0 N-CA-C 115.701 1.741 . . . . 0.0 115.701 169.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 0.2 OUTLIER -92.2 -156.16 0.65 Allowed 'Cis proline' 0 CA--C 1.583 2.949 0 CA-C-N 124.844 2.766 . . . . 0.0 113.497 -6.467 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.4 t 16.99 44.6 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.222 1 N-CA-C 123.456 4.613 . . . . 0.0 123.456 158.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -77.02 141.49 40.31 Favored 'General case' 0 CA--C 1.566 1.578 0 O-C-N 119.789 -1.82 . . . . 0.0 111.185 161.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 37.4 t80 68.58 -47.57 0.55 Allowed 'General case' 0 N--CA 1.512 2.64 0 C-N-CA 124.967 1.307 . . . . 0.0 113.319 -161.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -63.09 -21.37 66.13 Favored 'General case' 0 CA--C 1.574 1.885 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 172.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -73.87 -37.41 64.74 Favored 'General case' 0 CA--C 1.565 1.527 0 CA-C-N 121.795 2.089 . . . . 0.0 115.454 163.105 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 74.8 mmt-85 -60.06 -38.49 82.99 Favored 'General case' 0 CA--C 1.569 1.684 0 CA-C-N 120.506 1.503 . . . . 0.0 114.178 165.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 95.7 mt -68.09 -37.5 81.28 Favored 'General case' 0 CA--C 1.571 1.769 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 166.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.8 ttmp? -73.49 -38.96 65.21 Favored 'General case' 0 N--CA 1.501 2.076 0 CA-C-N 121.403 1.911 . . . . 0.0 114.375 -177.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -64.39 -38.19 90.18 Favored 'General case' 0 CA--C 1.577 1.998 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 167.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.39 -47.3 84.73 Favored 'General case' 0 CA--C 1.571 1.774 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 167.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -59.44 -28.19 66.75 Favored 'General case' 0 CA--C 1.569 1.693 0 N-CA-C 115.969 1.84 . . . . 0.0 115.969 169.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -77.2 -3.99 42.43 Favored 'General case' 0 CA--C 1.578 2.02 0 N-CA-C 115.989 1.848 . . . . 0.0 115.989 165.28 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 66.5 mmt-85 -79.63 -45.25 19.44 Favored 'General case' 0 CA--C 1.569 1.678 0 CA-C-N 121.686 2.039 . . . . 0.0 112.341 152.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -67.8 -48.47 66.19 Favored 'General case' 0 CA--C 1.574 1.87 0 CA-C-N 119.086 0.857 . . . . 0.0 113.104 -177.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 91.7 m -119.65 95.85 49.4 Favored Pre-proline 0 CA--C 1.581 2.159 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 168.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -84.66 62.41 6.36 Favored 'Trans proline' 0 CA--C 1.57 2.286 0 C-N-CA 123.51 2.807 . . . . 0.0 114.884 -176.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 78.7 m-85 . . . . . 0 N--CA 1.493 1.705 0 CA-C-O 124.923 2.297 . . . . 0.0 109.868 -169.8 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 86.6 m . . . . . 0 CA--C 1.563 1.457 0 CA-C-O 118.37 -0.824 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -81.63 78.27 8.39 Favored 'General case' 0 CA--C 1.569 1.7 0 CA-C-N 120.888 1.676 . . . . 0.0 112.133 -178.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 67.6 mttm 53.38 70.05 0.64 Allowed 'General case' 0 N--CA 1.505 2.296 0 C-N-CA 125.171 1.388 . . . . 0.0 111.711 -169.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.4 m 46.4 90.38 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.471 0 C-N-CA 126.209 1.804 . . . . 0.0 112.094 -163.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.23 82.5 1.31 Allowed 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 105.466 -2.049 . . . . 0.0 105.466 177.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -153.62 -142.33 3.44 Favored Glycine 0 CA--C 1.542 1.769 0 N-CA-C 114.791 0.676 . . . . 0.0 114.791 -156.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 10.1 tp -96.21 123.75 48.6 Favored 'Isoleucine or valine' 0 CA--C 1.573 1.842 0 CA-C-O 122.199 0.999 . . . . 0.0 110.587 -169.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.7 m -76.21 -45.63 32.18 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -166.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -128.82 77.39 1.78 Allowed 'General case' 0 CA--C 1.563 1.464 0 CA-C-N 120.639 1.563 . . . . 0.0 113.129 179.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 171.99 70.37 0.04 OUTLIER Glycine 0 N--CA 1.488 2.142 1 O-C-N 115.278 -4.639 . . . . 0.0 117.243 -29.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -78.04 45.86 1.92 Allowed 'Trans proline' 0 CA--C 1.576 2.598 0 CA-C-N 123.267 3.534 . . . . 0.0 116.134 169.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -85.99 76.04 9.88 Favored 'General case' 0 CA--C 1.569 1.707 0 O-C-N 120.609 -1.307 . . . . 0.0 109.373 170.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 18.2 pt-20 -101.33 -5.99 24.69 Favored 'General case' 0 N--CA 1.497 1.892 0 N-CA-C 118.259 2.689 . . . . 0.0 118.259 -159.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.5 t -60.39 -35.54 27.86 Favored Pre-proline 0 CA--C 1.581 2.163 0 CA-C-O 114.422 -2.704 . . . . 0.0 116.735 166.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -70.11 -57.29 0.12 Allowed 'Trans proline' 0 CA--C 1.564 1.989 0 CA-C-N 127.117 3.578 . . . . 0.0 114.745 172.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.5 m -164.19 80.59 0.4 Allowed 'General case' 0 CA--C 1.566 1.59 0 CA-C-N 119.641 1.109 . . . . 0.0 111.067 173.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -147.42 -42.47 0.17 Allowed 'General case' 0 N--CA 1.495 1.793 0 CA-C-O 118.34 -0.838 . . . . 0.0 111.662 155.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -62.89 -38.16 89.79 Favored 'General case' 0 N--CA 1.499 1.979 0 CA-C-N 121.048 1.749 . . . . 0.0 113.982 163.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -47.49 -42.89 23.92 Favored 'General case' 0 CA--C 1.576 1.948 0 N-CA-C 115.194 1.553 . . . . 0.0 115.194 161.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -72.71 -37.32 67.83 Favored 'General case' 0 CA--C 1.566 1.564 0 N-CA-C 115.035 1.494 . . . . 0.0 115.035 170.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 58.5 mtt-85 -52.81 -45.37 67.2 Favored 'General case' 0 CA--C 1.579 2.067 0 CA-C-N 121.537 1.971 . . . . 0.0 113.476 165.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 95.6 mt -63.45 -40.21 96.54 Favored 'General case' 0 CA--C 1.57 1.727 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 168.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.0 mmpt? -62.54 -38.03 88.4 Favored 'General case' 0 N--CA 1.497 1.915 0 CA-C-N 121.086 1.766 . . . . 0.0 114.883 172.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -60.96 -46.66 89.82 Favored 'General case' 0 CA--C 1.569 1.7 0 CA-C-N 119.957 1.253 . . . . 0.0 113.306 168.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.411 ' O ' ' HB3' ' A' ' 28' ' ' ARG . . . -60.17 -50.35 74.03 Favored 'General case' 0 CA--C 1.57 1.732 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 170.553 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 20.1 m-30 -56.57 -37.31 70.41 Favored 'General case' 0 CA--C 1.574 1.876 0 CA-C-N 120.925 1.693 . . . . 0.0 114.795 170.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -25.64 68.43 Favored 'General case' 0 CA--C 1.582 2.174 0 N-CA-C 115.084 1.513 . . . . 0.0 115.084 170.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.411 ' HB3' ' O ' ' A' ' 25' ' ' ALA . 7.5 tpm_? -56.25 -35.37 67.32 Favored 'General case' 0 CA--C 1.578 2.024 0 CA-C-N 121.982 2.173 . . . . 0.0 115.308 162.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -102.92 -43.9 5.4 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 124.246 1.019 . . . . 0.0 112.42 -171.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 86.2 m -115.01 135.56 22.49 Favored Pre-proline 0 CA--C 1.574 1.866 0 CA-C-O 117.791 -1.099 . . . . 0.0 108.906 174.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -48.65 -35.34 29.5 Favored 'Trans proline' 0 CA--C 1.57 2.286 0 N-CA-C 119.077 2.684 . . . . 0.0 119.077 178.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 38.9 p90 . . . . . 0 CA--C 1.569 1.709 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 170.57 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 32.0 p . . . . . 0 CA--C 1.565 1.544 0 CA-C-O 122.11 0.957 . . . . 0.0 110.712 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -145.33 143.25 30.05 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.309 -0.87 . . . . 0.0 111.638 -176.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 28.4 mtmm 91.91 107.49 0.03 OUTLIER 'General case' 0 N--CA 1.51 2.555 0 C-N-CA 127.302 2.241 . . . . 0.0 107.403 -172.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.6 m -104.03 68.07 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 CA-C-O 122.784 1.278 . . . . 0.0 110.509 -172.013 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -133.41 70.43 1.46 Allowed 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 105.996 -1.853 . . . . 0.0 105.996 160.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 145.02 151.76 5.48 Favored Glycine 0 CA--C 1.544 1.853 0 C-N-CA 120.43 -0.891 . . . . 0.0 113.182 -141.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 16.7 tt -75.76 133.79 30.51 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.022 0 CA-C-O 121.821 0.82 . . . . 0.0 110.507 174.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.2 p -131.93 61.96 1.64 Allowed 'General case' 0 N--CA 1.503 2.183 0 CA-C-O 121.952 0.882 . . . . 0.0 110.198 177.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -145.06 70.85 1.28 Allowed 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 165.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.56 104.71 1.41 Allowed Glycine 0 CA--C 1.553 2.456 0 CA-C-O 116.519 -2.267 . . . . 0.0 111.768 -132.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -69.18 148.66 69.35 Favored 'Trans proline' 0 CA--C 1.56 1.786 0 CA-C-N 123.207 3.503 . . . . 0.0 114.429 -178.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -62.51 -35.61 79.94 Favored 'General case' 0 CA--C 1.576 1.978 0 CA-C-N 113.193 -1.821 . . . . 0.0 115.721 -178.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 65.19 -15.3 0.1 Allowed 'General case' 0 N--CA 1.509 2.522 0 N-CA-C 118.026 2.602 . . . . 0.0 118.026 164.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 45.6 t -54.32 -49.92 87.81 Favored Pre-proline 0 CA--C 1.584 2.288 0 CA-C-N 122.589 2.45 . . . . 0.0 115.827 -178.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -75.21 -8.58 19.95 Favored 'Trans proline' 0 CA--C 1.573 2.449 0 CA-C-N 125.995 3.177 . . . . 0.0 117.586 169.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 97.5 p -60.92 -43.15 99.0 Favored 'General case' 0 CA--C 1.567 1.614 0 N-CA-C 116.225 1.935 . . . . 0.0 116.225 -169.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.88 -38.0 89.5 Favored 'General case' 0 CA--C 1.571 1.785 0 N-CA-C 115.372 1.619 . . . . 0.0 115.372 171.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -63.92 -44.11 93.89 Favored 'General case' 0 CA--C 1.573 1.829 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 166.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 13.5 tp -58.17 -45.63 87.15 Favored 'General case' 0 CA--C 1.567 1.633 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 169.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -67.39 -39.59 85.62 Favored 'General case' 0 CA--C 1.562 1.433 0 N-CA-C 114.738 1.384 . . . . 0.0 114.738 173.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.9 ttp85 -49.4 -43.05 44.04 Favored 'General case' 0 CA--C 1.581 2.141 0 CA-C-N 121.484 1.947 . . . . 0.0 114.547 163.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 93.1 mt -67.97 -46.42 71.43 Favored 'General case' 0 CA--C 1.569 1.686 0 CA-C-O 117.594 -1.193 . . . . 0.0 113.642 168.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.6 mttm -66.14 -39.42 89.83 Favored 'General case' 0 N--CA 1.502 2.149 0 CA-C-N 121.8 2.091 . . . . 0.0 114.48 178.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -61.45 -33.59 74.0 Favored 'General case' 0 CA--C 1.571 1.773 0 N-CA-C 114.819 1.414 . . . . 0.0 114.819 169.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.11 -45.91 65.93 Favored 'General case' 0 CA--C 1.572 1.804 0 N-CA-C 115.056 1.502 . . . . 0.0 115.056 163.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 14.8 m-30 -69.98 -23.74 63.21 Favored 'General case' 0 CA--C 1.565 1.557 0 N-CA-C 116.413 2.005 . . . . 0.0 116.413 -178.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -72.72 73.28 1.08 Allowed 'General case' 0 CA--C 1.577 2.008 0 CA-C-N 121.445 1.929 . . . . 0.0 110.296 166.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.66 -55.76 0.03 OUTLIER 'General case' 0 CA--C 1.564 1.506 0 C-N-CA 125.757 1.623 . . . . 0.0 108.194 -169.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 24.7 p90 -75.32 -32.29 60.88 Favored 'General case' 0 CA--C 1.578 2.054 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 162.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 23.3 m -106.58 130.81 22.36 Favored Pre-proline 0 CA--C 1.576 1.958 0 CA-C-N 120.469 1.486 . . . . 0.0 108.458 170.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_exo -56.06 -35.1 94.31 Favored 'Trans proline' 0 CA--C 1.568 2.219 0 C-N-CA 122.985 2.457 . . . . 0.0 118.438 176.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 . . . . . 0 N--CA 1.488 1.447 0 CA-C-O 124.736 2.207 . . . . 0.0 107.802 169.393 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 42.2 t . . . . . 0 CA--C 1.559 1.321 0 CA-C-O 121.164 0.506 . . . . 0.0 109.991 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.26 31.04 5.43 Favored 'General case' 0 CA--C 1.574 1.891 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 -177.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -74.36 100.93 3.92 Favored 'General case' 0 CA--C 1.569 1.693 0 O-C-N 120.333 -1.48 . . . . 0.0 111.359 -174.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.8 m 42.91 47.54 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.516 2.845 0 C-N-CA 125.558 1.543 . . . . 0.0 114.56 -166.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -165.86 77.6 0.25 Allowed 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 179.659 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -78.66 -87.39 0.48 Allowed Glycine 0 N--CA 1.488 2.111 0 N-CA-C 116.495 1.358 . . . . 0.0 116.495 -155.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 44.7 mt -89.8 87.7 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.072 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 -177.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 76.7 p -118.92 85.12 2.31 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 -172.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -155.32 66.52 0.64 Allowed 'General case' 0 CA--C 1.566 1.574 0 N-CA-C 105.342 -2.095 . . . . 0.0 105.342 160.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.82 94.34 0.89 Allowed Glycine 0 CA--C 1.557 2.668 0 CA-C-O 116.957 -2.024 . . . . 0.0 113.787 -137.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_exo -56.56 105.26 0.16 Allowed 'Trans proline' 0 CA--C 1.56 1.792 0 CA-C-N 122.272 3.036 . . . . 0.0 114.889 175.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -72.4 -33.64 67.3 Favored 'General case' 0 N--CA 1.499 2.014 0 N-CA-C 116.357 1.984 . . . . 0.0 116.357 -171.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -80.67 -39.38 27.36 Favored 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 115.093 1.516 . . . . 0.0 115.093 -169.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 30.1 t -57.3 -51.63 80.22 Favored Pre-proline 0 CA--C 1.584 2.265 0 CA-C-O 115.425 -2.226 . . . . 0.0 114.282 171.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -64.71 -47.12 5.69 Favored 'Trans proline' 0 CA--C 1.562 1.919 0 CA-C-N 125.718 3.078 . . . . 0.0 114.949 169.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 76.1 p -65.06 -34.19 77.83 Favored 'General case' 0 CA--C 1.573 1.863 0 CA-C-N 122.77 2.532 . . . . 0.0 115.678 -178.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.0 -42.95 84.14 Favored 'General case' 0 CA--C 1.571 1.776 0 CA-C-N 120.841 1.655 . . . . 0.0 114.877 164.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -67.28 -40.17 86.09 Favored 'General case' 0 CA--C 1.573 1.855 0 CA-C-N 120.44 1.473 . . . . 0.0 114.6 173.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.0 mp -56.12 -39.17 71.81 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 165.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.99 -34.12 61.95 Favored 'General case' 0 CA--C 1.569 1.706 0 CA-C-N 120.885 1.675 . . . . 0.0 115.213 172.562 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 74.8 ttt-85 -53.08 -44.35 67.47 Favored 'General case' 0 CA--C 1.578 2.053 0 CA-C-N 120.568 1.531 . . . . 0.0 114.243 159.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 94.7 mt -70.31 -39.97 74.47 Favored 'General case' 0 CA--C 1.569 1.699 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 171.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 61.0 tttm -69.05 -41.77 77.18 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-N 120.779 1.627 . . . . 0.0 114.227 -174.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -62.54 -31.19 71.94 Favored 'General case' 0 CA--C 1.58 2.115 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 168.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.24 -41.82 39.68 Favored 'General case' 0 CA--C 1.573 1.83 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 168.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 22.4 m-30 -57.91 -39.73 78.67 Favored 'General case' 0 CA--C 1.577 2.017 0 CA-C-N 121.451 1.932 . . . . 0.0 114.717 170.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 30.5 ttp180 -50.11 -38.31 38.18 Favored 'General case' 0 CA--C 1.579 2.087 0 N-CA-C 116.029 1.862 . . . . 0.0 116.029 157.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.6 tpm_? -76.34 -42.11 46.0 Favored 'General case' 0 CA--C 1.572 1.819 0 CA-C-N 121.424 1.92 . . . . 0.0 113.999 172.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -68.22 -18.59 64.61 Favored 'General case' 0 N--CA 1.503 2.21 0 N-CA-C 114.801 1.408 . . . . 0.0 114.801 174.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 17.8 m -69.28 124.8 91.21 Favored Pre-proline 0 CA--C 1.583 2.22 0 C-N-CA 123.88 0.872 . . . . 0.0 108.858 159.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -76.55 -22.57 12.09 Favored 'Trans proline' 0 CA--C 1.567 2.169 0 N-CA-C 117.925 2.24 . . . . 0.0 117.925 -162.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 124.597 2.141 . . . . 0.0 112.302 -160.433 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 53.3 t . . . . . 0 CA--C 1.564 1.483 0 CA-C-O 118.134 -0.936 . . . . 0.0 108.81 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -145.37 89.85 1.97 Allowed 'General case' 0 CA--C 1.571 1.765 0 CA-C-N 120.304 1.411 . . . . 0.0 110.272 175.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 42.3 tptt -141.0 127.87 20.46 Favored 'General case' 0 CA--C 1.563 1.477 1 O-C-N 114.76 -4.962 . . . . 0.0 110.213 -22.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.3 p -94.99 84.26 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.569 1.703 0 CA-C-O 123.765 1.745 . . . . 0.0 108.014 179.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.91 78.71 1.49 Allowed 'General case' 0 CA--C 1.567 1.602 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 168.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -128.71 112.0 1.33 Allowed Glycine 0 N--CA 1.483 1.774 0 O-C-N 121.023 -1.048 . . . . 0.0 114.587 -145.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 90.9 mt -129.95 101.39 6.01 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 N-CA-C 104.805 -2.294 . . . . 0.0 104.805 173.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 99.0 m -155.75 -62.63 0.11 Allowed 'General case' 0 N--CA 1.504 2.239 0 O-C-N 120.308 -1.495 . . . . 0.0 110.898 -177.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -141.11 63.49 1.44 Allowed 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 106.216 -1.772 . . . . 0.0 106.216 174.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 65.64 -171.87 24.88 Favored Glycine 0 CA--C 1.57 3.493 0 N-CA-C 116.571 1.389 . . . . 0.0 116.571 -135.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -63.06 84.5 0.11 Allowed 'Trans proline' 0 CA--C 1.568 2.217 0 C-N-CA 123.641 2.894 . . . . 0.0 115.044 164.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -92.61 28.48 2.0 Allowed 'General case' 0 CA--C 1.579 2.06 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 -165.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -167.26 146.08 5.03 Favored 'General case' 0 CA--C 1.566 1.569 0 O-C-N 120.385 -1.447 . . . . 0.0 110.928 -172.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 30.4 t -121.82 -69.2 0.02 OUTLIER Pre-proline 0 CA--C 1.572 1.827 0 CA-C-O 115.419 -2.229 . . . . 0.0 107.35 144.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo -81.36 19.62 1.15 Allowed 'Trans proline' 0 CA--C 1.58 2.795 0 CA-C-N 126.034 3.191 . . . . 0.0 117.167 169.129 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 59.6 p 66.64 -110.21 0.15 Allowed 'General case' 0 N--CA 1.498 1.97 0 C-N-CA 126.456 1.902 . . . . 0.0 109.155 -157.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . 62.13 -60.19 0.12 Allowed 'General case' 0 N--CA 1.508 2.435 0 N-CA-C 116.532 2.049 . . . . 0.0 116.532 169.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -65.69 -48.35 72.35 Favored 'General case' 0 N--CA 1.496 1.861 0 CA-C-N 120.5 1.5 . . . . 0.0 112.894 158.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 16.3 tp -50.68 -44.35 57.8 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 164.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -66.91 -39.81 87.52 Favored 'General case' 0 CA--C 1.564 1.502 0 N-CA-C 115.791 1.774 . . . . 0.0 115.791 173.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 78.9 mtt85 -54.04 -44.06 70.69 Favored 'General case' 0 CA--C 1.573 1.857 0 CA-C-N 121.571 1.987 . . . . 0.0 114.145 163.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 98.4 mt -64.42 -40.08 95.08 Favored 'General case' 0 CA--C 1.569 1.686 0 CA-C-O 117.222 -1.37 . . . . 0.0 113.726 169.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -66.01 -38.07 87.53 Favored 'General case' 0 N--CA 1.502 2.147 0 CA-C-N 122.159 2.254 . . . . 0.0 113.952 173.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -64.65 -38.18 90.11 Favored 'General case' 0 CA--C 1.577 2.011 0 N-CA-C 113.971 1.1 . . . . 0.0 113.971 170.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.93 -42.69 84.9 Favored 'General case' 0 CA--C 1.571 1.767 0 N-CA-C 115.885 1.809 . . . . 0.0 115.885 165.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 15.8 m-30 -75.26 -29.62 60.24 Favored 'General case' 0 CA--C 1.568 1.672 0 CA-C-N 120.5 1.5 . . . . 0.0 114.693 179.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -72.47 61.09 0.48 Allowed 'General case' 0 CA--C 1.581 2.168 0 CA-C-N 120.873 1.67 . . . . 0.0 112.394 165.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 94.4 mtt180 -158.27 -55.34 0.07 Allowed 'General case' 0 CA--C 1.567 1.632 0 C-N-CA 125.909 1.684 . . . . 0.0 109.608 -173.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 22.4 p90 -64.43 -35.28 80.41 Favored 'General case' 0 N--CA 1.502 2.147 0 N-CA-C 115.188 1.551 . . . . 0.0 115.188 -176.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.1 t -110.46 104.47 55.92 Favored Pre-proline 0 CA--C 1.57 1.733 0 CA-C-N 120.315 1.416 . . . . 0.0 107.695 160.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_exo -52.01 -43.12 54.63 Favored 'Trans proline' 0 CA--C 1.567 2.144 0 C-N-CA 123.097 2.531 . . . . 0.0 116.065 168.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 . . . . . 0 N--CA 1.489 1.509 0 CA-C-O 125.466 2.555 . . . . 0.0 111.719 170.029 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 50.7 t . . . . . 0 CA--C 1.563 1.474 0 CA-C-O 118.325 -0.845 . . . . 0.0 108.855 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -92.62 76.14 5.02 Favored 'General case' 0 CA--C 1.566 1.558 0 CA-C-N 120.792 1.633 . . . . 0.0 111.636 176.256 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -163.16 104.34 0.99 Allowed 'General case' 0 CA--C 1.568 1.637 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 174.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.0 p 44.42 70.72 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.473 0 C-N-CA 127.078 2.151 . . . . 0.0 116.525 170.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.42 72.37 0.47 Allowed 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 155.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -176.23 94.05 0.1 OUTLIER Glycine 0 N--CA 1.48 1.583 0 O-C-N 121.318 -0.864 . . . . 0.0 114.083 -158.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 42.1 mm -77.94 129.57 37.3 Favored 'Isoleucine or valine' 0 CA--C 1.576 1.964 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 175.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 56.3 m -73.73 107.57 6.06 Favored 'General case' 0 CA--C 1.572 1.819 0 O-C-N 121.563 -0.711 . . . . 0.0 112.366 -163.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 50.54 75.87 0.17 Allowed 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 116.311 1.967 . . . . 0.0 116.311 173.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -159.54 68.44 0.26 Allowed Glycine 0 CA--C 1.548 2.101 1 O-C-N 115.589 -4.444 . . . . 0.0 115.516 -36.048 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -79.38 67.62 8.54 Favored 'Trans proline' 0 CA--C 1.571 2.375 0 CA-C-N 122.517 3.158 . . . . 0.0 114.321 174.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -92.72 65.8 4.31 Favored 'General case' 0 CA--C 1.57 1.731 0 O-C-N 121.125 -0.985 . . . . 0.0 110.348 179.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 50.16 54.08 11.72 Favored 'General case' 0 N--CA 1.507 2.397 0 C-N-CA 124.583 1.153 . . . . 0.0 113.879 -162.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 36.1 t -65.64 -51.36 50.49 Favored Pre-proline 0 CA--C 1.579 2.068 0 CA-C-O 115.601 -2.143 . . . . 0.0 113.344 175.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -65.85 -22.51 56.27 Favored 'Trans proline' 0 CA--C 1.575 2.564 0 CA-C-N 125.667 3.06 . . . . 0.0 116.63 161.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.7 m 66.3 -89.14 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 125.826 1.65 . . . . 0.0 111.935 171.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . 58.54 -72.55 0.02 OUTLIER 'General case' 0 N--CA 1.499 1.98 0 C-N-CA 126.655 1.982 . . . . 0.0 115.498 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -63.23 -47.11 83.87 Favored 'General case' 0 N--CA 1.497 1.878 0 CA-C-N 120.776 1.625 . . . . 0.0 113.124 165.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.95 -42.35 68.79 Favored 'General case' 0 N--CA 1.496 1.872 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 165.292 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -66.67 -45.85 77.6 Favored 'General case' 0 CA--C 1.563 1.474 0 N-CA-C 114.83 1.419 . . . . 0.0 114.83 174.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.97 -38.62 57.29 Favored 'General case' 0 CA--C 1.576 1.96 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 167.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 82.7 mt -70.88 -41.93 70.7 Favored 'General case' 0 CA--C 1.571 1.785 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 166.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 34.8 ttpt -64.79 -44.58 89.51 Favored 'General case' 0 N--CA 1.494 1.744 0 CA-C-N 121.092 1.769 . . . . 0.0 114.34 -177.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -62.5 -35.86 80.7 Favored 'General case' 0 CA--C 1.575 1.905 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 173.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.12 -56.04 22.8 Favored 'General case' 0 CA--C 1.57 1.748 0 N-CA-C 113.982 1.105 . . . . 0.0 113.982 164.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -57.66 -41.28 81.17 Favored 'General case' 0 CA--C 1.571 1.757 0 CA-C-N 120.641 1.564 . . . . 0.0 115.192 176.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.7 tpm_? -64.89 -35.0 79.72 Favored 'General case' 0 CA--C 1.574 1.883 0 CA-C-N 120.453 1.479 . . . . 0.0 114.607 169.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.8 ttt180 -61.71 -38.42 87.79 Favored 'General case' 0 CA--C 1.573 1.834 0 CA-C-N 121.632 2.014 . . . . 0.0 114.409 169.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -102.14 10.88 39.08 Favored 'General case' 0 N--CA 1.501 2.102 0 N-CA-C 114.741 1.386 . . . . 0.0 114.741 -177.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 78.7 m -99.24 130.17 27.75 Favored Pre-proline 0 CA--C 1.574 1.899 0 CA-C-N 119.992 1.269 . . . . 0.0 108.011 172.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_endo -74.3 -22.61 16.28 Favored 'Trans proline' 0 CA--C 1.569 2.253 0 C-N-CA 122.58 2.186 . . . . 0.0 117.136 -177.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 125.023 2.344 . . . . 0.0 110.797 -173.518 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 99.9 m . . . . . 0 CA--C 1.56 1.331 0 CA-C-O 120.809 0.338 . . . . 0.0 110.202 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -89.68 37.5 0.88 Allowed 'General case' 0 CA--C 1.576 1.945 0 N-CA-C 115.347 1.61 . . . . 0.0 115.347 175.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.2 tptt -162.94 -59.62 0.04 OUTLIER 'General case' 0 CA--C 1.567 1.609 0 O-C-N 120.696 -1.253 . . . . 0.0 110.43 174.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 48.9 t -93.43 70.39 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.575 1.914 0 CA-C-O 122.746 1.26 . . . . 0.0 108.759 -177.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.2 pttm -157.05 44.29 0.37 Allowed 'General case' 0 CA--C 1.575 1.906 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 149.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 72.84 50.3 14.3 Favored Glycine 0 CA--C 1.55 2.273 0 N-CA-C 120.766 3.066 . . . . 0.0 120.766 -165.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 72.6 mt -131.47 113.11 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 176.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 36.6 p -105.42 -80.42 0.55 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 120.906 -1.121 . . . . 0.0 108.497 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 34.4 tp60 -150.42 82.18 1.36 Allowed 'General case' 0 CA--C 1.552 1.044 0 CA-C-N 120.967 1.712 . . . . 0.0 110.469 178.179 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -95.01 -70.22 1.08 Allowed Glycine 0 N--CA 1.496 2.694 1 O-C-N 115.545 -4.472 . . . . 0.0 116.652 -24.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -77.15 91.32 1.18 Allowed 'Trans proline' 0 CA--C 1.566 2.121 0 CA-C-N 122.726 3.263 . . . . 0.0 114.278 -167.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -76.3 -45.61 31.66 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 114.667 1.358 . . . . 0.0 114.667 -174.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -84.07 7.89 17.2 Favored 'General case' 0 CA--C 1.574 1.896 0 N-CA-C 117.461 2.393 . . . . 0.0 117.461 -168.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 38.8 t -87.15 -56.06 0.34 Allowed Pre-proline 0 CA--C 1.579 2.063 0 CA-C-O 115.326 -2.274 . . . . 0.0 111.688 162.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -68.3 -41.85 6.34 Favored 'Trans proline' 0 CA--C 1.572 2.378 0 CA-C-N 126.089 3.21 . . . . 0.0 116.174 173.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.2 t -104.44 174.06 6.04 Favored 'General case' 0 CA--C 1.568 1.663 0 CA-C-N 119.499 1.045 . . . . 0.0 111.668 167.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . 65.01 -48.88 0.35 Allowed 'General case' 0 N--CA 1.508 2.45 0 N-CA-C 115.869 1.803 . . . . 0.0 115.869 175.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -57.58 -46.5 83.92 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 119.459 -2.025 . . . . 0.0 113.597 154.037 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 36.8 tp -50.67 -44.28 57.63 Favored 'General case' 0 CA--C 1.574 1.885 0 N-CA-C 115.203 1.557 . . . . 0.0 115.203 166.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -75.31 -34.59 61.27 Favored 'General case' 0 CA--C 1.567 1.613 0 N-CA-C 114.965 1.469 . . . . 0.0 114.965 174.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 58.4 mtm180 -55.17 -43.74 74.58 Favored 'General case' 0 CA--C 1.577 1.989 0 CA-C-N 121.458 1.935 . . . . 0.0 113.776 163.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.1 mt -65.18 -36.75 85.19 Favored 'General case' 0 CA--C 1.575 1.905 0 N-CA-C 114.775 1.398 . . . . 0.0 114.775 166.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 18.9 ttmm -69.15 -41.01 77.84 Favored 'General case' 0 N--CA 1.494 1.767 0 CA-C-N 120.101 1.319 . . . . 0.0 113.889 177.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.4 mm-40 -58.23 -45.93 86.81 Favored 'General case' 0 CA--C 1.565 1.542 0 CA-C-N 119.779 1.172 . . . . 0.0 114.03 164.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.88 -52.85 63.8 Favored 'General case' 0 CA--C 1.571 1.761 0 N-CA-C 114.491 1.293 . . . . 0.0 114.491 172.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -65.06 -34.99 79.73 Favored 'General case' 0 CA--C 1.572 1.809 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 172.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -68.36 -42.81 78.66 Favored 'General case' 0 N--CA 1.494 1.747 0 CA-C-N 121.198 1.817 . . . . 0.0 114.511 173.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 92.3 mtt180 -67.83 -41.85 82.4 Favored 'General case' 0 CA--C 1.575 1.912 0 CA-C-N 120.789 1.632 . . . . 0.0 113.992 167.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -129.38 74.48 1.59 Allowed 'General case' 0 CA--C 1.568 1.662 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 -166.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 2.7 m -91.54 112.23 53.26 Favored Pre-proline 0 CA--C 1.573 1.839 0 O-C-N 120.714 -1.241 . . . . 0.0 108.128 -170.269 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -89.7 61.77 2.09 Favored 'Trans proline' 0 CA--C 1.571 2.352 0 CA-C-N 122.756 2.02 . . . . 0.0 115.2 -158.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 124.856 2.265 . . . . 0.0 108.561 -171.722 . . . . . . . . 0 0 . 1 stop_ save_